A0A077Z4Q3_TRITR Loading...

Pkinase domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4Q3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 363 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	35.6	Very low	29.1	Very low	241 Å²	241	160.7 Å²	160.7	100%	1.187	84%	0.843	S	S	*	*				0	112.2	0	-71.7	177.9	178.1	0	0	107.3	E3	M1-E3 PolarHBondContact O-N 3.14Å
2	T	32.6	Very low	28.9	Very low	136 Å²	136	160.6 Å²	160.6	83%	0.834	84%	0.843	S	S	*	*			trans	-83.1	100.6	-175.8	44.4	0	0	0	0	109.7	K4	T2-K4 PolarHBondContact O-N 3.5Å
3	E	28.9	Very low	28.7	Very low	193 Å²	193	156.2 Å²	156.2	90%	0.902	83%	0.833	S	S	*	*			trans	-68.4	98	171.3	-76.5	-178.7	156.7	0	0	109.5	M1 L5	M1-E3 PolarHBondContact O-N 3.14Å; E3-L5 PolarHBondContact O-N 3.39Å
4	K	28.2	Very low	28.4	Very low	192 Å²	192	159.5 Å²	159.5	84%	0.835	84%	0.837	S	S	*	*			trans	-77.9	114.1	165.8	-78.8	-177.7	175.8	179.2	0	107.8	T2	T2-K4 PolarHBondContact O-N 3.5Å
5	L	27	Very low	28.4	Very low	169 Å²	169	156.3 Å²	156.3	89%	0.885	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-58	125.2	165.2	-87.1	148.5	0	0	0	109.3	E3	E3-L5 PolarHBondContact O-N 3.39Å
6	P	29	Very low	28.1	Very low	106 Å²	106	154.1 Å²	154.1	69%	0.688	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.2	153.2	-176.4	28.8	-32.5	0	0	0	112.2
7	P	29.6	Very low	28.1	Very low	110 Å²	110	151.8 Å²	151.8	71%	0.714	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-75.1	127.1	175.2	30.5	-29.8	0	0	0	109.8	D9	P7-D9 VanDerWaalsContact C-N 3.34Å; P7-D9 PolarHBondContact O-N 3.43Å
8	E	29.9	Very low	27.9	Very low	195 Å²	195	155.4 Å²	155.4	91%	0.911	83%	0.83	S	S	*	*			trans	-70.6	89.5	172.1	-78.1	-175.2	154	0	0	110.3	A10	E8-A10 VanDerWaalsContact C-N 3.3Å; E8-A10 PolarHBondContact O-N 3.13Å; E8-A10 VanDerWaalsContact O-N 3.13Å
9	D	26.8	Very low	27.9	Very low	144 Å²	144	153.8 Å²	153.8	77%	0.77	83%	0.826	S	S	*	*			trans	-75	80	161.3	-82.4	-36.4	0	0	0	109.7	P7 K11	P7-D9 VanDerWaalsContact C-N 3.34Å; P7-D9 PolarHBondContact O-N 3.43Å; D9-K11 VanDerWaalsContact C-N 3.31Å; D9-K11 PolarHBondContact O-N 3.26Å; D9-K11 VanDerWaalsContact O-N 3.08Å
10	A	27.6	Very low	27.7	Very low	83 Å²	83	150.9 Å²	150.9	69%	0.686	82%	0.818	S	S	*	*			trans	-80.8	82.7	165.9	0	0	0	0	0	109.8	E8 L12	E8-A10 VanDerWaalsContact C-N 3.3Å; E8-A10 PolarHBondContact O-N 3.13Å; E8-A10 VanDerWaalsContact O-N 3.13Å; A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 2.63Å
11	K	24.9	Very low	27.5	Very low	199 Å²	199	149.5 Å²	149.5	87%	0.865	82%	0.819	S	S	*	*			trans	-61.6	91	160	-77.5	179.3	177.9	174.3	0	109	D9	D9-K11 VanDerWaalsContact C-N 3.31Å; D9-K11 PolarHBondContact O-N 3.26Å; D9-K11 VanDerWaalsContact O-N 3.08Å
12	L	26.9	Very low	27	Very low	159 Å²	159	143.3 Å²	143.3	83%	0.832	80%	0.795	S	S	*	*			trans	-92.7	104.8	160.2	-102.6	107	0	0	0	109.5	A10 K14	A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 2.63Å; L12-K14 PolarHBondContact O-N 3.38Å
13	S	26.5	Very low	26.7	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-51.2	128.5	165.4	48.5	0	0	0	0	111.2	P15	S13-P15 VanDerWaalsContact O-CD 3.32Å; S13-P15 WeakPolarHBondContact O-CD 3.4Å
14	K	24.5	Very low	26.5	Very low	203 Å²	203	144 Å²	144	88%	0.883	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62	121.8	172.3	-70.3	176.2	176.1	176.8	0	110.7	L12	L12-K14 PolarHBondContact O-N 3.38Å
15	P	27.9	Very low	26.5	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.6	118.5	155.2	10.7	8.6	0	0	0	108.1	S13 T17	S13-P15 VanDerWaalsContact O-CD 3.32Å; S13-P15 WeakPolarHBondContact O-CD 3.4Å; P15-T17 PolarHBondContact O-N 2.93Å; P15-T17 VanDerWaalsContact O-N 3.15Å
16	S	23.8	Very low	26.6	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	77%	0.767	S	S	*	*			trans	-70.6	98.1	168.3	52.7	0	0	0	0	109.5
17	T	28.5	Very low	26.6	Very low	115 Å²	115	133.9 Å²	133.9	71%	0.706	76%	0.761	S	S	*	*			trans	-131.7	112.5	165.2	19.3	0	0	0	0	109.3	P15 V19	P15-T17 PolarHBondContact O-N 2.93Å; P15-T17 VanDerWaalsContact O-N 3.15Å; T17-V19 PolarHBondContact O-N 3.27Å; T17-V19 VanDerWaalsContact O-N 3.1Å
18	K	24.1	Very low	26.5	Very low	218 Å²	218	134.2 Å²	134.2	95%	0.948	76%	0.761	S	S	*	*			trans	-53.6	109	165.8	-72.9	175	174.3	176.8	0	107.9
19	V	27	Very low	26.4	Very low	125 Å²	125	131.2 Å²	131.2	76%	0.758	75%	0.747	S	S	*	*			trans	-118.4	118	163.2	-178	0	0	0	0	107	T17	T17-V19 PolarHBondContact O-N 3.27Å; T17-V19 VanDerWaalsContact O-N 3.1Å
20	S	25	Very low	26.4	Very low	95 Å²	95	132.3 Å²	132.3	66%	0.664	75%	0.745	S	S	*	*			trans	-52.9	137	179.9	54.2	0	0	0	0	111.5	T22	S20-T22 PolarHBondContact O-N 3.49Å; S20-T22 PolarHBondContact O-OG1 2.92Å
21	S	23.8	Very low	26.3	Very low	121 Å²	121	136.5 Å²	136.5	85%	0.846	75%	0.748	S	S	*	*			trans	-48.2	97.2	167.8	53.7	0	0	0	0	110.8
22	T	24.9	Very low	26.4	Very low	112 Å²	112	132.4 Å²	132.4	69%	0.687	74%	0.735	S	S	*	*			trans	-88	111.8	168.1	-41.8	0	0	0	0	105.6	S20 V24	S20-T22 PolarHBondContact O-N 3.49Å; S20-T22 PolarHBondContact O-OG1 2.92Å; T22-V24 PolarHBondContact O-N 2.82Å
23	K	26.3	Very low	26.4	Very low	202 Å²	202	128.3 Å²	128.3	88%	0.878	71%	0.714	S	S	*	*			trans	-50.5	104.2	175.2	-74.2	176	174.7	176.5	0	108.5	S25	K23-S25 PolarHBondContact O-N 3.49Å
24	V	24.4	Very low	26.4	Very low	140 Å²	140	126.4 Å²	126.4	85%	0.848	70%	0.704	S	S	*	*			trans	-69.7	106.9	170	178.1	0	0	0	0	106.2	T22	T22-V24 PolarHBondContact O-N 2.82Å
25	S	27.5	Very low	26.7	Very low	78 Å²	78	122.6 Å²	122.6	55%	0.545	70%	0.698	S	S	.	*			trans	-52.5	137.5	-176.3	-178.1	0	0	0	0	112.3	K23 T27	K23-S25 PolarHBondContact O-N 3.49Å; S25-T27 PolarHBondContact O-N 2.99Å; S25-T27 PolarHBondContact OG-OG1 3.37Å
26	S	30	Very low	27	Very low	85 Å²	85	119.6 Å²	119.6	59%	0.594	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	18.4	-175.6	52.5	0	0	0	0	116
27	T	29.4	Very low	27.3	Very low	92 Å²	92	119.6 Å²	119.6	56%	0.564	68%	0.681	S	S	*	*	H	α-helix	trans	-86.2	-27.9	-174.7	-35.8	0	0	0	0	112.8	S25	S25-T27 PolarHBondContact O-N 2.99Å; S25-T27 PolarHBondContact OG-OG1 3.37Å
28	V	27.3	Very low	27.5	Very low	117 Å²	117	116.8 Å²	116.8	71%	0.709	68%	0.675	S	S	*	*	H	α-helix	trans	-75.7	-37.4	-179	-176.4	0	0	0	0	111.6	K31	V28-K31 PolarHBondContact O-N 2.86Å
29	E	27.6	Very low	27.8	Very low	133 Å²	133	113.6 Å²	113.6	62%	0.621	66%	0.664	S	S	*	*	H	α-helix	trans	-66.9	-39.4	179.5	-77.5	-178.3	157	0	0	112.7	K31 L32	E29-K31 VanDerWaalsContact C-N 3.27Å; E29-K31 PolarHBondContact O-N 2.79Å; E29-L32 PolarHBondContact O-N 3.32Å
30	K	26.1	Very low	28.1	Very low	167 Å²	167	110.9 Å²	110.9	73%	0.726	65%	0.649	S	S	*	*	H	α-helix	trans	-66.7	-27.3	176.8	-79.3	-172.2	174.5	-175.6	0	113.2	A34	K30-A34 PolarHBondContact O-N 2.75Å
31	K	26.6	Very low	28.9	Very low	170 Å²	170	109 Å²	109	74%	0.739	63%	0.634	S	S	*	*	H	α-helix	trans	-74.7	-26	-178.8	-111.5	-178	178.9	-179.3	0	113.6	V28 E29	V28-K31 PolarHBondContact O-N 2.86Å; E29-K31 VanDerWaalsContact C-N 3.27Å; E29-K31 PolarHBondContact O-N 2.79Å
32	L	26.9	Very low	29.6	Very low	113 Å²	113	106.3 Å²	106.3	59%	0.592	63%	0.626	S	S	*	*	H	α-helix	trans	-77.3	-31.2	178.2	-147.3	79.9	0	0	0	112.2	E29 T35	E29-L32 PolarHBondContact O-N 3.32Å; L32-T35 PolarHBondContact O-OG1 3.15Å
33	L	26.9	Very low	30.2	Very low	74 Å²	74	111 Å²	111	39%	0.387	64%	0.637	S	S	.	*	H	α-helix	trans	-77.2	-27.8	177.3	-85.6	148.8	0	0	0	113.2	T35 L94	L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 3.24Å; L33-L94 HydrophobicContact CD2-CD1 4.33Å
34	A	26.3	Very low	31	Very low	62 Å²	62	102.7 Å²	102.7	51%	0.512	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-71.2	-13	-173.7	0	0	0	0	0	115	K30 A36	K30-A34 PolarHBondContact O-N 2.75Å; A34-A36 VanDerWaalsContact C-N 3.33Å; A34-A36 PolarHBondContact O-N 3.41Å
35	T	31.2	Very low	32.1	Very low	124 Å²	124	97.8 Å²	97.8	76%	0.761	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-82.6	-3.2	-179.6	29.9	0	0	0	0	115	L32 L33	L32-T35 PolarHBondContact O-OG1 3.15Å; L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 3.24Å
36	A	33.4	Very low	33.1	Very low	48 Å²	48	103.7 Å²	103.7	40%	0.397	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-114.6	22.2	-177.5	0	0	0	0	0	114.2	A34 G38 I130	A34-A36 VanDerWaalsContact C-N 3.33Å; A34-A36 PolarHBondContact O-N 3.41Å; A36-G38 PolarHBondContact O-N 2.68Å; A36-I130 HydrophobicContact CB-CG2 4.41Å
37	C	29.5	Very low	34.1	Very low	120 Å²	120	103.8 Å²	103.8	81%	0.811	60%	0.598	S	S	*	*			trans	-74.8	66.2	178.5	-64.8	0	0	0	0	112.4
38	G	32.5	Very low	35.4	Very low	57 Å²	57	100 Å²	100	59%	0.588	58%	0.575	S	S	*	*	S	Bend	trans	-94.8	152.7	152.2	0	0	0	0	0	109.2	A36	A36-G38 PolarHBondContact O-N 2.68Å
39	E	31.7	Very low	36.7	Very low	151 Å²	151	98 Å²	98	71%	0.706	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-46.8	145.4	171.2	-74.1	169.8	139.7	0	0	111.7	K205	E39-K205 IonicContact OE2-NZ 3.15Å; E39-K205 PolarHBondContact OE2-NZ 3.2Å
40	P	33.4	Very low	38.1	Very low	68 Å²	68	92.1 Å²	92.1	44%	0.442	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-57.4	133.5	-177.3	22.8	-32	0	0	0	110.2	G42 K95 L96	P40-G42 PolarHBondContact O-N 2.89Å; P40-K95 HydrophobicContact CB-CB 4.04Å; P40-K95 VanDerWaalsContact CB-O 3.3Å; P40-K95 WeakPolarHBondContact CB-O 3.37Å; P40-K95 HydrophobicContact CG-CB 4.28Å; P40-L96 HydrophobicContact CB-CD2 3.96Å
41	P	42	Very low	39.4	Very low	54 Å²	54	89.4 Å²	89.4	35%	0.351	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-50.9	133.9	156.1	-13.4	27.5	0	0	0	106.2	L96	P41-L96 HydrophobicContact CG-CD2 4.28Å
42	G	36.7	Very low	40.9	Very low	66 Å²	66	84.6 Å²	84.6	68%	0.68	52%	0.522	S	S	*	.	S	Bend	trans	-47	154.2	177.7	0	0	0	0	0	111.2	P40 G44	P40-G42 PolarHBondContact O-N 2.89Å; G42-G44 PolarHBondContact O-N 3Å
43	K	39.1	Very low	42.4	Very low	211 Å²	211	80.4 Å²	80.4	92%	0.917	50%	0.504	S	S	*	.			trans	-34.6	115.3	-180	-83.9	-175.3	174.4	-177.6	0	110.1
44	G	43.1	Very low	44.1	Very low	27 Å²	27	84.3 Å²	84.3	28%	0.278	52%	0.518	S	S	.	.			trans	-54.5	151.5	176.3	0	0	0	0	0	110.3	G42	G42-G44 PolarHBondContact O-N 3Å
45	P	48	Very low	45.6	Very low	36 Å²	36	90.5 Å²	90.5	23%	0.234	53%	0.533	C	S	.	.			trans	-63.3	157.5	-172.9	29.9	-39.4	0	0	0	112.4	S47 L48 Q88 H360	P45-S47 PolarHBondContact O-N 3.18Å; P45-L48 HydrophobicContact CG-CD2 3.47Å; P45-L48 VanDerWaalsContact CG-CD2 3.47Å; P45-L48 HydrophobicContact CG-CG 4.26Å; P45-Q88 PolarHBondContact O-NE2 2.92Å; P45-H360 WeakPolarHBondContact CD-NE2 3.48Å
46	E	46.4	Very low	46.8	Very low	202 Å²	202	91.7 Å²	91.7	94%	0.944	54%	0.535	S	S	*	.	S	Bend	trans	-62.2	-26.4	-178.1	-68	-175.1	163.9	0	0	113.5
47	S	52.8	Low	48.2	Very low	87 Å²	87	91.1 Å²	91.1	61%	0.608	53%	0.528	S	S	*	.			trans	-145.3	123.4	173.3	60.9	0	0	0	0	112.5	P45	P45-S47 PolarHBondContact O-N 3.18Å
48	L	55.6	Low	49.9	Very low	13 Å²	13	91.6 Å²	91.6	7%	0.068	53%	0.53	C	S	.	.			trans	-90.8	140.8	171	-63.5	171.9	0	0	0	109.3	P45 I78 Q88 I99 H360	P45-L48 HydrophobicContact CG-CD2 3.47Å; P45-L48 VanDerWaalsContact CG-CD2 3.47Å; P45-L48 HydrophobicContact CG-CG 4.26Å; L48-I78 HydrophobicContact CB-CD1 3.85Å; L48-I78 HydrophobicContact CB-CG1 4.1Å; L48-I78 HydrophobicContact CB-CG2 4.47Å; L48-I78 HydrophobicContact CD1-CD1 4.08Å; L48-I78 WeakPolarHBondContact O-CG2 3.4Å; L48-Q88 HydrophobicContact CD1-CB 3.9Å; L48-Q88 VanDerWaalsContact CD1-CD 3.5Å; L48-Q88 HydrophobicContact CD1-CG 3.55Å; L48-Q88 HydrophobicContact CG-CG 4.33Å; L48-I99 HydrophobicContact CD1-CD1 3.56Å; L48-H360 HydrophobicContact CD2-CB 3.29Å
49	V	54.3	Low	52.4	Low	74 Å²	74	90.6 Å²	90.6	45%	0.448	52%	0.52	S	S	.	.			trans	-128.6	121.1	-179.6	-177.9	0	0	0	0	109.5	F51	V49-F51 HydrophobicContact CB-CE2 4.2Å; V49-F51 HydrophobicContact CG1-CD2 3.89Å; V49-F51 HydrophobicContact CG1-CE2 3.71Å; V49-F51 HydrophobicContact CG1-CZ 4.44Å
50	I	57.5	Low	55.1	Low	11 Å²	11	87.5 Å²	87.5	6%	0.056	51%	0.508	C	S	.	.			trans	-98.5	121.3	169.4	-59.3	160.8	0	0	0	110	A53 I78 F81 F86 Y362	I50-A53 HydrophobicContact CB-CB 4.37Å; I50-A53 VanDerWaalsContact O-CB 3.28Å; I50-A53 WeakPolarHBondContact O-CB 3.19Å; I50-A53 PolarHBondContact O-N 2.82Å; I50-I78 HydrophobicContact CB-CG2 3.95Å; I50-I78 HydrophobicContact CD1-CB 3.99Å; I50-I78 HydrophobicContact CD1-CD1 4.41Å; I50-I78 HydrophobicContact CD1-CG2 3.59Å; I50-I78 HydrophobicContact CG1-CB 4.4Å; I50-I78 HydrophobicContact CG1-CG2 3.45Å; I50-I78 VanDerWaalsContact CG1-CG2 3.45Å; I50-F81 HydrophobicContact CB-CE2 3.96Å; I50-F81 HydrophobicContact CB-CZ 4.42Å; I50-F81 HydrophobicContact CG2-CD2 4.33Å; I50-F81 HydrophobicContact CG2-CE2 3.17Å; I50-F81 HydrophobicContact CG2-CZ 3.42Å; I50-F81 VanDerWaalsContact CG2-CZ 3.42Å; I50-F86 HydrophobicContact CD1-CB 3.33Å; I50-F86 HydrophobicContact CD1-CD1 3.75Å; I50-F86 HydrophobicContact CD1-CD2 4.24Å; I50-F86 HydrophobicContact CD1-CG 3.51Å; I50-Y362 WeakPolarHBondContact CG2-O 3.16Å
51	F	53.4	Low	57.9	Low	109 Å²	109	86.3 Å²	86.3	48%	0.478	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	133.2	-177.3	-80.6	-109.3	0	0	0	112.3	V49 A53 F81 Y361	V49-F51 HydrophobicContact CB-CE2 4.2Å; V49-F51 HydrophobicContact CG1-CD2 3.89Å; V49-F51 HydrophobicContact CG1-CE2 3.71Å; V49-F51 HydrophobicContact CG1-CZ 4.44Å; F51-A53 VanDerWaalsContact C-N 3.32Å; F51-F81 VanDerWaalsContact O-CZ 3.29Å; F51-F81 WeakPolarHBondContact O-CZ 3.22Å; F51-Y361 HydrophobicContact CB-CD1 4.46Å; F51-Y361 HydrophobicContact CB-CE1 4.46Å; F51-Y361 AromaticContact CD2-CD1 3.39Å; F51-Y361 HydrophobicContact CD2-CD1 3.39Å; F51-Y361 AromaticContact CD2-CE1 3.02Å; F51-Y361 HydrophobicContact CD2-CE1 3.02Å; F51-Y361 AromaticContact CE2-CD1 3.87Å; F51-Y361 HydrophobicContact CE2-CD1 3.87Å; F51-Y361 AromaticContact CE2-CE1 3.11Å; F51-Y361 HydrophobicContact CE2-CE1 3.11Å; F51-Y361 AromaticContact CE2-CZ 3.81Å; F51-Y361 HydrophobicContact CG-CD1 4.18Å; F51-Y361 AromaticContact CG-CE1 3.79Å; F51-Y361 HydrophobicContact CG-CE1 3.79Å; F51-Y361 AromaticContact CZ-CE1 3.98Å; F51-Y361 HydrophobicContact CZ-CE1 3.98Å
52	G	57.6	Low	60.3	Low	69 Å²	69	83.7 Å²	83.7	71%	0.711	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-2.5	-173.2	0	0	0	0	0	113.7	F81	G52-F81 VanDerWaalsContact O-CE1 3.26Å; G52-F81 WeakPolarHBondContact O-CE1 3.43Å
53	A	59.8	Low	63	Low	25 Å²	25	88 Å²	88	21%	0.207	48%	0.478	C	S	.	.			trans	-70.9	135.6	179.6	0	0	0	0	0	109.6	I50 F51 C80 F81	I50-A53 HydrophobicContact CB-CB 4.37Å; I50-A53 VanDerWaalsContact O-CB 3.28Å; I50-A53 WeakPolarHBondContact O-CB 3.19Å; I50-A53 PolarHBondContact O-N 2.82Å; F51-A53 VanDerWaalsContact C-N 3.32Å; A53-C80 WeakPolarHBondContact CA-O 3.48Å; A53-F81 HydrophobicContact CB-CD2 4.19Å; A53-F81 HydrophobicContact CB-CE2 3.35Å; A53-F81 HydrophobicContact CB-CZ 3.58Å
54	K	61.8	Low	65.6	Low	157 Å²	157	83.2 Å²	83.2	68%	0.683	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-77.5	135.2	169.3	-67.4	-176.7	179.9	-178.1	0	108.3	C80	K54-C80 PolarHBondContact N-O 3.26Å; K54-C80 PolarHBondContact O-N 3.45Å; K54-C80 PolarHBondContact O-SG 3.5Å
55	K	57.4	Low	67.9	Low	192 Å²	192	83.8 Å²	83.8	84%	0.835	47%	0.467	S	S	*	.	S	Bend	trans	-77.3	-29	172.7	-71	-171.5	176	-175.9	0	112
56	N	57.4	Low	70.1	Confident	148 Å²	148	84.3 Å²	84.3	79%	0.791	47%	0.466	S	S	*	.			trans	-94.4	114.1	-174.6	-62.3	-5.7	0	0	0	110.4
57	S	62.2	Low	72.2	Confident	36 Å²	36	79.1 Å²	79.1	25%	0.252	45%	0.445	S	S	.	.			trans	-138.5	165.1	166.6	77.7	0	0	0	0	108.9	G59 R77 Q85	S57-G59 PolarHBondContact O-N 3.3Å; S57-G59 PolarHBondContact OG-O 3.05Å; S57-R77 VanDerWaalsContact CB-NH2 3.31Å; S57-R77 PolarHBondContact OG-NH1 2.91Å; S57-R77 PolarHBondContact OG-NH2 3.23Å; S57-Q85 PolarHBondContact OG-NE2 3.49Å
58	P	66	Low	73.9	Confident	131 Å²	131	75 Å²	75	85%	0.851	42%	0.416	S	S	*	.	S	Bend	trans	-70.1	19.6	-171.4	26.4	-34.5	0	0	0	115.9
59	G	83.6	Confident	75.2	Confident	36 Å²	36	78.1 Å²	78.1	37%	0.371	43%	0.427	S	S	.	.	S	Bend	trans	131.1	160.5	-174.3	0	0	0	0	0	111.9	S57 Q85	S57-G59 PolarHBondContact O-N 3.3Å; S57-G59 PolarHBondContact OG-O 3.05Å; G59-Q85 PolarHBondContact O-NE2 3.32Å
60	D	89.9	Confident	76.4	Confident	86 Å²	86	82.4 Å²	82.4	46%	0.46	44%	0.44	S	S	.	.			trans	-80.5	136.9	175.4	-68.6	-20.3	0	0	0	110.4	L62 R77 Y87	D60-L62 WeakPolarHBondContact CB-O 3.49Å; D60-R77 WeakPolarHBondContact OD1-CD 3.2Å; D60-R77 IonicContact OD1-CZ 2.95Å; D60-R77 IonicContact OD1-NE 3.12Å; D60-R77 IonicContact OD1-NH1 2.78Å; D60-R77 PolarHBondContact OD1-NH1 3.1Å; D60-Y87 WeakPolarHBondContact CB-OH 3.47Å
61	Y	92.4	Very high	78	Confident	42 Å²	42	85.2 Å²	85.2	17%	0.165	45%	0.453	C	S	.	.	S	Bend	trans	-76.2	-34.4	174.5	-64.6	-5.9	0	0	0	111.7	D83 Q85 Y87 A102 K104	Y61-D83 WeakPolarHBondContact CE2-O 3.43Å; Y61-Q85 HydrophobicContact CD1-CG 4.49Å; Y61-Q85 HydrophobicContact CD2-CB 4.04Å; Y61-Q85 HydrophobicContact CD2-CG 3.75Å; Y61-Q85 HydrophobicContact CE1-CG 4.45Å; Y61-Q85 VanDerWaalsContact CE1-NE2 3.32Å; Y61-Q85 HydrophobicContact CE2-CB 4.37Å; Y61-Q85 HydrophobicContact CE2-CG 3.72Å; Y61-Q85 VanDerWaalsContact CG-CD 3.5Å; Y61-Q85 HydrophobicContact CG-CG 4.15Å; Y61-Q85 VanDerWaalsContact CG-OE1 3.22Å; Y61-Y87 PolarHBondContact N-OH 3.44Å; Y61-A102 HydrophobicContact CD2-CB 4.34Å; Y61-K104 HydrophobicContact CD1-CG 4.42Å; Y61-K104 HydrophobicContact CD2-CG 4.48Å; Y61-K104 HydrophobicContact CE1-CD 4.23Å; Y61-K104 HydrophobicContact CE1-CG 4.18Å; Y61-K104 HydrophobicContact CE2-CG 4.21Å
62	L	92.3	Very high	80	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	43%	0.431	C	S	.	.	S	Bend	trans	-118.3	142.5	178.6	-51.4	-175.8	0	0	0	110.1	D60 I74 Y87 V100 A102 F137 I142	D60-L62 WeakPolarHBondContact CB-O 3.49Å; L62-I74 HydrophobicContact CB-CG1 4.27Å; L62-I74 HydrophobicContact CD1-CD1 3.92Å; L62-I74 HydrophobicContact CD1-CG1 4.33Å; L62-Y87 HydrophobicContact CB-CD1 4.4Å; L62-Y87 HydrophobicContact CB-CD2 4.36Å; L62-Y87 HydrophobicContact CB-CE1 4Å; L62-Y87 HydrophobicContact CB-CE2 3.96Å; L62-Y87 HydrophobicContact CD1-CD2 3.76Å; L62-Y87 HydrophobicContact CD1-CE2 3.92Å; L62-Y87 HydrophobicContact CD1-CG 4.29Å; L62-Y87 HydrophobicContact CG-CD2 4.16Å; L62-Y87 HydrophobicContact CG-CE2 3.78Å; L62-Y87 PolarHBondContact N-OH 3.45Å; L62-Y87 WeakPolarHBondContact O-CE1 3.37Å; L62-Y87 PolarHBondContact O-OH 3.47Å; L62-V100 HydrophobicContact CD1-CG1 3.69Å; L62-A102 HydrophobicContact CD1-CB 4Å; L62-A102 HydrophobicContact CD2-CB 4.45Å; L62-A102 HydrophobicContact CG-CB 4.06Å; L62-F137 HydrophobicContact CD2-CD1 3.65Å; L62-F137 HydrophobicContact CD2-CE1 4.06Å; L62-I142 HydrophobicContact CD1-CG2 4.31Å; L62-I142 HydrophobicContact CD2-CG2 4.25Å
63	K	92.7	Very high	81.8	Confident	155 Å²	155	80.5 Å²	80.5	67%	0.674	41%	0.413	S	S	*	.			trans	-89.1	140.7	-179.7	-65.9	178.7	-178.3	175.8	0	111.3	E66 I74	K63-E66 HydrophobicContact CB-CB 4.2Å; K63-E66 PolarHBondContact N-OE2 3.42Å; K63-E66 WeakPolarHBondContact O-CB 3.35Å; K63-E66 PolarHBondContact O-N 3.02Å; K63-I74 WeakPolarHBondContact O-CB 3.29Å
64	I	92.8	Very high	83.5	Confident	112 Å²	112	79.3 Å²	79.3	57%	0.574	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	137.3	170.8	-64.1	171.1	0	0	0	109.4	E66 V75	I64-E66 VanDerWaalsContact C-N 3.28Å; I64-V75 VanDerWaalsContact CG2-O 3.24Å; I64-V75 WeakPolarHBondContact CG2-O 3.25Å
65	G	92.4	Very high	85.1	Confident	39 Å²	39	74.7 Å²	74.7	40%	0.402	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-9.5	-175.8	0	0	0	0	0	114.4	I74	G65-I74 PolarHBondContact N-O 3.49Å
66	E	93.1	Very high	86.8	Confident	46 Å²	46	67.2 Å²	67.2	22%	0.215	36%	0.36	C	S	.	.			trans	-76.8	144.5	-178.9	-176.7	158.6	-125.5	0	0	112.7	K63 I64 A68 Q73 I74 F137 H138	K63-E66 HydrophobicContact CB-CB 4.2Å; K63-E66 PolarHBondContact N-OE2 3.42Å; K63-E66 WeakPolarHBondContact O-CB 3.35Å; K63-E66 PolarHBondContact O-N 3.02Å; I64-E66 VanDerWaalsContact C-N 3.28Å; E66-A68 PolarHBondContact O-N 3.07Å; E66-Q73 CarbonylContact O-C 3.56Å; E66-Q73 WeakPolarHBondContact O-CA 3.24Å; E66-I74 WeakPolarHBondContact O-CG1 3.22Å; E66-I74 PolarHBondContact O-N 3.29Å; E66-F137 HydrophobicContact CG-CE1 3.92Å; E66-F137 HydrophobicContact CG-CZ 3.61Å; E66-F137 WeakPolarHBondContact OE2-CE1 3.39Å; E66-H138 IonicContact OE1-CD2 3.2Å; E66-H138 PolarHBondContact OE1-CD2 3.04Å; E66-H138 IonicContact OE1-CE1 3.96Å; E66-H138 IonicContact OE1-NE2 2.78Å; E66-H138 PolarHBondContact OE1-NE2 2.78Å; E66-H138 IonicContact OE2-CD2 3.75Å; E66-H138 PolarHBondContact OE2-CD2 2.85Å; E66-H138 IonicContact OE2-NE2 3.85Å; E66-H138 PolarHBondContact OE2-NE2 3.07Å
67	L	91.6	Very high	88.3	Confident	94 Å²	94	62.5 Å²	62.5	49%	0.492	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	93.3	179.3	-77.9	160.1	0	0	0	111.5	K70 W72 Q73	L67-K70 PolarHBondContact O-N 3Å; L67-W72 CarbonylContact C-O 3.54Å; L67-W72 WeakPolarHBondContact CA-O 3.46Å; L67-Q73 HydrophobicContact CD2-CB 4.11Å
68	A	87.6	Confident	89.6	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134.6	167.5	0	0	0	0	0	110.1	E66 K70 H71 W72 I74 I142 I144	E66-A68 PolarHBondContact O-N 3.07Å; A68-K70 PolarHBondContact O-N 3.42Å; A68-H71 PolarHBondContact O-N 3.49Å; A68-W72 HydrophobicContact CB-CB 4.28Å; A68-W72 PolarHBondContact N-O 3.36Å; A68-W72 WeakPolarHBondContact O-CB 3.25Å; A68-W72 PolarHBondContact O-N 3.37Å; A68-I74 HydrophobicContact CB-CD1 4.01Å; A68-I142 HydrophobicContact CB-CD1 3.99Å; A68-I144 HydrophobicContact CB-CD1 4.41Å
69	Y	82.8	Confident	90.6	Very high	78 Å²	78	55.8 Å²	55.8	31%	0.306	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	29.4	-178.2	-148.6	-107.1	0	0	0	113.6	H71 A135	Y69-H71 PolarHBondContact O-CD2 2.93Å; Y69-H71 PolarHBondContact O-N 3.36Å; Y69-A135 HydrophobicContact CD2-CB 3.85Å; Y69-A135 HydrophobicContact CE2-CB 4.13Å
70	K	81.3	Confident	90.7	Very high	165 Å²	165	54.6 Å²	54.6	72%	0.717	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	-5.4	-176.9	-57.4	179.4	-178	171.3	0	116.8	L67 A68	L67-K70 PolarHBondContact O-N 3Å; A68-K70 PolarHBondContact O-N 3.42Å
71	H	89.4	Confident	90.3	Very high	70 Å²	70	53.3 Å²	53.3	32%	0.324	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-15.3	-170.9	-59.3	-67.5	0	0	0	113.7	A68 Y69 N91	A68-H71 PolarHBondContact O-N 3.49Å; Y69-H71 PolarHBondContact O-CD2 2.93Å; Y69-H71 PolarHBondContact O-N 3.36Å; H71-N91 WeakPolarHBondContact O-CB 3.41Å; H71-N91 PolarHBondContact O-ND2 2.94Å
72	W	95.2	Very high	89.9	Confident	5 Å²	5	55 Å²	55	2%	0.019	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	103.2	-176.8	-64.8	100.2	0	0	0	110.4	L67 A68 I74 A89 V90 N91 L96 A98 Y132 I144	L67-W72 CarbonylContact C-O 3.54Å; L67-W72 WeakPolarHBondContact CA-O 3.46Å; A68-W72 HydrophobicContact CB-CB 4.28Å; A68-W72 PolarHBondContact N-O 3.36Å; A68-W72 WeakPolarHBondContact O-CB 3.25Å; A68-W72 PolarHBondContact O-N 3.37Å; W72-I74 PolarHBondContact O-N 3.44Å; W72-A89 HydrophobicContact CB-CB 4.12Å; W72-A89 HydrophobicContact CE3-CB 4.42Å; W72-V90 CarbonylContact C-O 3.56Å; W72-V90 WeakPolarHBondContact CA-O 3.4Å; W72-N91 HydrophobicContact CD2-CB 4.13Å; W72-N91 HydrophobicContact CE3-CB 3.7Å; W72-N91 HydrophobicContact CH2-CB 4Å; W72-N91 HydrophobicContact CZ2-CB 4.38Å; W72-N91 HydrophobicContact CZ3-CB 3.62Å; W72-L96 HydrophobicContact CH2-CB 3.72Å; W72-L96 HydrophobicContact CH2-CD1 4.2Å; W72-L96 HydrophobicContact CZ3-CB 4.02Å; W72-A98 HydrophobicContact CD2-CB 4.24Å; W72-A98 HydrophobicContact CE3-CB 3.57Å; W72-A98 HydrophobicContact CH2-CB 3.89Å; W72-A98 HydrophobicContact CZ3-CB 3.38Å; W72-Y132 HydrophobicContact CH2-CD1 4.11Å; W72-Y132 AromaticContact CH2-CD2 3.66Å; W72-Y132 HydrophobicContact CH2-CD2 3.66Å; W72-Y132 HydrophobicContact CH2-CE1 4.09Å; W72-Y132 AromaticContact CH2-CE2 3.6Å; W72-Y132 HydrophobicContact CH2-CE2 3.6Å; W72-Y132 AromaticContact CH2-CG 3.89Å; W72-Y132 HydrophobicContact CH2-CG 3.89Å; W72-Y132 AromaticContact CH2-CZ 3.84Å; W72-Y132 AromaticContact CZ2-CD1 3.7Å; W72-Y132 HydrophobicContact CZ2-CD1 3.7Å; W72-Y132 AromaticContact CZ2-CD2 3.57Å; W72-Y132 HydrophobicContact CZ2-CD2 3.57Å; W72-Y132 HydrophobicContact CZ2-CE1 4.15Å; W72-Y132 HydrophobicContact CZ2-CE2 4Å; W72-Y132 AromaticContact CZ2-CG 3.38Å; W72-Y132 HydrophobicContact CZ2-CG 3.38Å; W72-Y132 HydrophobicContact CZ3-CE2 4.4Å; W72-I144 HydrophobicContact CB-CD1 4.32Å; W72-I144 HydrophobicContact CD2-CG2 3.99Å; W72-I144 HydrophobicContact CG-CD1 4.01Å; W72-I144 HydrophobicContact CG-CG2 4.1Å
73	Q	96.8	Very high	89.7	Confident	73 Å²	73	59.3 Å²	59.3	34%	0.341	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.2	176.7	-171.2	179.9	16.2	0	0	109.8	E66 L67 V75 A89 V90	E66-Q73 CarbonylContact O-C 3.56Å; E66-Q73 WeakPolarHBondContact O-CA 3.24Å; L67-Q73 HydrophobicContact CD2-CB 4.11Å; Q73-V75 PolarHBondContact O-N 3.02Å; Q73-A89 CarbonylContact O-C 3.37Å; Q73-A89 WeakPolarHBondContact O-CA 3.5Å; Q73-A89 WeakPolarHBondContact O-CB 3.3Å; Q73-V90 HydrophobicContact CB-CG2 4.29Å; Q73-V90 PolarHBondContact N-O 3.09Å; Q73-V90 PolarHBondContact O-N 3.21Å
74	I	95.8	Very high	89.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	118.9	174.5	-56.1	-53.9	0	0	0	109	L62 K63 G65 E66 A68 W72 Y87 A89 V100	L62-I74 HydrophobicContact CB-CG1 4.27Å; L62-I74 HydrophobicContact CD1-CD1 3.92Å; L62-I74 HydrophobicContact CD1-CG1 4.33Å; K63-I74 WeakPolarHBondContact O-CB 3.29Å; G65-I74 PolarHBondContact N-O 3.49Å; E66-I74 WeakPolarHBondContact O-CG1 3.22Å; E66-I74 PolarHBondContact O-N 3.29Å; A68-I74 HydrophobicContact CB-CD1 4.01Å; W72-I74 PolarHBondContact O-N 3.44Å; I74-Y87 HydrophobicContact CG2-CD1 3.66Å; I74-Y87 HydrophobicContact CG2-CE1 4.41Å; I74-Y87 HydrophobicContact CG2-CG 4.17Å; I74-A89 HydrophobicContact CD1-CB 4.07Å; I74-V100 HydrophobicContact CD1-CB 4.31Å; I74-V100 HydrophobicContact CD1-CG1 4.49Å; I74-V100 HydrophobicContact CD1-CG2 3.91Å
75	V	94.7	Very high	89.7	Confident	60 Å²	60	46.7 Å²	46.7	36%	0.364	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-49.8	-176.6	176.8	0	0	0	0	111.1	I64 Q73 Q88 V90	I64-V75 VanDerWaalsContact CG2-O 3.24Å; I64-V75 WeakPolarHBondContact CG2-O 3.25Å; Q73-V75 PolarHBondContact O-N 3.02Å; V75-Q88 HydrophobicContact CB-CB 4.5Å; V75-Q88 HydrophobicContact CB-CG 4.38Å; V75-Q88 PolarHBondContact N-O 3.08Å; V75-V90 HydrophobicContact CG2-CB 4.29Å; V75-V90 HydrophobicContact CG2-CG1 3.87Å; V75-V90 HydrophobicContact CG2-CG2 3.64Å
76	S	92.2	Very high	89.7	Confident	36 Å²	36	44.8 Å²	44.8	25%	0.252	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	153.7	-175.2	66.5	0	0	0	0	110.2	Y87 Q88	S76-Y87 CarbonylContact O-C 3.55Å; S76-Y87 VanDerWaalsContact O-CA 3.27Å; S76-Y87 WeakPolarHBondContact O-CA 3.41Å; S76-Q88 PolarHBondContact O-N 2.89Å
77	R	90.3	Very high	89.7	Confident	48 Å²	48	42.6 Å²	42.6	18%	0.181	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.5	166.4	-176.6	172.3	167.3	-163.6	-6.4	109.3	S57 D60 C80 Y87	S57-R77 VanDerWaalsContact CB-NH2 3.31Å; S57-R77 PolarHBondContact OG-NH1 2.91Å; S57-R77 PolarHBondContact OG-NH2 3.23Å; D60-R77 WeakPolarHBondContact OD1-CD 3.2Å; D60-R77 IonicContact OD1-CZ 2.95Å; D60-R77 IonicContact OD1-NE 3.12Å; D60-R77 IonicContact OD1-NH1 2.78Å; D60-R77 PolarHBondContact OD1-NH1 3.1Å; R77-C80 PolarHBondContact NH2-SG 3.36Å; R77-C80 VanDerWaalsContact NH2-SG 3.43Å; R77-Y87 HydrophobicContact CB-CD1 3.81Å; R77-Y87 HydrophobicContact CB-CE1 3.71Å; R77-Y87 HydrophobicContact CG-CD1 4.16Å; R77-Y87 HydrophobicContact CG-CE1 3.91Å
78	I	88.8	Confident	89.8	Confident	23 Å²	23	38.5 Å²	38.5	12%	0.118	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-41.1	178.6	-53.7	167.4	0	0	0	110.6	L48 I50 F86 Y87 Q88 I99	L48-I78 HydrophobicContact CB-CD1 3.85Å; L48-I78 HydrophobicContact CB-CG1 4.1Å; L48-I78 HydrophobicContact CB-CG2 4.47Å; L48-I78 HydrophobicContact CD1-CD1 4.08Å; L48-I78 WeakPolarHBondContact O-CG2 3.4Å; I50-I78 HydrophobicContact CB-CG2 3.95Å; I50-I78 HydrophobicContact CD1-CB 3.99Å; I50-I78 HydrophobicContact CD1-CD1 4.41Å; I50-I78 HydrophobicContact CD1-CG2 3.59Å; I50-I78 HydrophobicContact CG1-CB 4.4Å; I50-I78 HydrophobicContact CG1-CG2 3.45Å; I50-I78 VanDerWaalsContact CG1-CG2 3.45Å; I78-F86 HydrophobicContact CB-CB 4.35Å; I78-F86 PolarHBondContact N-O 3.3Å; I78-Y87 VanDerWaalsContact CD1-C 3.43Å; I78-Q88 HydrophobicContact CD1-CB 4.1Å; I78-Q88 HydrophobicContact CG1-CB 4.15Å; I78-I99 HydrophobicContact CD1-CD1 3.46Å; I78-I99 VanDerWaalsContact CD1-CD1 3.46Å
79	G	86	Confident	90.2	Very high	4 Å²	4	38.5 Å²	38.5	4%	0.041	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-167.8	177.8	0	0	0	0	0	114.7	F86	G79-F86 PolarHBondContact N-O 3.07Å; G79-F86 PolarHBondContact O-N 3.27Å
80	C	86.3	Confident	90.9	Very high	11 Å²	11	36.4 Å²	36.4	7%	0.074	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.7	170.2	64.1	0	0	0	0	114.2	A53 K54 R77 A84 Q85	A53-C80 WeakPolarHBondContact CA-O 3.48Å; K54-C80 PolarHBondContact N-O 3.26Å; K54-C80 PolarHBondContact O-N 3.45Å; K54-C80 PolarHBondContact O-SG 3.5Å; R77-C80 PolarHBondContact NH2-SG 3.36Å; R77-C80 VanDerWaalsContact NH2-SG 3.43Å; C80-A84 CarbonylContact C-O 3.57Å; C80-A84 VanDerWaalsContact CA-O 3.24Å; C80-A84 WeakPolarHBondContact CA-O 3.48Å; C80-A84 VanDerWaalsContact CB-O 3.28Å; C80-A84 WeakPolarHBondContact CB-O 3.33Å; C80-Q85 HydrophobicContact CB-CG 4.03Å
81	F	81.2	Confident	91.6	Very high	59 Å²	59	28.8 Å²	28.8	26%	0.259	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	119.3	172.3	-68	-92.1	0	0	0	110.3	I50 F51 G52 A53 D83 A84 F86	I50-F81 HydrophobicContact CB-CE2 3.96Å; I50-F81 HydrophobicContact CB-CZ 4.42Å; I50-F81 HydrophobicContact CG2-CD2 4.33Å; I50-F81 HydrophobicContact CG2-CE2 3.17Å; I50-F81 HydrophobicContact CG2-CZ 3.42Å; I50-F81 VanDerWaalsContact CG2-CZ 3.42Å; F51-F81 VanDerWaalsContact O-CZ 3.29Å; F51-F81 WeakPolarHBondContact O-CZ 3.22Å; G52-F81 VanDerWaalsContact O-CE1 3.26Å; G52-F81 WeakPolarHBondContact O-CE1 3.43Å; A53-F81 HydrophobicContact CB-CD2 4.19Å; A53-F81 HydrophobicContact CB-CE2 3.35Å; A53-F81 HydrophobicContact CB-CZ 3.58Å; F81-D83 PolarHBondContact O-N 3.08Å; F81-A84 PolarHBondContact N-O 3.16Å; F81-A84 PolarHBondContact O-N 3.03Å; F81-F86 HydrophobicContact CB-CE2 4.01Å; F81-F86 AromaticContact CD2-CD2 3.89Å; F81-F86 HydrophobicContact CD2-CD2 3.89Å; F81-F86 AromaticContact CD2-CE2 3.51Å; F81-F86 HydrophobicContact CD2-CE2 3.51Å; F81-F86 HydrophobicContact CD2-CZ 4.23Å; F81-F86 HydrophobicContact CE2-CE2 4.47Å; F81-F86 HydrophobicContact CG-CE2 4.22Å
82	G	84.6	Confident	91.7	Very high	78 Å²	78	30.3 Å²	30.3	80%	0.804	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-127.1	-172.6	0	0	0	0	0	110.7	A84	G82-A84 VanDerWaalsContact C-N 3.32Å
83	D	88.8	Confident	91.6	Very high	90 Å²	90	37.7 Å²	37.7	48%	0.481	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	4.3	178.9	-54.5	-47.4	0	0	0	113.6	Y61 F81 C103 I107	Y61-D83 WeakPolarHBondContact CE2-O 3.43Å; F81-D83 PolarHBondContact O-N 3.08Å; D83-C103 PolarHBondContact O-SG 2.81Å; D83-I107 HydrophobicContact CB-CD1 4.39Å; D83-I107 HydrophobicContact CB-CG1 4.29Å; D83-I107 HydrophobicContact CB-CG2 4.5Å
84	A	91.9	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.5	-179.4	0	0	0	0	0	111.9	C80 F81 G82 F86 R101 A102 V112	C80-A84 CarbonylContact C-O 3.57Å; C80-A84 VanDerWaalsContact CA-O 3.24Å; C80-A84 WeakPolarHBondContact CA-O 3.48Å; C80-A84 VanDerWaalsContact CB-O 3.28Å; C80-A84 WeakPolarHBondContact CB-O 3.33Å; F81-A84 PolarHBondContact N-O 3.16Å; F81-A84 PolarHBondContact O-N 3.03Å; G82-A84 VanDerWaalsContact C-N 3.32Å; A84-F86 HydrophobicContact CB-CE2 4.09Å; A84-F86 HydrophobicContact CB-CZ 4.47Å; A84-R101 HydrophobicContact CB-CG 4.14Å; A84-A102 CarbonylContact C-O 3.58Å; A84-A102 WeakPolarHBondContact CA-O 3.28Å; A84-V112 HydrophobicContact CB-CG2 4.17Å
85	Q	92.7	Very high	91.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	148.2	171.2	-64.6	-174.7	-5.9	0	0	110.1	S57 G59 Y61 C80 Y87 R101 A102	S57-Q85 PolarHBondContact OG-NE2 3.49Å; G59-Q85 PolarHBondContact O-NE2 3.32Å; Y61-Q85 HydrophobicContact CD1-CG 4.49Å; Y61-Q85 HydrophobicContact CD2-CB 4.04Å; Y61-Q85 HydrophobicContact CD2-CG 3.75Å; Y61-Q85 HydrophobicContact CE1-CG 4.45Å; Y61-Q85 VanDerWaalsContact CE1-NE2 3.32Å; Y61-Q85 HydrophobicContact CE2-CB 4.37Å; Y61-Q85 HydrophobicContact CE2-CG 3.72Å; Y61-Q85 VanDerWaalsContact CG-CD 3.5Å; Y61-Q85 HydrophobicContact CG-CG 4.15Å; Y61-Q85 VanDerWaalsContact CG-OE1 3.22Å; C80-Q85 HydrophobicContact CB-CG 4.03Å; Q85-Y87 HydrophobicContact CB-CD2 4.47Å; Q85-Y87 HydrophobicContact CB-CE2 3.63Å; Q85-Y87 PolarHBondContact OE1-OH 3.41Å; Q85-R101 CarbonylContact O-C 3.51Å; Q85-R101 WeakPolarHBondContact O-CA 3.41Å; Q85-A102 PolarHBondContact N-O 3.2Å; Q85-A102 PolarHBondContact O-N 3.16Å
86	F	92.6	Very high	91.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.5	-175.9	-63.9	-100.6	0	0	0	109.5	I50 I78 G79 F81 A84 I99 V100 R101 Y362	I50-F86 HydrophobicContact CD1-CB 3.33Å; I50-F86 HydrophobicContact CD1-CD1 3.75Å; I50-F86 HydrophobicContact CD1-CD2 4.24Å; I50-F86 HydrophobicContact CD1-CG 3.51Å; I78-F86 HydrophobicContact CB-CB 4.35Å; I78-F86 PolarHBondContact N-O 3.3Å; G79-F86 PolarHBondContact N-O 3.07Å; G79-F86 PolarHBondContact O-N 3.27Å; F81-F86 HydrophobicContact CB-CE2 4.01Å; F81-F86 AromaticContact CD2-CD2 3.89Å; F81-F86 HydrophobicContact CD2-CD2 3.89Å; F81-F86 AromaticContact CD2-CE2 3.51Å; F81-F86 HydrophobicContact CD2-CE2 3.51Å; F81-F86 HydrophobicContact CD2-CZ 4.23Å; F81-F86 HydrophobicContact CE2-CE2 4.47Å; F81-F86 HydrophobicContact CG-CE2 4.22Å; A84-F86 HydrophobicContact CB-CE2 4.09Å; A84-F86 HydrophobicContact CB-CZ 4.47Å; F86-I99 HydrophobicContact CD1-CG2 4.21Å; F86-V100 CarbonylContact C-O 3.4Å; F86-V100 WeakPolarHBondContact CA-O 3.46Å; F86-R101 HydrophobicContact CD1-CB 4.22Å; F86-R101 HydrophobicContact CD1-CG 4Å; F86-R101 HydrophobicContact CE1-CB 4.12Å; F86-R101 HydrophobicContact CE1-CG 3.57Å; F86-R101 HydrophobicContact CE2-CG 4.37Å; F86-R101 HydrophobicContact CZ-CG 3.8Å; F86-Y362 AromaticContact CD1-CD1 3.66Å; F86-Y362 HydrophobicContact CD1-CD1 3.66Å; F86-Y362 HydrophobicContact CD1-CE1 4.14Å; F86-Y362 AromaticContact CE1-CD1 3.4Å; F86-Y362 HydrophobicContact CE1-CD1 3.4Å; F86-Y362 VanDerWaalsContact CE1-CD1 3.4Å; F86-Y362 AromaticContact CE1-CE1 3.62Å; F86-Y362 HydrophobicContact CE1-CE1 3.62Å
87	Y	93.7	Very high	91.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.1	-176.2	-61.3	-96.1	0	0	0	110.6	D60 Y61 L62 I74 S76 R77 I78 Q85 I99 V100 A102	D60-Y87 WeakPolarHBondContact CB-OH 3.47Å; Y61-Y87 PolarHBondContact N-OH 3.44Å; L62-Y87 HydrophobicContact CB-CD1 4.4Å; L62-Y87 HydrophobicContact CB-CD2 4.36Å; L62-Y87 HydrophobicContact CB-CE1 4Å; L62-Y87 HydrophobicContact CB-CE2 3.96Å; L62-Y87 HydrophobicContact CD1-CD2 3.76Å; L62-Y87 HydrophobicContact CD1-CE2 3.92Å; L62-Y87 HydrophobicContact CD1-CG 4.29Å; L62-Y87 HydrophobicContact CG-CD2 4.16Å; L62-Y87 HydrophobicContact CG-CE2 3.78Å; L62-Y87 PolarHBondContact N-OH 3.45Å; L62-Y87 WeakPolarHBondContact O-CE1 3.37Å; L62-Y87 PolarHBondContact O-OH 3.47Å; I74-Y87 HydrophobicContact CG2-CD1 3.66Å; I74-Y87 HydrophobicContact CG2-CE1 4.41Å; I74-Y87 HydrophobicContact CG2-CG 4.17Å; S76-Y87 CarbonylContact O-C 3.55Å; S76-Y87 VanDerWaalsContact O-CA 3.27Å; S76-Y87 WeakPolarHBondContact O-CA 3.41Å; R77-Y87 HydrophobicContact CB-CD1 3.81Å; R77-Y87 HydrophobicContact CB-CE1 3.71Å; R77-Y87 HydrophobicContact CG-CD1 4.16Å; R77-Y87 HydrophobicContact CG-CE1 3.91Å; I78-Y87 VanDerWaalsContact CD1-C 3.43Å; Q85-Y87 HydrophobicContact CB-CD2 4.47Å; Q85-Y87 HydrophobicContact CB-CE2 3.63Å; Q85-Y87 PolarHBondContact OE1-OH 3.41Å; Y87-I99 WeakPolarHBondContact O-CA 3.33Å; Y87-V100 PolarHBondContact N-O 3.14Å; Y87-V100 PolarHBondContact O-N 3.45Å; Y87-A102 HydrophobicContact CE2-CB 4.2Å
88	Q	94.1	Very high	91.4	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.2	164.6	-177.8	168.1	1.6	0	0	107.9	P45 L48 V75 S76 I78	P45-Q88 PolarHBondContact O-NE2 2.92Å; L48-Q88 HydrophobicContact CD1-CB 3.9Å; L48-Q88 VanDerWaalsContact CD1-CD 3.5Å; L48-Q88 HydrophobicContact CD1-CG 3.55Å; L48-Q88 HydrophobicContact CG-CG 4.33Å; V75-Q88 HydrophobicContact CB-CB 4.5Å; V75-Q88 HydrophobicContact CB-CG 4.38Å; V75-Q88 PolarHBondContact N-O 3.08Å; S76-Q88 PolarHBondContact O-N 2.89Å; I78-Q88 HydrophobicContact CD1-CB 4.1Å; I78-Q88 HydrophobicContact CG1-CB 4.15Å
89	A	95.7	Very high	91.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.1	171.7	0	0	0	0	0	111.2	W72 Q73 I74 S97 A98 V100	W72-A89 HydrophobicContact CB-CB 4.12Å; W72-A89 HydrophobicContact CE3-CB 4.42Å; Q73-A89 CarbonylContact O-C 3.37Å; Q73-A89 WeakPolarHBondContact O-CA 3.5Å; Q73-A89 WeakPolarHBondContact O-CB 3.3Å; I74-A89 HydrophobicContact CD1-CB 4.07Å; A89-S97 CarbonylContact O-C 3.58Å; A89-S97 WeakPolarHBondContact O-CA 3.35Å; A89-A98 PolarHBondContact N-O 3.32Å; A89-A98 PolarHBondContact O-N 3.47Å; A89-V100 HydrophobicContact CB-CG2 3.6Å
90	V	96.4	Very high	92.1	Very high	34 Å²	34	37.7 Å²	37.7	21%	0.206	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.9	176.2	-63.8	0	0	0	0	110.5	W72 Q73 V75 L96	W72-V90 CarbonylContact C-O 3.56Å; W72-V90 WeakPolarHBondContact CA-O 3.4Å; Q73-V90 HydrophobicContact CB-CG2 4.29Å; Q73-V90 PolarHBondContact N-O 3.09Å; Q73-V90 PolarHBondContact O-N 3.21Å; V75-V90 HydrophobicContact CG2-CB 4.29Å; V75-V90 HydrophobicContact CG2-CG1 3.87Å; V75-V90 HydrophobicContact CG2-CG2 3.64Å; V90-L96 WeakPolarHBondContact CA-O 3.46Å
91	N	96.6	Very high	92.5	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.027	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	104.7	168.2	-178.7	-36.8	0	0	0	107.6	H71 W72 E93 L94 K95 L96	H71-N91 WeakPolarHBondContact O-CB 3.41Å; H71-N91 PolarHBondContact O-ND2 2.94Å; W72-N91 HydrophobicContact CD2-CB 4.13Å; W72-N91 HydrophobicContact CE3-CB 3.7Å; W72-N91 HydrophobicContact CH2-CB 4Å; W72-N91 HydrophobicContact CZ2-CB 4.38Å; W72-N91 HydrophobicContact CZ3-CB 3.62Å; N91-E93 VanDerWaalsContact C-N 3.31Å; N91-E93 PolarHBondContact O-N 3.14Å; N91-E93 WeakPolarHBondContact OD1-CB 3.49Å; N91-E93 PolarHBondContact OD1-N 3.24Å; N91-E93 VanDerWaalsContact OD1-N 3.08Å; N91-L94 HydrophobicContact CB-CB 4.34Å; N91-L94 WeakPolarHBondContact ND2-CD1 3.31Å; N91-L94 PolarHBondContact O-N 3.29Å; N91-L94 PolarHBondContact OD1-N 3.43Å; N91-K95 WeakPolarHBondContact O-CA 3.06Å; N91-K95 PolarHBondContact O-N 3.44Å; N91-L96 PolarHBondContact N-O 3.33Å; N91-L96 PolarHBondContact O-N 3.21Å; N91-L96 VanDerWaalsContact O-N 3.09Å
92	D	91	Very high	93.2	Very high	102 Å²	102	34.9 Å²	34.9	55%	0.545	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-26.6	-176.1	-79.5	-29.8	0	0	0	113.6	K95	D92-K95 VanDerWaalsContact O-CD 3.26Å; D92-K95 WeakPolarHBondContact O-CD 3.4Å; D92-K95 WeakPolarHBondContact O-CE 3.47Å; D92-K95 PolarHBondContact O-NZ 3.37Å
93	E	92.6	Very high	93.7	Very high	160 Å²	160	31.1 Å²	31.1	75%	0.748	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-46	176.8	-63.3	-179.9	171.5	0	0	110.3	N91 K95	N91-E93 VanDerWaalsContact C-N 3.31Å; N91-E93 PolarHBondContact O-N 3.14Å; N91-E93 WeakPolarHBondContact OD1-CB 3.49Å; N91-E93 PolarHBondContact OD1-N 3.24Å; N91-E93 VanDerWaalsContact OD1-N 3.08Å; E93-K95 VanDerWaalsContact C-N 3.35Å
94	L	92.7	Very high	94	Very high	78 Å²	78	31.4 Å²	31.4	41%	0.408	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.5	-179.8	-58.9	-178.9	0	0	0	113.2	L33 N91 L96	L33-L94 HydrophobicContact CD2-CD1 4.33Å; N91-L94 HydrophobicContact CB-CB 4.34Å; N91-L94 WeakPolarHBondContact ND2-CD1 3.31Å; N91-L94 PolarHBondContact O-N 3.29Å; N91-L94 PolarHBondContact OD1-N 3.43Å; L94-L96 HydrophobicContact CB-CB 4.33Å; L94-L96 HydrophobicContact CB-CD1 3.77Å; L94-L96 HydrophobicContact CB-CG 3.7Å; L94-L96 HydrophobicContact CD1-CD1 3.95Å; L94-L96 PolarHBondContact O-N 3.17Å
95	K	93.1	Very high	94.2	Very high	133 Å²	133	35.1 Å²	35.1	58%	0.578	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	37.8	-171.5	-56.7	-60.8	177.9	-151.7	0	112.7	P40 N91 D92 E93	P40-K95 HydrophobicContact CB-CB 4.04Å; P40-K95 VanDerWaalsContact CB-O 3.3Å; P40-K95 WeakPolarHBondContact CB-O 3.37Å; P40-K95 HydrophobicContact CG-CB 4.28Å; N91-K95 WeakPolarHBondContact O-CA 3.06Å; N91-K95 PolarHBondContact O-N 3.44Å; D92-K95 VanDerWaalsContact O-CD 3.26Å; D92-K95 WeakPolarHBondContact O-CD 3.4Å; D92-K95 WeakPolarHBondContact O-CE 3.47Å; D92-K95 PolarHBondContact O-NZ 3.37Å; E93-K95 VanDerWaalsContact C-N 3.35Å
96	L	93.8	Very high	94.2	Very high	22 Å²	22	40.8 Å²	40.8	12%	0.115	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	152.3	-179.2	-61.3	179.1	0	0	0	111.5	P40 P41 W72 V90 N91 L94 Y132	P40-L96 HydrophobicContact CB-CD2 3.96Å; P41-L96 HydrophobicContact CG-CD2 4.28Å; W72-L96 HydrophobicContact CH2-CB 3.72Å; W72-L96 HydrophobicContact CH2-CD1 4.2Å; W72-L96 HydrophobicContact CZ3-CB 4.02Å; V90-L96 WeakPolarHBondContact CA-O 3.46Å; N91-L96 PolarHBondContact N-O 3.33Å; N91-L96 PolarHBondContact O-N 3.21Å; N91-L96 VanDerWaalsContact O-N 3.09Å; L94-L96 HydrophobicContact CB-CB 4.33Å; L94-L96 HydrophobicContact CB-CD1 3.77Å; L94-L96 HydrophobicContact CB-CG 3.7Å; L94-L96 HydrophobicContact CD1-CD1 3.95Å; L94-L96 PolarHBondContact O-N 3.17Å; L96-Y132 HydrophobicContact CD1-CE1 3.83Å
97	S	93.3	Very high	94.3	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.042	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	155.7	165	59.2	0	0	0	0	110.2	A89 P147	A89-S97 CarbonylContact O-C 3.58Å; A89-S97 WeakPolarHBondContact O-CA 3.35Å; S97-P147 WeakPolarHBondContact O-CD 3.36Å; S97-P147 WeakPolarHBondContact OG-CG 3.31Å
98	A	94.5	Very high	93.9	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	158	-178.7	0	0	0	0	0	112.3	W72 A89 Y132 I144 V145	W72-A98 HydrophobicContact CD2-CB 4.24Å; W72-A98 HydrophobicContact CE3-CB 3.57Å; W72-A98 HydrophobicContact CH2-CB 3.89Å; W72-A98 HydrophobicContact CZ3-CB 3.38Å; A89-A98 PolarHBondContact N-O 3.32Å; A89-A98 PolarHBondContact O-N 3.47Å; A98-Y132 HydrophobicContact CB-CD2 3.84Å; A98-Y132 HydrophobicContact CB-CE2 3.81Å; A98-I144 HydrophobicContact CB-CG2 3.62Å; A98-V145 CarbonylContact C-O 3.6Å; A98-V145 VanDerWaalsContact CA-O 3.24Å; A98-V145 WeakPolarHBondContact CA-O 3.01Å; A98-V145 WeakPolarHBondContact CB-O 3.44Å
99	I	94.5	Very high	93.7	Very high	5 Å²	5	57 Å²	57	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.4	163.5	-57.2	-66.4	0	0	0	108.1	L48 I78 F86 Y87 I144 V145 P147 Y362	L48-I99 HydrophobicContact CD1-CD1 3.56Å; I78-I99 HydrophobicContact CD1-CD1 3.46Å; I78-I99 VanDerWaalsContact CD1-CD1 3.46Å; F86-I99 HydrophobicContact CD1-CG2 4.21Å; Y87-I99 WeakPolarHBondContact O-CA 3.33Å; I99-I144 WeakPolarHBondContact O-CA 3.47Å; I99-V145 HydrophobicContact CB-CG2 4.24Å; I99-V145 PolarHBondContact N-O 3.38Å; I99-V145 PolarHBondContact O-N 3.33Å; I99-P147 HydrophobicContact CD1-CB 4.5Å; I99-P147 HydrophobicContact CG1-CB 4.28Å; I99-Y362 HydrophobicContact CB-CD2 4.03Å; I99-Y362 HydrophobicContact CB-CE2 4.36Å; I99-Y362 HydrophobicContact CB-CG 4.35Å; I99-Y362 HydrophobicContact CG1-CD2 3.85Å; I99-Y362 HydrophobicContact CG1-CG 4.22Å; I99-Y362 HydrophobicContact CG2-CD1 4.04Å; I99-Y362 HydrophobicContact CG2-CD2 3.93Å; I99-Y362 HydrophobicContact CG2-CE1 4.43Å; I99-Y362 HydrophobicContact CG2-CE2 4.32Å; I99-Y362 HydrophobicContact CG2-CG 3.78Å
100	V	94.7	Very high	93.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.1	171.7	-175.5	0	0	0	0	108.7	L62 I74 F86 Y87 A89 I142 T143 I144	L62-V100 HydrophobicContact CD1-CG1 3.69Å; I74-V100 HydrophobicContact CD1-CB 4.31Å; I74-V100 HydrophobicContact CD1-CG1 4.49Å; I74-V100 HydrophobicContact CD1-CG2 3.91Å; F86-V100 CarbonylContact C-O 3.4Å; F86-V100 WeakPolarHBondContact CA-O 3.46Å; Y87-V100 PolarHBondContact N-O 3.14Å; Y87-V100 PolarHBondContact O-N 3.45Å; A89-V100 HydrophobicContact CB-CG2 3.6Å; V100-I142 HydrophobicContact CG1-CB 4.11Å; V100-I142 HydrophobicContact CG1-CG2 4.36Å; V100-T143 WeakPolarHBondContact CA-O 3.23Å; V100-I144 HydrophobicContact CG1-CG1 4.35Å; V100-I144 HydrophobicContact CG2-CG1 4.12Å; V100-I144 HydrophobicContact CG2-CG2 4.11Å
101	R	94.9	Very high	93.5	Very high	10 Å²	10	56.7 Å²	56.7	4%	0.038	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.4	168.6	-164.9	-176.5	-177.2	160	10.6	108.7	A84 Q85 F86 V112 E115 I142 T143 D214	A84-R101 HydrophobicContact CB-CG 4.14Å; Q85-R101 CarbonylContact O-C 3.51Å; Q85-R101 WeakPolarHBondContact O-CA 3.41Å; F86-R101 HydrophobicContact CD1-CB 4.22Å; F86-R101 HydrophobicContact CD1-CG 4Å; F86-R101 HydrophobicContact CE1-CB 4.12Å; F86-R101 HydrophobicContact CE1-CG 3.57Å; F86-R101 HydrophobicContact CE2-CG 4.37Å; F86-R101 HydrophobicContact CZ-CG 3.8Å; R101-V112 HydrophobicContact CB-CG1 4.37Å; R101-V112 HydrophobicContact CB-CG2 4.43Å; R101-V112 HydrophobicContact CG-CG1 4.45Å; R101-V112 HydrophobicContact CG-CG2 3.65Å; R101-V112 WeakPolarHBondContact O-CG1 3.11Å; R101-E115 WeakPolarHBondContact CD-OE2 3.06Å; R101-E115 IonicContact CZ-OE2 3.41Å; R101-E115 IonicContact NE-OE2 3.59Å; R101-E115 IonicContact NH1-OE1 3.69Å; R101-E115 IonicContact NH1-OE2 2.72Å; R101-E115 PolarHBondContact NH1-OE2 2.8Å; R101-I142 CarbonylContact O-C 3.58Å; R101-I142 WeakPolarHBondContact O-CA 3.42Å; R101-T143 PolarHBondContact N-O 2.93Å; R101-T143 PolarHBondContact O-N 3.36Å; R101-D214 IonicContact NH1-OD1 3.43Å
102	A	95	Very high	93.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.3	-177.9	0	0	0	0	0	111.8	Y61 L62 A84 Q85 Y87 Y141 I142	Y61-A102 HydrophobicContact CD2-CB 4.34Å; L62-A102 HydrophobicContact CD1-CB 4Å; L62-A102 HydrophobicContact CD2-CB 4.45Å; L62-A102 HydrophobicContact CG-CB 4.06Å; A84-A102 CarbonylContact C-O 3.58Å; A84-A102 WeakPolarHBondContact CA-O 3.28Å; Q85-A102 PolarHBondContact N-O 3.2Å; Q85-A102 PolarHBondContact O-N 3.16Å; Y87-A102 HydrophobicContact CE2-CB 4.2Å; A102-Y141 CarbonylContact C-O 3.55Å; A102-Y141 WeakPolarHBondContact CA-O 3.45Å; A102-I142 HydrophobicContact CB-CG2 3.9Å
103	C	95.5	Very high	93.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	136	174.3	-178.2	0	0	0	0	110.9	D83 N110 V112 C140 Y141	D83-C103 PolarHBondContact O-SG 2.81Å; C103-N110 PolarHBondContact O-ND2 2.98Å; C103-N110 PolarHBondContact SG-ND2 3.36Å; C103-V112 HydrophobicContact CB-CB 3.98Å; C103-V112 HydrophobicContact CB-CG2 3.34Å; C103-C140 CarbonylContact O-C 3.55Å; C103-C140 WeakPolarHBondContact O-CA 3.25Å; C103-Y141 PolarHBondContact N-O 3.33Å; C103-Y141 PolarHBondContact O-N 2.86Å
104	K	95.1	Very high	93.9	Very high	96 Å²	96	51.2 Å²	51.2	42%	0.417	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	138.2	-177.9	-65.1	-174.2	173.4	-175.7	0	112.3	Y61 N106 I107 N110 D139	Y61-K104 HydrophobicContact CD1-CG 4.42Å; Y61-K104 HydrophobicContact CD2-CG 4.48Å; Y61-K104 HydrophobicContact CE1-CD 4.23Å; Y61-K104 HydrophobicContact CE1-CG 4.18Å; Y61-K104 HydrophobicContact CE2-CG 4.21Å; K104-N106 VanDerWaalsContact CB-OD1 3.23Å; K104-N106 WeakPolarHBondContact CB-OD1 3.45Å; K104-N106 PolarHBondContact O-N 2.98Å; K104-I107 HydrophobicContact CB-CG1 4.35Å; K104-I107 WeakPolarHBondContact O-CB 3.33Å; K104-I107 WeakPolarHBondContact O-CG1 3.48Å; K104-I107 PolarHBondContact O-N 2.76Å; K104-N110 PolarHBondContact O-ND2 3.28Å; K104-D139 CarbonylContact C-O 3.54Å
105	Q	95	Very high	94	Very high	77 Å²	77	47.5 Å²	47.5	36%	0.36	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.2	-173.9	69.8	-177	-24.1	0	0	113.8	I107 L136 D139 Y141	Q105-I107 PolarHBondContact O-N 2.89Å; Q105-L136 HydrophobicContact CB-CD1 3.98Å; Q105-D139 WeakPolarHBondContact CB-O 3.4Å; Q105-D139 HydrophobicContact CG-CB 4.23Å; Q105-D139 WeakPolarHBondContact CG-O 3.45Å; Q105-D139 PolarHBondContact N-O 2.63Å; Q105-D139 VanDerWaalsContact NE2-CB 3.27Å; Q105-D139 VanDerWaalsContact NE2-CG 3.27Å; Q105-D139 PolarHBondContact NE2-OD1 3.46Å; Q105-Y141 HydrophobicContact CB-CD2 4.2Å; Q105-Y141 HydrophobicContact CB-CE2 3.89Å
106	N	94.1	Very high	94.2	Very high	120 Å²	120	41.2 Å²	41.2	64%	0.642	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.3	179.4	68.4	-28.6	0	0	0	113.5	K104 V108	K104-N106 VanDerWaalsContact CB-OD1 3.23Å; K104-N106 WeakPolarHBondContact CB-OD1 3.45Å; K104-N106 PolarHBondContact O-N 2.98Å; N106-V108 PolarHBondContact O-N 3.38Å
107	I	93	Very high	94.4	Very high	49 Å²	49	43.2 Å²	43.2	25%	0.251	21%	0.206	S	C	.	.			trans	-73.6	110.1	174.1	-57.6	-59.4	0	0	0	109.3	D83 K104 Q105 R109 N110	D83-I107 HydrophobicContact CB-CD1 4.39Å; D83-I107 HydrophobicContact CB-CG1 4.29Å; D83-I107 HydrophobicContact CB-CG2 4.5Å; K104-I107 HydrophobicContact CB-CG1 4.35Å; K104-I107 WeakPolarHBondContact O-CB 3.33Å; K104-I107 WeakPolarHBondContact O-CG1 3.48Å; K104-I107 PolarHBondContact O-N 2.76Å; Q105-I107 PolarHBondContact O-N 2.89Å; I107-R109 VanDerWaalsContact C-N 3.28Å; I107-R109 PolarHBondContact O-N 3.47Å; I107-N110 WeakPolarHBondContact O-CB 3.48Å; I107-N110 PolarHBondContact O-N 3.36Å
108	V	87.2	Confident	94.6	Very high	144 Å²	144	42.9 Å²	42.9	87%	0.873	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.3	-173.2	179.7	0	0	0	0	113.6	N106	N106-V108 PolarHBondContact O-N 3.38Å
109	R	88	Confident	94.7	Very high	157 Å²	157	42.9 Å²	42.9	59%	0.592	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.7	60	177.8	-68.1	-176.7	173.5	127.9	-9	110.1	I107 S111	I107-R109 VanDerWaalsContact C-N 3.28Å; I107-R109 PolarHBondContact O-N 3.47Å; R109-S111 PolarHBondContact O-N 3.05Å; R109-S111 VanDerWaalsContact O-N 3.12Å
110	N	94.5	Very high	94.8	Very high	8 Å²	8	48 Å²	48	4%	0.043	22%	0.223	C	C	.	.			trans	-64.2	110.9	-174.3	-166.8	-60.8	0	0	0	111.4	C103 K104 I107 V112 Y113 N114 Y141	C103-N110 PolarHBondContact O-ND2 2.98Å; C103-N110 PolarHBondContact SG-ND2 3.36Å; K104-N110 PolarHBondContact O-ND2 3.28Å; I107-N110 WeakPolarHBondContact O-CB 3.48Å; I107-N110 PolarHBondContact O-N 3.36Å; N110-V112 VanDerWaalsContact C-N 3.29Å; N110-V112 PolarHBondContact O-N 3.23Å; N110-V112 WeakPolarHBondContact OD1-CA 3.48Å; N110-V112 WeakPolarHBondContact OD1-CB 3.41Å; N110-V112 PolarHBondContact OD1-N 2.58Å; N110-Y113 PolarHBondContact OD1-N 2.97Å; N110-N114 PolarHBondContact O-N 2.81Å; N110-Y141 HydrophobicContact CB-CD2 4.29Å; N110-Y141 WeakPolarHBondContact ND2-CD2 3.28Å
111	S	94.2	Very high	94.9	Very high	19 Å²	19	52.1 Å²	52.1	13%	0.133	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-32	-179.1	58.1	0	0	0	0	112.7	R109 N114 E115 G216	R109-S111 PolarHBondContact O-N 3.05Å; R109-S111 VanDerWaalsContact O-N 3.12Å; S111-N114 PolarHBondContact O-N 3.36Å; S111-E115 WeakPolarHBondContact O-CB 3.41Å; S111-E115 PolarHBondContact O-N 3.05Å; S111-G216 WeakPolarHBondContact O-CA 2.91Å
112	V	96	Very high	95	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-74.3	-39.1	-177.4	-175.1	0	0	0	0	111	A84 R101 C103 N110 E115 G116 Y141 T143	A84-V112 HydrophobicContact CB-CG2 4.17Å; R101-V112 HydrophobicContact CB-CG1 4.37Å; R101-V112 HydrophobicContact CB-CG2 4.43Å; R101-V112 HydrophobicContact CG-CG1 4.45Å; R101-V112 HydrophobicContact CG-CG2 3.65Å; R101-V112 WeakPolarHBondContact O-CG1 3.11Å; C103-V112 HydrophobicContact CB-CB 3.98Å; C103-V112 HydrophobicContact CB-CG2 3.34Å; N110-V112 VanDerWaalsContact C-N 3.29Å; N110-V112 PolarHBondContact O-N 3.23Å; N110-V112 WeakPolarHBondContact OD1-CA 3.48Å; N110-V112 WeakPolarHBondContact OD1-CB 3.41Å; N110-V112 PolarHBondContact OD1-N 2.58Å; V112-E115 PolarHBondContact O-N 3.4Å; V112-G116 PolarHBondContact O-N 3.34Å; V112-Y141 WeakPolarHBondContact CG1-O 3.26Å; V112-T143 PolarHBondContact O-OG1 2.98Å
113	Y	96.6	Very high	95	Very high	111 Å²	111	54.7 Å²	54.7	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-58.8	-48	170.6	176.9	-92.1	0	0	0	111.4	N110 E115 G116 Y117 Y141	N110-Y113 PolarHBondContact OD1-N 2.97Å; Y113-E115 PolarHBondContact O-N 3.45Å; Y113-G116 PolarHBondContact O-N 3.06Å; Y113-Y117 WeakPolarHBondContact O-CB 3.32Å; Y113-Y117 PolarHBondContact O-N 2.79Å; Y113-Y141 AromaticContact CD2-CD1 3.91Å; Y113-Y141 HydrophobicContact CD2-CD1 3.91Å; Y113-Y141 HydrophobicContact CD2-CD2 4.45Å; Y113-Y141 AromaticContact CD2-CE1 3.69Å; Y113-Y141 HydrophobicContact CD2-CE1 3.69Å; Y113-Y141 HydrophobicContact CD2-CE2 4.24Å; Y113-Y141 HydrophobicContact CD2-CG 4.29Å; Y113-Y141 AromaticContact CD2-CZ 3.86Å; Y113-Y141 HydrophobicContact CE2-CE1 4.29Å
114	N	96.3	Very high	94.8	Very high	41 Å²	41	64 Å²	64	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-44.3	178.7	-74.6	-13.1	0	0	0	111.9	N110 S111 Y117 A118 G216 I218	N110-N114 PolarHBondContact O-N 2.81Å; S111-N114 PolarHBondContact O-N 3.36Å; N114-Y117 PolarHBondContact O-N 2.9Å; N114-A118 PolarHBondContact O-N 2.87Å; N114-G216 PolarHBondContact ND2-O 3.46Å; N114-I218 HydrophobicContact CB-CD1 4.25Å; N114-I218 HydrophobicContact CB-CG1 4.05Å
115	E	95.6	Very high	94.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-47.6	177.3	-179.7	170.1	-166.7	0	0	111.5	R101 S111 V112 Y113 Y117 A118 M119 T143 L215 Y362	R101-E115 WeakPolarHBondContact CD-OE2 3.06Å; R101-E115 IonicContact CZ-OE2 3.41Å; R101-E115 IonicContact NE-OE2 3.59Å; R101-E115 IonicContact NH1-OE1 3.69Å; R101-E115 IonicContact NH1-OE2 2.72Å; R101-E115 PolarHBondContact NH1-OE2 2.8Å; S111-E115 WeakPolarHBondContact O-CB 3.41Å; S111-E115 PolarHBondContact O-N 3.05Å; V112-E115 PolarHBondContact O-N 3.4Å; Y113-E115 PolarHBondContact O-N 3.45Å; E115-Y117 VanDerWaalsContact C-N 3.28Å; E115-Y117 PolarHBondContact O-N 3.44Å; E115-A118 PolarHBondContact O-N 3.19Å; E115-A118 VanDerWaalsContact O-N 3.13Å; E115-M119 HydrophobicContact CG-CE 4.18Å; E115-M119 HydrophobicContact CG-CG 4.09Å; E115-M119 WeakPolarHBondContact O-CB 3.46Å; E115-M119 VanDerWaalsContact O-CG 3.22Å; E115-M119 WeakPolarHBondContact O-CG 3.5Å; E115-M119 PolarHBondContact O-N 3.29Å; E115-T143 HydrophobicContact CG-CG2 4.42Å; E115-L215 HydrophobicContact CB-CB 4.23Å; E115-L215 HydrophobicContact CG-CB 4.18Å; E115-Y362 PolarHBondContact OE1-OH 3.1Å
116	G	96.6	Very high	95	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-58.9	-39.4	175.4	0	0	0	0	0	112.8	V112 Y113 R120 S134 T143	V112-G116 PolarHBondContact O-N 3.34Å; Y113-G116 PolarHBondContact O-N 3.06Å; G116-R120 VanDerWaalsContact C-NH1 3.31Å; G116-R120 WeakPolarHBondContact O-CG 3.36Å; G116-R120 PolarHBondContact O-N 3.07Å; G116-R120 VanDerWaalsContact O-N 3.12Å; G116-R120 PolarHBondContact O-NH1 2.83Å; G116-S134 WeakPolarHBondContact CA-OG 3.33Å; G116-T143 WeakPolarHBondContact CA-OG1 3.34Å
117	Y	97	Very high	95.1	Very high	63 Å²	63	56.1 Å²	56.1	25%	0.247	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-42.5	174.7	168.1	-102.6	0	0	0	112.8	Y113 N114 E115 K121 L188 I218 P220	Y113-Y117 WeakPolarHBondContact O-CB 3.32Å; Y113-Y117 PolarHBondContact O-N 2.79Å; N114-Y117 PolarHBondContact O-N 2.9Å; E115-Y117 VanDerWaalsContact C-N 3.28Å; E115-Y117 PolarHBondContact O-N 3.44Å; Y117-K121 HydrophobicContact CE1-CD 4.5Å; Y117-K121 HydrophobicContact CE2-CD 4.43Å; Y117-K121 VanDerWaalsContact CZ-CE 3.5Å; Y117-K121 VanDerWaalsContact OH-CE 3.25Å; Y117-K121 WeakPolarHBondContact OH-CE 3.48Å; Y117-K121 PolarHBondContact OH-NZ 3.3Å; Y117-L188 HydrophobicContact CE1-CD1 4.31Å; Y117-L188 HydrophobicContact CE1-CD2 3.71Å; Y117-I218 HydrophobicContact CD1-CD1 3.81Å; Y117-I218 HydrophobicContact CE1-CD1 4.2Å; Y117-P220 HydrophobicContact CE1-CG 4.41Å
118	A	97.9	Very high	95.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-71	-45.3	178.2	0	0	0	0	0	112.1	N114 E115 R120 K121 L122 L188 L215 I218	N114-A118 PolarHBondContact O-N 2.87Å; E115-A118 PolarHBondContact O-N 3.19Å; E115-A118 VanDerWaalsContact O-N 3.13Å; A118-R120 VanDerWaalsContact C-N 3.31Å; A118-R120 PolarHBondContact O-N 2.79Å; A118-K121 WeakPolarHBondContact O-CA 3.22Å; A118-K121 WeakPolarHBondContact O-CB 3.43Å; A118-K121 PolarHBondContact O-N 3.36Å; A118-L122 WeakPolarHBondContact O-CG 3.47Å; A118-L122 PolarHBondContact O-N 3.05Å; A118-L188 HydrophobicContact CB-CD1 3.73Å; A118-L215 HydrophobicContact CB-CB 4.01Å; A118-L215 HydrophobicContact CB-CD1 3.63Å; A118-L215 HydrophobicContact CB-CG 4.32Å; A118-I218 HydrophobicContact CB-CD1 4.36Å; A118-I218 HydrophobicContact CB-CG1 4.09Å; A118-I218 HydrophobicContact CB-CG2 4.38Å
119	M	97	Very high	95.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-40.1	177.8	-69.3	-63.9	-175.6	0	0	111.8	E115 K121 L122 S123 P129 Y131 L215	E115-M119 HydrophobicContact CG-CE 4.18Å; E115-M119 HydrophobicContact CG-CG 4.09Å; E115-M119 WeakPolarHBondContact O-CB 3.46Å; E115-M119 VanDerWaalsContact O-CG 3.22Å; E115-M119 WeakPolarHBondContact O-CG 3.5Å; E115-M119 PolarHBondContact O-N 3.29Å; M119-K121 PolarHBondContact O-N 2.85Å; M119-L122 CarbonylContact O-C 3.57Å; M119-L122 PolarHBondContact O-N 2.71Å; M119-L122 VanDerWaalsContact O-N 3.15Å; M119-S123 WeakPolarHBondContact O-CA 3.42Å; M119-S123 WeakPolarHBondContact O-CB 3.49Å; M119-S123 PolarHBondContact O-N 3.17Å; M119-P129 HydrophobicContact CE-CG 3.71Å; M119-P129 HydrophobicContact SD-CG 3.92Å; M119-Y131 HydrophobicContact CB-CD2 3.47Å; M119-Y131 VanDerWaalsContact CB-CD2 3.47Å; M119-Y131 HydrophobicContact CB-CE2 3.91Å; M119-Y131 HydrophobicContact CB-CG 3.9Å; M119-Y131 HydrophobicContact CG-CD2 4.21Å; M119-L215 HydrophobicContact CE-CD1 3.69Å; M119-L215 HydrophobicContact CE-CG 4.39Å; M119-L215 HydrophobicContact CG-CD1 4.08Å; M119-L215 HydrophobicContact SD-CD1 3.77Å
120	R	96.7	Very high	96	Very high	113 Å²	113	43.1 Å²	43.1	43%	0.426	21%	0.208	S	C	.	.	H	α-helix	trans	-59.6	-31.4	174.3	-79.7	-169.6	-60.9	-82.5	6.4	113.9	G116 A118 S123 Y131	G116-R120 VanDerWaalsContact C-NH1 3.31Å; G116-R120 WeakPolarHBondContact O-CG 3.36Å; G116-R120 PolarHBondContact O-N 3.07Å; G116-R120 VanDerWaalsContact O-N 3.12Å; G116-R120 PolarHBondContact O-NH1 2.83Å; A118-R120 VanDerWaalsContact C-N 3.31Å; A118-R120 PolarHBondContact O-N 2.79Å; R120-S123 PolarHBondContact O-OG 3.36Å; R120-Y131 HydrophobicContact CG-CD1 4.41Å; R120-Y131 HydrophobicContact CG-CE1 3.48Å; R120-Y131 VanDerWaalsContact CG-CE1 3.48Å; R120-Y131 VanDerWaalsContact CG-OH 3.29Å; R120-Y131 WeakPolarHBondContact CG-OH 3.21Å; R120-Y131 PolarHBondContact NH1-OH 3.21Å
121	K	96.8	Very high	96	Very high	86 Å²	86	44.5 Å²	44.5	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-82.2	-32	177.6	-69.2	-172.7	164.1	-157.2	0	112	Y117 A118 M119 V186 L188	Y117-K121 HydrophobicContact CE1-CD 4.5Å; Y117-K121 HydrophobicContact CE2-CD 4.43Å; Y117-K121 VanDerWaalsContact CZ-CE 3.5Å; Y117-K121 VanDerWaalsContact OH-CE 3.25Å; Y117-K121 WeakPolarHBondContact OH-CE 3.48Å; Y117-K121 PolarHBondContact OH-NZ 3.3Å; A118-K121 WeakPolarHBondContact O-CA 3.22Å; A118-K121 WeakPolarHBondContact O-CB 3.43Å; A118-K121 PolarHBondContact O-N 3.36Å; M119-K121 PolarHBondContact O-N 2.85Å; K121-V186 HydrophobicContact CB-CB 3.98Å; K121-V186 HydrophobicContact CB-CG1 4.18Å; K121-V186 HydrophobicContact CB-CG2 4.07Å; K121-V186 HydrophobicContact CD-CB 4.3Å; K121-V186 PolarHBondContact NZ-O 3.28Å; K121-L188 HydrophobicContact CD-CD1 4.26Å
122	L	97.9	Very high	96	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-91.1	-11.7	-176.9	-69.9	176.2	0	0	0	114.3	A118 M119 K124 T125 C128 D182 L183 V186 L215	A118-L122 WeakPolarHBondContact O-CG 3.47Å; A118-L122 PolarHBondContact O-N 3.05Å; M119-L122 CarbonylContact O-C 3.57Å; M119-L122 PolarHBondContact O-N 2.71Å; M119-L122 VanDerWaalsContact O-N 3.15Å; L122-K124 PolarHBondContact O-N 3.33Å; L122-T125 HydrophobicContact CD2-CG2 4.14Å; L122-T125 PolarHBondContact O-N 3.1Å; L122-T125 PolarHBondContact O-OG1 3.21Å; L122-C128 VanDerWaalsContact C-SG 3.54Å; L122-C128 HydrophobicContact CB-CB 3.9Å; L122-C128 WeakPolarHBondContact O-CB 3.48Å; L122-D182 HydrophobicContact CD2-CB 4.13Å; L122-L183 HydrophobicContact CD1-CD1 3.87Å; L122-V186 HydrophobicContact CD2-CG1 4.3Å; L122-V186 HydrophobicContact CD2-CG2 3.85Å; L122-V186 HydrophobicContact CG-CG2 4.29Å; L122-L215 HydrophobicContact CD1-CD1 4.01Å
123	S	94.9	Very high	95.9	Very high	59 Å²	59	45 Å²	45	41%	0.413	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-11	-170	62.8	0	0	0	0	116.4	M119 R120	M119-S123 WeakPolarHBondContact O-CA 3.42Å; M119-S123 WeakPolarHBondContact O-CB 3.49Å; M119-S123 PolarHBondContact O-N 3.17Å; R120-S123 PolarHBondContact O-OG 3.36Å
124	K	91.4	Very high	95.9	Very high	196 Å²	196	41 Å²	41	85%	0.852	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.8	3.4	176.6	-60.8	-174.4	179.3	-177.1	0	113.6	L122	L122-K124 PolarHBondContact O-N 3.33Å
125	T	96.8	Very high	95.7	Very high	27 Å²	27	40.4 Å²	40.4	17%	0.166	20%	0.202	C	C	.	.	S	Bend	trans	-97.8	150.2	-178.2	81.6	0	0	0	0	110.9	L122 H127 C128 D182	L122-T125 HydrophobicContact CD2-CG2 4.14Å; L122-T125 PolarHBondContact O-N 3.1Å; L122-T125 PolarHBondContact O-OG1 3.21Å; T125-H127 PolarHBondContact O-N 2.91Å; T125-C128 PolarHBondContact O-N 3.2Å; T125-D182 VanDerWaalsContact CB-CG 3.47Å; T125-D182 WeakPolarHBondContact CB-OD2 3.21Å; T125-D182 HydrophobicContact CG2-CB 4.07Å; T125-D182 PolarHBondContact OG1-OD2 2.95Å; T125-D182 VanDerWaalsContact OG1-OD2 3.11Å
126	P	95.9	Very high	95.7	Very high	86 Å²	86	44.8 Å²	44.8	56%	0.558	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.7	-172.7	-24.9	35.5	0	0	0	114.7
127	H	97.3	Very high	95.5	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.065	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	23.7	-177.2	-66.2	-69.3	0	0	0	113.4	T125 R178 A179 D182 L210 F211 L212	T125-H127 PolarHBondContact O-N 2.91Å; H127-R178 WeakPolarHBondContact NE2-CB 3.43Å; H127-A179 HydrophobicContact CB-CB 3.54Å; H127-D182 IonicContact CD2-OD2 3.11Å; H127-L210 PolarHBondContact ND1-O 2.78Å; H127-F211 WeakPolarHBondContact O-CA 3.5Å; H127-L212 PolarHBondContact O-N 2.84Å
128	C	96.6	Very high	95	Very high	11 Å²	11	48.6 Å²	48.6	7%	0.074	24%	0.244	C	C	.	.	S	Bend	trans	-106	133.7	171	-173.5	0	0	0	0	109.7	L122 T125	L122-C128 VanDerWaalsContact C-SG 3.54Å; L122-C128 HydrophobicContact CB-CB 3.9Å; L122-C128 WeakPolarHBondContact O-CB 3.48Å; T125-C128 PolarHBondContact O-N 3.2Å
129	P	94.9	Very high	94.7	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.013	27%	0.271	C	S	.	.			trans	-65.2	157.7	170.9	31.4	-34.3	0	0	0	110.1	M119 Y131 E146 L148 F211	M119-P129 HydrophobicContact CE-CG 3.71Å; M119-P129 HydrophobicContact SD-CG 3.92Å; P129-Y131 PolarHBondContact O-N 2.86Å; P129-E146 WeakPolarHBondContact CA-OE1 3.26Å; P129-E146 HydrophobicContact CB-CG 4.05Å; P129-L148 HydrophobicContact CB-CD1 4.23Å; P129-L148 HydrophobicContact CB-CD2 4.11Å; P129-F211 HydrophobicContact CB-CB 4.32Å; P129-F211 HydrophobicContact CB-CD2 4.12Å; P129-F211 HydrophobicContact CB-CG 4.24Å
130	I	94.9	Very high	94.7	Very high	63 Å²	63	53.8 Å²	53.8	32%	0.323	27%	0.272	S	S	.	.			trans	-57.2	113.5	172.3	-62.7	172.7	0	0	0	108.6	A36 Y132 V145 E146	A36-I130 HydrophobicContact CB-CG2 4.41Å; I130-Y132 HydrophobicContact CG2-CD1 3.87Å; I130-Y132 HydrophobicContact CG2-CE1 3.47Å; I130-Y132 VanDerWaalsContact CG2-CE1 3.47Å; I130-V145 VanDerWaalsContact O-CA 3.3Å; I130-V145 WeakPolarHBondContact O-CA 3.37Å; I130-E146 HydrophobicContact CB-CB 4.14Å; I130-E146 HydrophobicContact CB-CG 3.98Å; I130-E146 WeakPolarHBondContact CG1-OE1 3.45Å; I130-E146 PolarHBondContact N-OE1 3.07Å; I130-E146 PolarHBondContact O-N 2.76Å
131	Y	95	Very high	94.7	Very high	37 Å²	37	51.7 Å²	51.7	15%	0.145	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.6	178.5	168.5	-101.4	0	0	0	109.9	M119 R120 P129 G133 S134 T143 V145	M119-Y131 HydrophobicContact CB-CD2 3.47Å; M119-Y131 VanDerWaalsContact CB-CD2 3.47Å; M119-Y131 HydrophobicContact CB-CE2 3.91Å; M119-Y131 HydrophobicContact CB-CG 3.9Å; M119-Y131 HydrophobicContact CG-CD2 4.21Å; R120-Y131 HydrophobicContact CG-CD1 4.41Å; R120-Y131 HydrophobicContact CG-CE1 3.48Å; R120-Y131 VanDerWaalsContact CG-CE1 3.48Å; R120-Y131 VanDerWaalsContact CG-OH 3.29Å; R120-Y131 WeakPolarHBondContact CG-OH 3.21Å; R120-Y131 PolarHBondContact NH1-OH 3.21Å; P129-Y131 PolarHBondContact O-N 2.86Å; Y131-G133 VanDerWaalsContact CE2-C 3.4Å; Y131-G133 WeakPolarHBondContact CE2-O 3.26Å; Y131-G133 VanDerWaalsContact CZ-CA 3.44Å; Y131-G133 VanDerWaalsContact OH-C 3.26Å; Y131-S134 VanDerWaalsContact CE2-OG 3.31Å; Y131-S134 WeakPolarHBondContact CE2-OG 3.34Å; Y131-S134 VanDerWaalsContact OH-CB 3.23Å; Y131-S134 WeakPolarHBondContact OH-CB 3.14Å; Y131-S134 PolarHBondContact OH-N 3.44Å; Y131-S134 PolarHBondContact OH-OG 3.35Å; Y131-S134 VanDerWaalsContact OH-OG 3.05Å; Y131-T143 HydrophobicContact CD2-CG2 4.26Å; Y131-T143 HydrophobicContact CE2-CG2 4.03Å; Y131-V145 HydrophobicContact CD2-CG1 4.22Å
132	Y	94.4	Very high	94.7	Very high	28 Å²	28	47.7 Å²	47.7	11%	0.11	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-29.1	-179.9	-60.3	-56.2	0	0	0	112.6	W72 L96 A98 I130 I144 E146	W72-Y132 HydrophobicContact CH2-CD1 4.11Å; W72-Y132 AromaticContact CH2-CD2 3.66Å; W72-Y132 HydrophobicContact CH2-CD2 3.66Å; W72-Y132 HydrophobicContact CH2-CE1 4.09Å; W72-Y132 AromaticContact CH2-CE2 3.6Å; W72-Y132 HydrophobicContact CH2-CE2 3.6Å; W72-Y132 AromaticContact CH2-CG 3.89Å; W72-Y132 HydrophobicContact CH2-CG 3.89Å; W72-Y132 AromaticContact CH2-CZ 3.84Å; W72-Y132 AromaticContact CZ2-CD1 3.7Å; W72-Y132 HydrophobicContact CZ2-CD1 3.7Å; W72-Y132 AromaticContact CZ2-CD2 3.57Å; W72-Y132 HydrophobicContact CZ2-CD2 3.57Å; W72-Y132 HydrophobicContact CZ2-CE1 4.15Å; W72-Y132 HydrophobicContact CZ2-CE2 4Å; W72-Y132 AromaticContact CZ2-CG 3.38Å; W72-Y132 HydrophobicContact CZ2-CG 3.38Å; W72-Y132 HydrophobicContact CZ3-CE2 4.4Å; L96-Y132 HydrophobicContact CD1-CE1 3.83Å; A98-Y132 HydrophobicContact CB-CD2 3.84Å; A98-Y132 HydrophobicContact CB-CE2 3.81Å; I130-Y132 HydrophobicContact CG2-CD1 3.87Å; I130-Y132 HydrophobicContact CG2-CE1 3.47Å; I130-Y132 VanDerWaalsContact CG2-CE1 3.47Å; Y132-I144 WeakPolarHBondContact CB-O 3.45Å; Y132-I144 HydrophobicContact CD2-CG2 4.01Å; Y132-I144 HydrophobicContact CG-CG2 4.48Å; Y132-I144 PolarHBondContact N-O 2.59Å; Y132-E146 HydrophobicContact CE2-CB 4.19Å
133	G	94	Very high	94.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.6	174.3	176.6	0	0	0	0	0	114.5	Y131 I144	Y131-G133 VanDerWaalsContact CE2-C 3.4Å; Y131-G133 WeakPolarHBondContact CE2-O 3.26Å; Y131-G133 VanDerWaalsContact CZ-CA 3.44Å; Y131-G133 VanDerWaalsContact OH-C 3.26Å; G133-I144 PolarHBondContact N-O 2.91Å; G133-I144 PolarHBondContact O-N 3.21Å
134	S	95	Very high	94.6	Very high	28 Å²	28	44.7 Å²	44.7	20%	0.196	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.9	170.9	-65.4	0	0	0	0	108.7	G116 Y131 I142 T143	G116-S134 WeakPolarHBondContact CA-OG 3.33Å; Y131-S134 VanDerWaalsContact CE2-OG 3.31Å; Y131-S134 WeakPolarHBondContact CE2-OG 3.34Å; Y131-S134 VanDerWaalsContact OH-CB 3.23Å; Y131-S134 WeakPolarHBondContact OH-CB 3.14Å; Y131-S134 PolarHBondContact OH-N 3.44Å; Y131-S134 PolarHBondContact OH-OG 3.35Å; Y131-S134 VanDerWaalsContact OH-OG 3.05Å; S134-I142 CarbonylContact C-O 3.57Å; S134-I142 WeakPolarHBondContact CA-O 3.39Å; S134-I142 WeakPolarHBondContact CB-O 3.26Å; S134-I142 PolarHBondContact OG-O 3.43Å; S134-T143 PolarHBondContact OG-OG1 2.93Å
135	A	93.6	Very high	94.8	Very high	28 Å²	28	35.4 Å²	35.4	23%	0.231	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	167.5	179.6	0	0	0	0	0	111.5	Y69 Y141 I142	Y69-A135 HydrophobicContact CD2-CB 3.85Å; Y69-A135 HydrophobicContact CE2-CB 4.13Å; A135-Y141 WeakPolarHBondContact O-CA 3.39Å; A135-I142 HydrophobicContact CB-CD1 4.35Å; A135-I142 HydrophobicContact CB-CG1 4.06Å; A135-I142 PolarHBondContact N-O 3.49Å; A135-I142 WeakPolarHBondContact O-CG1 3.24Å; A135-I142 PolarHBondContact O-N 3.41Å
136	L	94.4	Very high	94.6	Very high	92 Å²	92	34.4 Å²	34.4	48%	0.482	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.2	158.8	-177.9	66	0	0	0	107.6	Q105 C140 Y141	Q105-L136 HydrophobicContact CB-CD1 3.98Å; L136-C140 CarbonylContact C-O 3.54Å; L136-C140 WeakPolarHBondContact CA-O 3.4Å; L136-Y141 HydrophobicContact CB-CD1 4.49Å; L136-Y141 HydrophobicContact CB-CE1 4.47Å; L136-Y141 HydrophobicContact CD1-CD1 4.15Å; L136-Y141 HydrophobicContact CD1-CE1 4.14Å
137	F	92.9	Very high	94.5	Very high	39 Å²	39	30.7 Å²	30.7	17%	0.171	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	120.6	-175	-173.2	-102.8	0	0	0	109.4	L62 E66 D139 C140 I142	L62-F137 HydrophobicContact CD2-CD1 3.65Å; L62-F137 HydrophobicContact CD2-CE1 4.06Å; E66-F137 HydrophobicContact CG-CE1 3.92Å; E66-F137 HydrophobicContact CG-CZ 3.61Å; E66-F137 WeakPolarHBondContact OE2-CE1 3.39Å; F137-D139 VanDerWaalsContact C-N 3.32Å; F137-D139 PolarHBondContact O-N 3.09Å; F137-C140 PolarHBondContact N-O 3.02Å; F137-C140 WeakPolarHBondContact O-CA 3.22Å; F137-C140 VanDerWaalsContact O-CB 3.31Å; F137-C140 WeakPolarHBondContact O-CB 3.36Å; F137-C140 PolarHBondContact O-N 3.25Å; F137-I142 HydrophobicContact CB-CD1 3.91Å; F137-I142 HydrophobicContact CB-CG1 4.24Å; F137-I142 HydrophobicContact CB-CG2 4.28Å; F137-I142 HydrophobicContact CG-CD1 4.37Å
138	H	87.4	Confident	94.2	Very high	106 Å²	106	30.1 Å²	30.1	49%	0.491	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	52.3	-173.9	-60.9	-45.2	0	0	0	113.8	E66 C140	E66-H138 IonicContact OE1-CD2 3.2Å; E66-H138 PolarHBondContact OE1-CD2 3.04Å; E66-H138 IonicContact OE1-CE1 3.96Å; E66-H138 IonicContact OE1-NE2 2.78Å; E66-H138 PolarHBondContact OE1-NE2 2.78Å; E66-H138 IonicContact OE2-CD2 3.75Å; E66-H138 PolarHBondContact OE2-CD2 2.85Å; E66-H138 IonicContact OE2-NE2 3.85Å; E66-H138 PolarHBondContact OE2-NE2 3.07Å; H138-C140 PolarHBondContact O-N 3.5Å; H138-C140 PolarHBondContact O-SG 3.34Å
139	D	91.6	Very high	93.9	Very high	105 Å²	105	29.7 Å²	29.7	56%	0.561	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	17.6	-178.3	-56.2	-42	0	0	0	114.4	K104 Q105 F137	K104-D139 CarbonylContact C-O 3.54Å; Q105-D139 WeakPolarHBondContact CB-O 3.4Å; Q105-D139 HydrophobicContact CG-CB 4.23Å; Q105-D139 WeakPolarHBondContact CG-O 3.45Å; Q105-D139 PolarHBondContact N-O 2.63Å; Q105-D139 VanDerWaalsContact NE2-CB 3.27Å; Q105-D139 VanDerWaalsContact NE2-CG 3.27Å; Q105-D139 PolarHBondContact NE2-OD1 3.46Å; F137-D139 VanDerWaalsContact C-N 3.32Å; F137-D139 PolarHBondContact O-N 3.09Å
140	C	95.3	Very high	93.7	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.027	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.5	174.6	-62.1	0	0	0	0	110.1	C103 L136 F137 H138 I142	C103-C140 CarbonylContact O-C 3.55Å; C103-C140 WeakPolarHBondContact O-CA 3.25Å; L136-C140 CarbonylContact C-O 3.54Å; L136-C140 WeakPolarHBondContact CA-O 3.4Å; F137-C140 PolarHBondContact N-O 3.02Å; F137-C140 WeakPolarHBondContact O-CA 3.22Å; F137-C140 VanDerWaalsContact O-CB 3.31Å; F137-C140 WeakPolarHBondContact O-CB 3.36Å; F137-C140 PolarHBondContact O-N 3.25Å; H138-C140 PolarHBondContact O-N 3.5Å; H138-C140 PolarHBondContact O-SG 3.34Å; C140-I142 HydrophobicContact CB-CG2 4.42Å; C140-I142 PolarHBondContact O-N 3.35Å
141	Y	97.1	Very high	93.5	Very high	69 Å²	69	27.3 Å²	27.3	27%	0.271	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	130.5	160.1	-69.3	-65.6	0	0	0	108	A102 C103 Q105 N110 V112 Y113 A135 L136	A102-Y141 CarbonylContact C-O 3.55Å; A102-Y141 WeakPolarHBondContact CA-O 3.45Å; C103-Y141 PolarHBondContact N-O 3.33Å; C103-Y141 PolarHBondContact O-N 2.86Å; Q105-Y141 HydrophobicContact CB-CD2 4.2Å; Q105-Y141 HydrophobicContact CB-CE2 3.89Å; N110-Y141 HydrophobicContact CB-CD2 4.29Å; N110-Y141 WeakPolarHBondContact ND2-CD2 3.28Å; V112-Y141 WeakPolarHBondContact CG1-O 3.26Å; Y113-Y141 AromaticContact CD2-CD1 3.91Å; Y113-Y141 HydrophobicContact CD2-CD1 3.91Å; Y113-Y141 HydrophobicContact CD2-CD2 4.45Å; Y113-Y141 AromaticContact CD2-CE1 3.69Å; Y113-Y141 HydrophobicContact CD2-CE1 3.69Å; Y113-Y141 HydrophobicContact CD2-CE2 4.24Å; Y113-Y141 HydrophobicContact CD2-CG 4.29Å; Y113-Y141 AromaticContact CD2-CZ 3.86Å; Y113-Y141 HydrophobicContact CE2-CE1 4.29Å; A135-Y141 WeakPolarHBondContact O-CA 3.39Å; L136-Y141 HydrophobicContact CB-CD1 4.49Å; L136-Y141 HydrophobicContact CB-CE1 4.47Å; L136-Y141 HydrophobicContact CD1-CD1 4.15Å; L136-Y141 HydrophobicContact CD1-CE1 4.14Å
142	I	96.5	Very high	93.5	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.9	175.2	67.3	169.1	0	0	0	111	L62 A68 V100 R101 A102 S134 A135 F137 C140 I144	L62-I142 HydrophobicContact CD1-CG2 4.31Å; L62-I142 HydrophobicContact CD2-CG2 4.25Å; A68-I142 HydrophobicContact CB-CD1 3.99Å; V100-I142 HydrophobicContact CG1-CB 4.11Å; V100-I142 HydrophobicContact CG1-CG2 4.36Å; R101-I142 CarbonylContact O-C 3.58Å; R101-I142 WeakPolarHBondContact O-CA 3.42Å; A102-I142 HydrophobicContact CB-CG2 3.9Å; S134-I142 CarbonylContact C-O 3.57Å; S134-I142 WeakPolarHBondContact CA-O 3.39Å; S134-I142 WeakPolarHBondContact CB-O 3.26Å; S134-I142 PolarHBondContact OG-O 3.43Å; A135-I142 HydrophobicContact CB-CD1 4.35Å; A135-I142 HydrophobicContact CB-CG1 4.06Å; A135-I142 PolarHBondContact N-O 3.49Å; A135-I142 WeakPolarHBondContact O-CG1 3.24Å; A135-I142 PolarHBondContact O-N 3.41Å; F137-I142 HydrophobicContact CB-CD1 3.91Å; F137-I142 HydrophobicContact CB-CG1 4.24Å; F137-I142 HydrophobicContact CB-CG2 4.28Å; F137-I142 HydrophobicContact CG-CD1 4.37Å; C140-I142 HydrophobicContact CB-CG2 4.42Å; C140-I142 PolarHBondContact O-N 3.35Å; I142-I144 HydrophobicContact CD1-CD1 4.15Å; I142-I144 HydrophobicContact CD1-CG1 4.4Å
143	T	96	Very high	93.4	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.5	169.7	-66.6	0	0	0	0	108.5	V100 R101 V112 E115 G116 Y131 S134 V145	V100-T143 WeakPolarHBondContact CA-O 3.23Å; R101-T143 PolarHBondContact N-O 2.93Å; R101-T143 PolarHBondContact O-N 3.36Å; V112-T143 PolarHBondContact O-OG1 2.98Å; E115-T143 HydrophobicContact CG-CG2 4.42Å; G116-T143 WeakPolarHBondContact CA-OG1 3.34Å; Y131-T143 HydrophobicContact CD2-CG2 4.26Å; Y131-T143 HydrophobicContact CE2-CG2 4.03Å; S134-T143 PolarHBondContact OG-OG1 2.93Å; T143-V145 HydrophobicContact CG2-CG1 4.03Å
144	I	95.7	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.6	-172.8	-45.5	-177.2	0	0	0	108	A68 W72 A98 I99 V100 Y132 G133 I142	A68-I144 HydrophobicContact CB-CD1 4.41Å; W72-I144 HydrophobicContact CB-CD1 4.32Å; W72-I144 HydrophobicContact CD2-CG2 3.99Å; W72-I144 HydrophobicContact CG-CD1 4.01Å; W72-I144 HydrophobicContact CG-CG2 4.1Å; A98-I144 HydrophobicContact CB-CG2 3.62Å; I99-I144 WeakPolarHBondContact O-CA 3.47Å; V100-I144 HydrophobicContact CG1-CG1 4.35Å; V100-I144 HydrophobicContact CG2-CG1 4.12Å; V100-I144 HydrophobicContact CG2-CG2 4.11Å; Y132-I144 WeakPolarHBondContact CB-O 3.45Å; Y132-I144 HydrophobicContact CD2-CG2 4.01Å; Y132-I144 HydrophobicContact CG-CG2 4.48Å; Y132-I144 PolarHBondContact N-O 2.59Å; G133-I144 PolarHBondContact N-O 2.91Å; G133-I144 PolarHBondContact O-N 3.21Å; I142-I144 HydrophobicContact CD1-CD1 4.15Å; I142-I144 HydrophobicContact CD1-CG1 4.4Å
145	V	95	Very high	93	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	165	-176	-63	0	0	0	0	110.9	A98 I99 I130 Y131 T143 Y362	A98-V145 CarbonylContact C-O 3.6Å; A98-V145 VanDerWaalsContact CA-O 3.24Å; A98-V145 WeakPolarHBondContact CA-O 3.01Å; A98-V145 WeakPolarHBondContact CB-O 3.44Å; I99-V145 HydrophobicContact CB-CG2 4.24Å; I99-V145 PolarHBondContact N-O 3.38Å; I99-V145 PolarHBondContact O-N 3.33Å; I130-V145 VanDerWaalsContact O-CA 3.3Å; I130-V145 WeakPolarHBondContact O-CA 3.37Å; Y131-V145 HydrophobicContact CD2-CG1 4.22Å; T143-V145 HydrophobicContact CG2-CG1 4.03Å; V145-Y362 HydrophobicContact CG2-CD2 4.38Å; V145-Y362 HydrophobicContact CG2-CE2 3.38Å; V145-Y362 WeakPolarHBondContact CG2-OH 3.36Å
146	E	93.7	Very high	93	Very high	6 Å²	6	26.8 Å²	26.8	3%	0.028	13%	0.127	C	C	.	.			trans	-62	150.1	173	65.6	178.5	148.1	0	0	112.7	P129 I130 Y132 L148 F211	P129-E146 WeakPolarHBondContact CA-OE1 3.26Å; P129-E146 HydrophobicContact CB-CG 4.05Å; I130-E146 HydrophobicContact CB-CB 4.14Å; I130-E146 HydrophobicContact CB-CG 3.98Å; I130-E146 WeakPolarHBondContact CG1-OE1 3.45Å; I130-E146 PolarHBondContact N-OE1 3.07Å; I130-E146 PolarHBondContact O-N 2.76Å; Y132-E146 HydrophobicContact CE2-CB 4.19Å; E146-L148 HydrophobicContact CG-CD2 3.93Å; E146-F211 WeakPolarHBondContact OE1-CE2 3.1Å
147	P	92.8	Very high	92.8	Very high	8 Å²	8	24.6 Å²	24.6	5%	0.052	12%	0.119	C	C	.	.			trans	-65	145.6	169.6	-17.4	31.9	0	0	0	111.2	S97 I99 L202	S97-P147 WeakPolarHBondContact O-CD 3.36Å; S97-P147 WeakPolarHBondContact OG-CG 3.31Å; I99-P147 HydrophobicContact CD1-CB 4.5Å; I99-P147 HydrophobicContact CG1-CB 4.28Å; P147-L202 HydrophobicContact CB-CD1 4.04Å; P147-L202 WeakPolarHBondContact O-CD1 3.46Å
148	L	91.6	Very high	92.6	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	13%	0.127	C	C	.	.			trans	-120.8	161.7	-175.9	-59.6	-177.3	0	0	0	111.9	P129 E146 A199 F211 T213 Y361 Y362	P129-L148 HydrophobicContact CB-CD1 4.23Å; P129-L148 HydrophobicContact CB-CD2 4.11Å; E146-L148 HydrophobicContact CG-CD2 3.93Å; L148-A199 HydrophobicContact CB-CB 4.06Å; L148-A199 HydrophobicContact CD1-CB 3.98Å; L148-F211 HydrophobicContact CD2-CD2 3.52Å; L148-F211 HydrophobicContact CD2-CE2 4Å; L148-T213 HydrophobicContact CD1-CG2 3.46Å; L148-T213 VanDerWaalsContact CD1-CG2 3.46Å; L148-Y361 CarbonylContact C-O 3.52Å; L148-Y361 PolarHBondContact O-N 3.22Å; L148-Y362 HydrophobicContact CD1-CD2 4.31Å; L148-Y362 HydrophobicContact CD1-CE2 4.14Å; L148-Y362 HydrophobicContact CG-CD2 4.41Å
149	G	90	Very high	92.7	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.01	11%	0.106	C	C	.	.			trans	-81.4	-171.4	175.1	0	0	0	0	0	112	L200	G149-L200 WeakPolarHBondContact CA-O 3.31Å; G149-L200 PolarHBondContact N-O 3.09Å
150	P	90.1	Very high	92.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.12	C	C	.	.			trans	-60.9	147.2	178.5	26.8	-35.4	0	0	0	112	R154 L155 L200 I356 L357 Y361	P150-R154 HydrophobicContact CB-CB 4.36Å; P150-R154 HydrophobicContact CB-CG 4.15Å; P150-L155 HydrophobicContact CB-CD2 4.17Å; P150-L155 HydrophobicContact CB-CG 4.07Å; P150-L155 HydrophobicContact CG-CD1 4.39Å; P150-L155 HydrophobicContact CG-CD2 3.65Å; P150-L155 HydrophobicContact CG-CG 3.96Å; P150-L200 HydrophobicContact CG-CD1 4.33Å; P150-L200 PolarHBondContact O-N 2.85Å; P150-L200 VanDerWaalsContact O-N 3.13Å; P150-I356 HydrophobicContact CG-CG2 4.47Å; P150-L357 HydrophobicContact CG-CD2 4.23Å; P150-Y361 VanDerWaalsContact CA-CD2 3.48Å; P150-Y361 HydrophobicContact CB-CD2 3.68Å; P150-Y361 HydrophobicContact CB-CE2 3.83Å; P150-Y361 HydrophobicContact CB-CG 4.49Å; P150-Y361 HydrophobicContact CG-CD2 4.48Å
151	D	92.2	Very high	92.2	Very high	15 Å²	15	28.7 Å²	28.7	8%	0.08	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-78.5	163.2	171.2	67	67.9	0	0	0	112.5	H153 R154 L155 F198 C363	D151-H153 VanDerWaalsContact C-N 3.27Å; D151-H153 PolarHBondContact O-N 2.96Å; D151-H153 WeakPolarHBondContact OD1-CA 3.44Å; D151-H153 VanDerWaalsContact OD1-CB 3.27Å; D151-H153 WeakPolarHBondContact OD1-CB 3.4Å; D151-H153 PolarHBondContact OD1-N 3.26Å; D151-R154 WeakPolarHBondContact O-CB 3.32Å; D151-R154 PolarHBondContact O-N 3.26Å; D151-R154 VanDerWaalsContact O-N 3.14Å; D151-R154 PolarHBondContact OD1-N 3.45Å; D151-L155 WeakPolarHBondContact O-CG 3.38Å; D151-L155 PolarHBondContact O-N 3.34Å; D151-F198 CarbonylContact C-O 3.53Å; D151-F198 WeakPolarHBondContact CA-O 3.33Å; D151-F198 WeakPolarHBondContact CB-O 3.3Å; D151-C363 PolarHBondContact OD2-SG 3.33Å; D151-C363 VanDerWaalsContact OD2-SG 3.41Å
152	L	94.7	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-31.8	-178.4	-65.4	-173.6	0	0	0	113.3	R154 L155 R156 L172 G195 F198 L210 F270	L152-R154 VanDerWaalsContact C-N 3.35Å; L152-L155 HydrophobicContact CD2-CD1 4.05Å; L152-R156 WeakPolarHBondContact O-CB 3.31Å; L152-R156 PolarHBondContact O-N 2.77Å; L152-L172 HydrophobicContact CD2-CD1 3.84Å; L152-L172 HydrophobicContact CD2-CD2 3.97Å; L152-L172 HydrophobicContact CD2-CG 4.36Å; L152-G195 WeakPolarHBondContact CA-O 3.42Å; L152-G195 WeakPolarHBondContact CB-O 3.47Å; L152-G195 PolarHBondContact N-O 3.18Å; L152-F198 HydrophobicContact CD1-CB 3.66Å; L152-F198 HydrophobicContact CD1-CD2 4.28Å; L152-F198 HydrophobicContact CD1-CG 4.18Å; L152-F198 HydrophobicContact CG-CB 3.78Å; L152-F198 PolarHBondContact N-O 2.72Å; L152-L210 HydrophobicContact CD1-CD1 3.81Å; L152-L210 HydrophobicContact CD1-CD2 4.44Å; L152-L210 HydrophobicContact CD2-CD1 4.15Å; L152-L210 HydrophobicContact CD2-CD2 3.59Å; L152-L210 HydrophobicContact CG-CD1 4.31Å; L152-L210 HydrophobicContact CG-CD2 4.04Å; L152-F270 HydrophobicContact CB-CE1 4.21Å; L152-F270 HydrophobicContact CB-CZ 4.12Å; L152-F270 HydrophobicContact CD1-CE1 4.28Å; L152-F270 HydrophobicContact CD1-CE2 3.91Å; L152-F270 HydrophobicContact CD1-CZ 3.41Å; L152-F270 VanDerWaalsContact CD1-CZ 3.41Å; L152-F270 HydrophobicContact CG-CZ 4.39Å
153	H	92.6	Very high	91.9	Very high	54 Å²	54	33 Å²	33	25%	0.25	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-42	175.5	169	73.5	0	0	0	110.7	D151 C157 G195 K196	D151-H153 VanDerWaalsContact C-N 3.27Å; D151-H153 PolarHBondContact O-N 2.96Å; D151-H153 WeakPolarHBondContact OD1-CA 3.44Å; D151-H153 VanDerWaalsContact OD1-CB 3.27Å; D151-H153 WeakPolarHBondContact OD1-CB 3.4Å; D151-H153 PolarHBondContact OD1-N 3.26Å; H153-C157 WeakPolarHBondContact O-CB 3.46Å; H153-C157 PolarHBondContact O-N 2.77Å; H153-C157 PolarHBondContact O-SG 2.92Å; H153-G195 PolarHBondContact N-O 2.95Å; H153-K196 HydrophobicContact CB-CG 3.87Å; H153-K196 WeakPolarHBondContact CD2-CE 3.38Å
154	R	89.1	Confident	91.8	Very high	55 Å²	55	33.2 Å²	33.2	21%	0.208	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-52.9	175.2	179.4	60.2	176.6	156.1	15.6	111.2	P150 D151 L152 R156 C157 E158 Y361	P150-R154 HydrophobicContact CB-CB 4.36Å; P150-R154 HydrophobicContact CB-CG 4.15Å; D151-R154 WeakPolarHBondContact O-CB 3.32Å; D151-R154 PolarHBondContact O-N 3.26Å; D151-R154 VanDerWaalsContact O-N 3.14Å; D151-R154 PolarHBondContact OD1-N 3.45Å; L152-R154 VanDerWaalsContact C-N 3.35Å; R154-R156 VanDerWaalsContact C-N 3.26Å; R154-R156 PolarHBondContact O-N 3Å; R154-C157 PolarHBondContact O-N 2.88Å; R154-C157 VanDerWaalsContact O-N 3.1Å; R154-E158 IonicContact CZ-OE1 3.37Å; R154-E158 IonicContact CZ-OE2 3.09Å; R154-E158 IonicContact NE-OE1 3.46Å; R154-E158 IonicContact NH1-OE1 3.65Å; R154-E158 PolarHBondContact NH1-OE1 2.96Å; R154-E158 IonicContact NH2-OE1 2.63Å; R154-E158 PolarHBondContact NH2-OE1 3.39Å; R154-E158 IonicContact NH2-OE2 2.78Å; R154-E158 PolarHBondContact NH2-OE2 3.09Å; R154-E158 VanDerWaalsContact NH2-OE2 3.11Å; R154-E158 WeakPolarHBondContact O-CG 3.43Å; R154-E158 PolarHBondContact O-N 3.25Å; R154-E158 VanDerWaalsContact O-N 3.17Å; R154-Y361 HydrophobicContact CG-CE1 4.39Å
155	L	91.1	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-53.9	-46.8	179.7	-73.4	167.6	0	0	0	111.2	P150 D151 L152 C157 E158 M159 F164 L200 W349 I356	P150-L155 HydrophobicContact CB-CD2 4.17Å; P150-L155 HydrophobicContact CB-CG 4.07Å; P150-L155 HydrophobicContact CG-CD1 4.39Å; P150-L155 HydrophobicContact CG-CD2 3.65Å; P150-L155 HydrophobicContact CG-CG 3.96Å; D151-L155 WeakPolarHBondContact O-CG 3.38Å; D151-L155 PolarHBondContact O-N 3.34Å; L152-L155 HydrophobicContact CD2-CD1 4.05Å; L155-C157 PolarHBondContact O-N 2.76Å; L155-E158 PolarHBondContact O-N 2.88Å; L155-M159 WeakPolarHBondContact O-CE 3.49Å; L155-M159 PolarHBondContact O-N 3.03Å; L155-F164 HydrophobicContact CB-CE1 4.23Å; L155-F164 HydrophobicContact CB-CZ 3.92Å; L155-L200 HydrophobicContact CD1-CD1 3.5Å; L155-L200 HydrophobicContact CD1-CG 3.87Å; L155-L200 HydrophobicContact CD2-CD1 4.29Å; L155-L200 HydrophobicContact CG-CD1 4.47Å; L155-W349 HydrophobicContact CB-CE3 4.33Å; L155-W349 HydrophobicContact CB-CZ3 4.5Å; L155-W349 HydrophobicContact CD1-CD2 4.31Å; L155-W349 HydrophobicContact CD1-CE3 4.13Å; L155-W349 HydrophobicContact CD1-CH2 3.99Å; L155-W349 HydrophobicContact CD1-CZ2 4.21Å; L155-W349 HydrophobicContact CD1-CZ3 3.96Å; L155-W349 HydrophobicContact CD2-CB 4.17Å; L155-W349 HydrophobicContact CD2-CD2 3.87Å; L155-W349 HydrophobicContact CD2-CE3 4.04Å; L155-W349 HydrophobicContact CD2-CG 3.94Å; L155-W349 HydrophobicContact CG-CE3 4.4Å; L155-I356 HydrophobicContact CD2-CG2 4.14Å
156	R	93.2	Very high	91.4	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.011	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-45.9	177.9	-174.8	-178.8	67.5	73.6	-5.2	111.9	L152 R154 E158 M159 R162 F164 E269 G273	L152-R156 WeakPolarHBondContact O-CB 3.31Å; L152-R156 PolarHBondContact O-N 2.77Å; R154-R156 VanDerWaalsContact C-N 3.26Å; R154-R156 PolarHBondContact O-N 3Å; R156-E158 PolarHBondContact O-N 2.8Å; R156-M159 WeakPolarHBondContact O-CB 3.28Å; R156-M159 PolarHBondContact O-N 3.09Å; R156-R162 VanDerWaalsContact CD-O 3.24Å; R156-R162 WeakPolarHBondContact CD-O 3.25Å; R156-R162 WeakPolarHBondContact CG-O 3.49Å; R156-R162 PolarHBondContact NH1-O 2.63Å; R156-R162 WeakPolarHBondContact O-CA 3.36Å; R156-F164 HydrophobicContact CB-CE1 4.44Å; R156-F164 HydrophobicContact CB-CE2 3.85Å; R156-F164 HydrophobicContact CB-CZ 3.68Å; R156-F164 HydrophobicContact CG-CE2 4.28Å; R156-F164 HydrophobicContact CG-CZ 4.43Å; R156-E269 IonicContact CZ-OE1 3.87Å; R156-E269 IonicContact CZ-OE2 2.69Å; R156-E269 IonicContact NE-OE2 2.85Å; R156-E269 PolarHBondContact NE-OE2 3.12Å; R156-E269 IonicContact NH2-OE1 3.45Å; R156-E269 PolarHBondContact NH2-OE1 3.31Å; R156-E269 VanDerWaalsContact NH2-OE1 3.12Å; R156-E269 IonicContact NH2-OE2 2.75Å; R156-E269 PolarHBondContact NH2-OE2 2.92Å; R156-G273 PolarHBondContact NH1-O 2.83Å
157	C	90.1	Very high	91.3	Very high	45 Å²	45	42 Å²	42	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-24.3	179	-72.9	0	0	0	0	113.8	H153 R154 L155	H153-C157 WeakPolarHBondContact O-CB 3.46Å; H153-C157 PolarHBondContact O-N 2.77Å; H153-C157 PolarHBondContact O-SG 2.92Å; R154-C157 PolarHBondContact O-N 2.88Å; R154-C157 VanDerWaalsContact O-N 3.1Å; L155-C157 PolarHBondContact O-N 2.76Å
158	E	88.4	Confident	91.3	Very high	74 Å²	74	41.6 Å²	41.6	35%	0.346	21%	0.208	S	C	.	.	H	α-helix	trans	-85	-11.7	177.1	-61.6	-68.4	116.1	0	0	112.9	R154 L155 R156 I356	R154-E158 IonicContact CZ-OE1 3.37Å; R154-E158 IonicContact CZ-OE2 3.09Å; R154-E158 IonicContact NE-OE1 3.46Å; R154-E158 IonicContact NH1-OE1 3.65Å; R154-E158 PolarHBondContact NH1-OE1 2.96Å; R154-E158 IonicContact NH2-OE1 2.63Å; R154-E158 PolarHBondContact NH2-OE1 3.39Å; R154-E158 IonicContact NH2-OE2 2.78Å; R154-E158 PolarHBondContact NH2-OE2 3.09Å; R154-E158 VanDerWaalsContact NH2-OE2 3.11Å; R154-E158 WeakPolarHBondContact O-CG 3.43Å; R154-E158 PolarHBondContact O-N 3.25Å; R154-E158 VanDerWaalsContact O-N 3.17Å; L155-E158 PolarHBondContact O-N 2.88Å; R156-E158 PolarHBondContact O-N 2.8Å; E158-I356 HydrophobicContact CB-CD1 4.06Å; E158-I356 HydrophobicContact CG-CD1 4.38Å
159	M	89.9	Confident	91.5	Very high	9 Å²	9	41.5 Å²	41.5	4%	0.044	21%	0.208	C	C	.	.	S	Bend	trans	-75	144.7	175.3	-59	-59.5	95.5	0	0	110.6	L155 R156 S161 R162 S163 F164 D348 W349 Y352	L155-M159 WeakPolarHBondContact O-CE 3.49Å; L155-M159 PolarHBondContact O-N 3.03Å; R156-M159 WeakPolarHBondContact O-CB 3.28Å; R156-M159 PolarHBondContact O-N 3.09Å; M159-S161 VanDerWaalsContact C-N 3.32Å; M159-S161 PolarHBondContact O-N 2.92Å; M159-R162 WeakPolarHBondContact O-CA 3.41Å; M159-R162 PolarHBondContact O-N 3.14Å; M159-S163 WeakPolarHBondContact CB-O 3.2Å; M159-S163 WeakPolarHBondContact CG-O 3.48Å; M159-F164 HydrophobicContact CG-CD1 3.71Å; M159-F164 HydrophobicContact CG-CE1 3.64Å; M159-F164 HydrophobicContact SD-CD1 4.22Å; M159-F164 HydrophobicContact SD-CE1 4.22Å; M159-D348 HydrophobicContact SD-CB 3.66Å; M159-W349 HydrophobicContact CE-CB 4.21Å; M159-Y352 HydrophobicContact CE-CD2 4.31Å; M159-Y352 HydrophobicContact CE-CE2 4.38Å; M159-Y352 HydrophobicContact SD-CE2 4.24Å
160	Q	86.6	Confident	91.7	Very high	181 Å²	181	42.2 Å²	42.2	85%	0.846	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-44.5	-175.2	-176.5	64.3	34.9	0	0	113.3
161	S	90.3	Very high	92	Very high	77 Å²	77	45 Å²	45	54%	0.538	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.3	178.7	51.8	0	0	0	0	113.2	M159 S163	M159-S161 VanDerWaalsContact C-N 3.32Å; M159-S161 PolarHBondContact O-N 2.92Å; S161-S163 WeakPolarHBondContact CB-OG 3.44Å; S161-S163 PolarHBondContact O-N 3.03Å; S161-S163 VanDerWaalsContact O-N 3.1Å; S161-S163 PolarHBondContact OG-OG 3.28Å
162	R	93.3	Very high	92.2	Very high	140 Å²	140	44.3 Å²	44.3	53%	0.528	22%	0.223	S	C	.	.	S	Bend	trans	52.5	23.7	-167.4	-56.8	-177	175.3	-177.5	0.2	113.8	R156 M159 G273	R156-R162 VanDerWaalsContact CD-O 3.24Å; R156-R162 WeakPolarHBondContact CD-O 3.25Å; R156-R162 WeakPolarHBondContact CG-O 3.49Å; R156-R162 PolarHBondContact NH1-O 2.63Å; R156-R162 WeakPolarHBondContact O-CA 3.36Å; M159-R162 WeakPolarHBondContact O-CA 3.41Å; M159-R162 PolarHBondContact O-N 3.14Å; R162-G273 WeakPolarHBondContact O-CA 3.43Å
163	S	94.2	Very high	92.4	Very high	19 Å²	19	44.3 Å²	44.3	13%	0.133	22%	0.223	C	C	.	.	S	Bend	trans	-129.9	166.1	174.7	66.6	0	0	0	0	109.3	M159 S161 F270 M271	M159-S163 WeakPolarHBondContact CB-O 3.2Å; M159-S163 WeakPolarHBondContact CG-O 3.48Å; S161-S163 WeakPolarHBondContact CB-OG 3.44Å; S161-S163 PolarHBondContact O-N 3.03Å; S161-S163 VanDerWaalsContact O-N 3.1Å; S161-S163 PolarHBondContact OG-OG 3.28Å; S163-F270 CarbonylContact C-O 3.49Å; S163-F270 WeakPolarHBondContact CA-O 3.47Å; S163-F270 WeakPolarHBondContact CB-O 3.48Å; S163-M271 WeakPolarHBondContact CB-O 3.43Å
164	F	93.2	Very high	92.7	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.031	21%	0.214	C	C	.	.			trans	-102	158.3	172.4	-62.1	-59.1	0	0	0	110.3	L155 R156 M159 T168 A169 L172 F270 D348 W349	L155-F164 HydrophobicContact CB-CE1 4.23Å; L155-F164 HydrophobicContact CB-CZ 3.92Å; R156-F164 HydrophobicContact CB-CE1 4.44Å; R156-F164 HydrophobicContact CB-CE2 3.85Å; R156-F164 HydrophobicContact CB-CZ 3.68Å; R156-F164 HydrophobicContact CG-CE2 4.28Å; R156-F164 HydrophobicContact CG-CZ 4.43Å; M159-F164 HydrophobicContact CG-CD1 3.71Å; M159-F164 HydrophobicContact CG-CE1 3.64Å; M159-F164 HydrophobicContact SD-CD1 4.22Å; M159-F164 HydrophobicContact SD-CE1 4.22Å; F164-T168 HydrophobicContact CB-CG2 3.8Å; F164-T168 HydrophobicContact CD1-CG2 3.76Å; F164-T168 HydrophobicContact CD2-CG2 4.46Å; F164-T168 HydrophobicContact CE1-CG2 4.46Å; F164-T168 HydrophobicContact CG-CG2 3.76Å; F164-A169 HydrophobicContact CB-CB 4.31Å; F164-L172 HydrophobicContact CD2-CD1 3.83Å; F164-L172 HydrophobicContact CE2-CD1 3.67Å; F164-L172 HydrophobicContact CG-CD1 4.4Å; F164-L172 HydrophobicContact CZ-CD1 4.11Å; F164-F270 HydrophobicContact CD2-CB 3.89Å; F164-F270 HydrophobicContact CD2-CD1 4.05Å; F164-F270 AromaticContact CD2-CG 3.98Å; F164-F270 HydrophobicContact CD2-CG 3.98Å; F164-F270 AromaticContact CE2-CD1 3.88Å; F164-F270 HydrophobicContact CE2-CD1 3.88Å; F164-F270 HydrophobicContact CE2-CE1 4.33Å; F164-F270 HydrophobicContact CE2-CG 4.21Å; F164-F270 PolarHBondContact N-O 2.66Å; F164-D348 WeakPolarHBondContact CA-OD2 3.34Å; F164-D348 WeakPolarHBondContact CB-OD2 3.47Å; F164-D348 HydrophobicContact CD1-CB 4.37Å; F164-W349 HydrophobicContact CD1-CZ3 4.42Å; F164-W349 HydrophobicContact CE1-CE3 4.03Å; F164-W349 AromaticContact CE1-CZ3 3.86Å; F164-W349 HydrophobicContact CE1-CZ3 3.86Å; F164-W349 HydrophobicContact CZ-CZ3 4.21Å
165	T	91.5	Very high	93.1	Very high	67 Å²	67	40.6 Å²	40.6	41%	0.411	21%	0.209	S	C	.	.			trans	-61.1	153.8	164.7	64.9	0	0	0	0	110.1	H167 T168 A169 D348	T165-H167 PolarHBondContact O-N 3.17Å; T165-T168 PolarHBondContact O-N 3.11Å; T165-T168 PolarHBondContact OG1-N 3.41Å; T165-T168 PolarHBondContact OG1-OG1 2.74Å; T165-A169 WeakPolarHBondContact O-CB 3.03Å; T165-A169 PolarHBondContact O-N 2.91Å; T165-D348 WeakPolarHBondContact CB-OD1 3.33Å; T165-D348 VanDerWaalsContact CG2-OD1 3.28Å; T165-D348 WeakPolarHBondContact CG2-OD1 3.4Å; T165-D348 PolarHBondContact N-OD2 2.87Å; T165-D348 PolarHBondContact OG1-OD1 2.87Å
166	D	91.2	Very high	93.5	Very high	64 Å²	64	40.6 Å²	40.6	34%	0.342	21%	0.209	S	C	.	.	H	α-helix	trans	-55.2	-38	179.6	-70	-25.5	0	0	0	112.3	A169 V170	D166-A169 PolarHBondContact O-N 3.23Å; D166-V170 VanDerWaalsContact O-CB 3.26Å; D166-V170 WeakPolarHBondContact O-CB 3.31Å; D166-V170 VanDerWaalsContact O-CG2 3.22Å; D166-V170 WeakPolarHBondContact O-CG2 3.32Å; D166-V170 PolarHBondContact O-N 3.38Å
167	H	91.1	Very high	93.7	Very high	60 Å²	60	40.4 Å²	40.4	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-57.7	-51.9	174.7	174.4	-91.6	0	0	0	112	T165 N171 C345	T165-H167 PolarHBondContact O-N 3.17Å; H167-N171 WeakPolarHBondContact O-CB 3.22Å; H167-N171 PolarHBondContact O-N 3Å; H167-C345 PolarHBondContact CE1-O 3.26Å
168	T	92.5	Very high	94.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-44.8	179.3	-65.6	0	0	0	0	110.7	F164 T165 V170 N171 L172 L347 D348 W349	F164-T168 HydrophobicContact CB-CG2 3.8Å; F164-T168 HydrophobicContact CD1-CG2 3.76Å; F164-T168 HydrophobicContact CD2-CG2 4.46Å; F164-T168 HydrophobicContact CE1-CG2 4.46Å; F164-T168 HydrophobicContact CG-CG2 3.76Å; T165-T168 PolarHBondContact O-N 3.11Å; T165-T168 PolarHBondContact OG1-N 3.41Å; T165-T168 PolarHBondContact OG1-OG1 2.74Å; T168-V170 PolarHBondContact O-N 3.34Å; T168-N171 PolarHBondContact O-N 3Å; T168-L172 HydrophobicContact CG2-CD1 3.75Å; T168-L172 HydrophobicContact CG2-CG 4.24Å; T168-L172 VanDerWaalsContact O-CG 3.23Å; T168-L172 WeakPolarHBondContact O-CG 3.13Å; T168-L172 PolarHBondContact O-N 3.32Å; T168-L347 HydrophobicContact CG2-CD2 4.28Å; T168-D348 HydrophobicContact CG2-CB 4.41Å; T168-D348 PolarHBondContact OG1-N 3.36Å; T168-D348 VanDerWaalsContact OG1-N 3.08Å; T168-D348 PolarHBondContact OG1-OD1 3.35Å; T168-W349 HydrophobicContact CG2-CH2 4.36Å; T168-W349 HydrophobicContact CG2-CZ3 3.8Å
169	A	95.5	Very high	94.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-58.7	-45.5	178.7	0	0	0	0	0	112.2	F164 T165 D166 L172 A173 F270 M271	F164-A169 HydrophobicContact CB-CB 4.31Å; T165-A169 WeakPolarHBondContact O-CB 3.03Å; T165-A169 PolarHBondContact O-N 2.91Å; D166-A169 PolarHBondContact O-N 3.23Å; A169-L172 PolarHBondContact O-N 3.39Å; A169-A173 WeakPolarHBondContact O-CB 3.19Å; A169-A173 PolarHBondContact O-N 2.9Å; A169-F270 HydrophobicContact CB-CB 4.04Å; A169-M271 HydrophobicContact CB-CG 3.88Å
170	V	95.6	Very high	95.1	Very high	15 Å²	15	39.7 Å²	39.7	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-46.9	176.7	165.6	0	0	0	0	111.1	D166 T168 L172 A173 V174 I331 I334 A335	D166-V170 VanDerWaalsContact O-CB 3.26Å; D166-V170 WeakPolarHBondContact O-CB 3.31Å; D166-V170 VanDerWaalsContact O-CG2 3.22Å; D166-V170 WeakPolarHBondContact O-CG2 3.32Å; D166-V170 PolarHBondContact O-N 3.38Å; T168-V170 PolarHBondContact O-N 3.34Å; V170-L172 PolarHBondContact O-N 3.36Å; V170-A173 PolarHBondContact O-N 3.23Å; V170-V174 WeakPolarHBondContact O-CG2 3.39Å; V170-V174 PolarHBondContact O-N 2.81Å; V170-I331 HydrophobicContact CB-CG2 4.36Å; V170-I331 HydrophobicContact CG1-CG2 4.08Å; V170-I331 HydrophobicContact CG2-CG2 4.31Å; V170-I331 WeakPolarHBondContact CG2-O 3.38Å; V170-I334 HydrophobicContact CG2-CB 3.74Å; V170-I334 HydrophobicContact CG2-CG2 3.89Å; V170-A335 HydrophobicContact CB-CB 4.23Å; V170-A335 HydrophobicContact CG1-CB 3.99Å; V170-A335 HydrophobicContact CG2-CB 4.03Å
171	N	94.9	Very high	95.7	Very high	59 Å²	59	34.4 Å²	34.4	32%	0.316	17%	0.171	S	C	.	.	H	α-helix	trans	-57.4	-48.8	178.3	-175.2	-75.3	0	0	0	111.7	H167 T168 V174 Q175 L347	H167-N171 WeakPolarHBondContact O-CB 3.22Å; H167-N171 PolarHBondContact O-N 3Å; T168-N171 PolarHBondContact O-N 3Å; N171-V174 PolarHBondContact O-N 3.36Å; N171-Q175 WeakPolarHBondContact O-CG 3.38Å; N171-Q175 PolarHBondContact O-N 3.42Å; N171-Q175 PolarHBondContact OD1-NE2 3.19Å; N171-L347 HydrophobicContact CB-CD2 4.08Å
172	L	97	Very high	96.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.1	-40.5	-179.5	-60.8	173.1	0	0	0	112.1	L152 F164 T168 A169 V170 V174 Q175 C176 L210 F270 W349	L152-L172 HydrophobicContact CD2-CD1 3.84Å; L152-L172 HydrophobicContact CD2-CD2 3.97Å; L152-L172 HydrophobicContact CD2-CG 4.36Å; F164-L172 HydrophobicContact CD2-CD1 3.83Å; F164-L172 HydrophobicContact CE2-CD1 3.67Å; F164-L172 HydrophobicContact CG-CD1 4.4Å; F164-L172 HydrophobicContact CZ-CD1 4.11Å; T168-L172 HydrophobicContact CG2-CD1 3.75Å; T168-L172 HydrophobicContact CG2-CG 4.24Å; T168-L172 VanDerWaalsContact O-CG 3.23Å; T168-L172 WeakPolarHBondContact O-CG 3.13Å; T168-L172 PolarHBondContact O-N 3.32Å; A169-L172 PolarHBondContact O-N 3.39Å; V170-L172 PolarHBondContact O-N 3.36Å; L172-V174 PolarHBondContact O-N 3.33Å; L172-Q175 PolarHBondContact O-N 3.23Å; L172-C176 WeakPolarHBondContact O-CB 3.43Å; L172-C176 PolarHBondContact O-N 3.47Å; L172-C176 PolarHBondContact O-SG 2.9Å; L172-L210 HydrophobicContact CB-CD1 4.31Å; L172-L210 HydrophobicContact CD2-CD1 3.79Å; L172-L210 HydrophobicContact CD2-CD2 4.33Å; L172-L210 HydrophobicContact CD2-CG 4.18Å; L172-F270 HydrophobicContact CB-CE2 4.35Å; L172-W349 HydrophobicContact CD1-CH2 4.02Å; L172-W349 HydrophobicContact CD1-CZ3 3.99Å; L172-W349 HydrophobicContact CD2-CH2 3.67Å; L172-W349 HydrophobicContact CD2-CZ3 4.48Å; L172-W349 HydrophobicContact CG-CH2 4.32Å
173	A	98.5	Very high	96.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59	-46	176.6	0	0	0	0	0	111.6	A169 V170 Q175 C176 I177 I267 I331	A169-A173 WeakPolarHBondContact O-CB 3.19Å; A169-A173 PolarHBondContact O-N 2.9Å; V170-A173 PolarHBondContact O-N 3.23Å; A173-Q175 PolarHBondContact O-N 3.5Å; A173-C176 PolarHBondContact O-N 3.23Å; A173-I177 VanDerWaalsContact O-CG1 3.29Å; A173-I177 WeakPolarHBondContact O-CG1 3.43Å; A173-I177 PolarHBondContact O-N 2.78Å; A173-I267 HydrophobicContact CB-CD1 3.77Å; A173-I267 HydrophobicContact CB-CG1 3.71Å; A173-I267 HydrophobicContact CB-CG2 4.25Å; A173-I331 HydrophobicContact CB-CG1 4.49Å; A173-I331 HydrophobicContact CB-CG2 3.63Å
174	V	98.5	Very high	96.5	Very high	10 Å²	10	24.6 Å²	24.6	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-45.1	176.9	171.3	0	0	0	0	111.4	V170 N171 L172 C176 I177 R178 I328 I331 E332	V170-V174 WeakPolarHBondContact O-CG2 3.39Å; V170-V174 PolarHBondContact O-N 2.81Å; N171-V174 PolarHBondContact O-N 3.36Å; L172-V174 PolarHBondContact O-N 3.33Å; V174-C176 PolarHBondContact O-N 2.85Å; V174-I177 PolarHBondContact O-N 3.13Å; V174-R178 WeakPolarHBondContact O-CG 3.47Å; V174-R178 PolarHBondContact O-N 3.16Å; V174-I328 HydrophobicContact CG1-CG1 4.39Å; V174-I328 HydrophobicContact CG1-CG2 4.09Å; V174-I328 HydrophobicContact CG2-CG2 4.12Å; V174-I331 HydrophobicContact CG2-CG2 3.96Å; V174-E332 HydrophobicContact CG2-CG 4.1Å
175	Q	98.5	Very high	96.7	Very high	21 Å²	21	27.6 Å²	27.6	10%	0.098	14%	0.144	C	C	.	.	H	α-helix	trans	-63.2	-40.6	176.3	-69.6	-165.8	65.4	0	0	112.2	N171 L172 A173 I177 R178 A179 G208 L210	N171-Q175 WeakPolarHBondContact O-CG 3.38Å; N171-Q175 PolarHBondContact O-N 3.42Å; N171-Q175 PolarHBondContact OD1-NE2 3.19Å; L172-Q175 PolarHBondContact O-N 3.23Å; A173-Q175 PolarHBondContact O-N 3.5Å; Q175-I177 VanDerWaalsContact C-N 3.35Å; Q175-I177 PolarHBondContact O-N 3.46Å; Q175-R178 PolarHBondContact O-N 3.49Å; Q175-A179 WeakPolarHBondContact O-CB 3.37Å; Q175-A179 PolarHBondContact O-N 3.2Å; Q175-G208 PolarHBondContact NE2-O 2.84Å; Q175-G208 PolarHBondContact OE1-O 3.31Å; Q175-L210 HydrophobicContact CB-CB 4.37Å; Q175-L210 HydrophobicContact CB-CD1 3.96Å; Q175-L210 HydrophobicContact CB-CG 4.42Å
176	C	98.9	Very high	96.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-39.1	176	-66.5	0	0	0	0	112.2	L172 A173 V174 A179 L180 F198 L263	L172-C176 WeakPolarHBondContact O-CB 3.43Å; L172-C176 PolarHBondContact O-N 3.47Å; L172-C176 PolarHBondContact O-SG 2.9Å; A173-C176 PolarHBondContact O-N 3.23Å; V174-C176 PolarHBondContact O-N 2.85Å; C176-A179 PolarHBondContact O-N 3.02Å; C176-L180 PolarHBondContact O-N 3.47Å; C176-F198 HydrophobicContact CB-CD1 4.44Å; C176-F198 HydrophobicContact CB-CE1 3.89Å; C176-F198 HydrophobicContact CB-CE2 4.29Å; C176-F198 HydrophobicContact CB-CZ 3.81Å; C176-L263 HydrophobicContact CB-CD1 3.49Å; C176-L263 VanDerWaalsContact CB-CD1 3.49Å; C176-L263 HydrophobicContact CB-CD2 4.12Å; C176-L263 HydrophobicContact CB-CG 4.48Å
177	I	98.9	Very high	97.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.2	-45.6	175.9	-63.2	163.3	0	0	0	110.3	A173 V174 Q175 A179 L180 Q181 L263 F309 Y324 L327 I328 I331	A173-I177 VanDerWaalsContact O-CG1 3.29Å; A173-I177 WeakPolarHBondContact O-CG1 3.43Å; A173-I177 PolarHBondContact O-N 2.78Å; V174-I177 PolarHBondContact O-N 3.13Å; Q175-I177 VanDerWaalsContact C-N 3.35Å; Q175-I177 PolarHBondContact O-N 3.46Å; I177-A179 PolarHBondContact O-N 3.3Å; I177-L180 PolarHBondContact O-N 2.91Å; I177-Q181 WeakPolarHBondContact O-CB 3.44Å; I177-Q181 PolarHBondContact O-N 3.32Å; I177-L263 HydrophobicContact CG1-CD2 3.68Å; I177-F309 HydrophobicContact CD1-CE2 3.83Å; I177-F309 HydrophobicContact CG1-CE2 4.27Å; I177-Y324 HydrophobicContact CG2-CD1 3.98Å; I177-L327 HydrophobicContact CD1-CB 4.36Å; I177-I328 HydrophobicContact CB-CD1 4.48Å; I177-I328 HydrophobicContact CB-CG1 4.03Å; I177-I328 HydrophobicContact CD1-CG1 3.98Å; I177-I328 HydrophobicContact CG2-CD1 4.08Å; I177-I328 HydrophobicContact CG2-CG1 3.76Å; I177-I331 HydrophobicContact CD1-CG1 3.88Å
178	R	98.8	Very high	97.6	Very high	111 Å²	111	20.5 Å²	20.5	42%	0.419	11%	0.108	S	C	.	.	H	α-helix	trans	-62.4	-41.9	177.4	-71.9	177.2	179.6	153.5	4.5	112	H127 V174 Q175 L180 Q181 D182 I328	H127-R178 WeakPolarHBondContact NE2-CB 3.43Å; V174-R178 WeakPolarHBondContact O-CG 3.47Å; V174-R178 PolarHBondContact O-N 3.16Å; Q175-R178 PolarHBondContact O-N 3.49Å; R178-L180 PolarHBondContact O-N 2.82Å; R178-Q181 WeakPolarHBondContact O-CB 3.44Å; R178-Q181 PolarHBondContact O-N 3.49Å; R178-D182 PolarHBondContact O-N 3.31Å; R178-I328 HydrophobicContact CG-CD1 3.93Å
179	A	98.8	Very high	97.9	Very high	2 Å²	2	20.6 Å²	20.6	2%	0.017	11%	0.109	C	C	.	.	H	α-helix	trans	-62.2	-40.5	175.3	0	0	0	0	0	112.9	H127 Q175 C176 I177 D182 L183 F198 L212	H127-A179 HydrophobicContact CB-CB 3.54Å; Q175-A179 WeakPolarHBondContact O-CB 3.37Å; Q175-A179 PolarHBondContact O-N 3.2Å; C176-A179 PolarHBondContact O-N 3.02Å; I177-A179 PolarHBondContact O-N 3.3Å; A179-D182 PolarHBondContact O-N 3.41Å; A179-L183 PolarHBondContact O-N 3.49Å; A179-L183 VanDerWaalsContact O-N 3.13Å; A179-F198 HydrophobicContact CB-CE1 4.01Å; A179-L212 HydrophobicContact CB-CB 4.26Å
180	L	98.9	Very high	98	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.9	-38.5	172.9	-77.8	-177	0	0	0	112.3	C176 I177 R178 D182 L183 H184 I193 D259 L260 L263	C176-L180 PolarHBondContact O-N 3.47Å; I177-L180 PolarHBondContact O-N 2.91Å; R178-L180 PolarHBondContact O-N 2.82Å; L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 2.92Å; L180-L183 PolarHBondContact O-N 3.04Å; L180-H184 VanDerWaalsContact O-CB 3.31Å; L180-H184 WeakPolarHBondContact O-CB 3.17Å; L180-H184 PolarHBondContact O-CD2 3.44Å; L180-H184 PolarHBondContact O-N 3.48Å; L180-I193 HydrophobicContact CD2-CD1 3.6Å; L180-I193 HydrophobicContact CD2-CG1 4.08Å; L180-I193 HydrophobicContact CG-CD1 4.49Å; L180-D259 HydrophobicContact CD1-CB 4.23Å; L180-D259 HydrophobicContact CD2-CB 4.03Å; L180-L260 HydrophobicContact CD1-CD2 4.01Å; L180-L263 HydrophobicContact CD1-CB 4.1Å; L180-L263 HydrophobicContact CD1-CD2 3.73Å; L180-L263 HydrophobicContact CD1-CG 4.49Å
181	Q	98.8	Very high	98.1	Very high	70 Å²	70	20.5 Å²	20.5	33%	0.327	11%	0.106	S	C	.	.	H	α-helix	trans	-58.6	-45.5	174.5	-178.6	176.6	4	0	0	110.8	I177 R178 H184 S185 Y324	I177-Q181 WeakPolarHBondContact O-CB 3.44Å; I177-Q181 PolarHBondContact O-N 3.32Å; R178-Q181 WeakPolarHBondContact O-CB 3.44Å; R178-Q181 PolarHBondContact O-N 3.49Å; Q181-H184 PolarHBondContact O-N 3.42Å; Q181-S185 VanDerWaalsContact O-CB 3.32Å; Q181-S185 WeakPolarHBondContact O-CB 3.44Å; Q181-S185 PolarHBondContact O-N 3.33Å; Q181-Y324 HydrophobicContact CB-CD1 3.72Å; Q181-Y324 HydrophobicContact CB-CD2 4.04Å; Q181-Y324 HydrophobicContact CB-CE1 4.06Å; Q181-Y324 HydrophobicContact CB-CE2 4.36Å; Q181-Y324 HydrophobicContact CB-CG 3.73Å; Q181-Y324 HydrophobicContact CG-CD1 4.25Å; Q181-Y324 HydrophobicContact CG-CD2 3.63Å; Q181-Y324 HydrophobicContact CG-CE2 4.05Å; Q181-Y324 HydrophobicContact CG-CG 3.76Å
182	D	98.6	Very high	98.2	Very high	28 Å²	28	20 Å²	20	15%	0.15	10%	0.1	C	C	.	.	H	α-helix	trans	-57.5	-50.7	175.2	-72.3	-17.7	0	0	0	111.3	L122 T125 H127 R178 A179 L180 H184 S185 V186	L122-D182 HydrophobicContact CD2-CB 4.13Å; T125-D182 VanDerWaalsContact CB-CG 3.47Å; T125-D182 WeakPolarHBondContact CB-OD2 3.21Å; T125-D182 HydrophobicContact CG2-CB 4.07Å; T125-D182 PolarHBondContact OG1-OD2 2.95Å; T125-D182 VanDerWaalsContact OG1-OD2 3.11Å; H127-D182 IonicContact CD2-OD2 3.11Å; R178-D182 PolarHBondContact O-N 3.31Å; A179-D182 PolarHBondContact O-N 3.41Å; L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 2.92Å; D182-H184 PolarHBondContact O-N 3Å; D182-S185 WeakPolarHBondContact O-CB 3.29Å; D182-S185 PolarHBondContact O-N 3.5Å; D182-S185 PolarHBondContact O-OG 3.46Å; D182-V186 PolarHBondContact O-N 3.19Å
183	L	98.7	Very high	98.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.4	-45.7	177	-175.6	73.1	0	0	0	112.7	L122 A179 L180 S185 V186 L188 H190 L212 L215 I218	L122-L183 HydrophobicContact CD1-CD1 3.87Å; A179-L183 PolarHBondContact O-N 3.49Å; A179-L183 VanDerWaalsContact O-N 3.13Å; L180-L183 PolarHBondContact O-N 3.04Å; L183-S185 VanDerWaalsContact C-N 3.32Å; L183-S185 PolarHBondContact O-N 2.76Å; L183-V186 WeakPolarHBondContact O-CG2 3.34Å; L183-V186 PolarHBondContact O-N 3.05Å; L183-L188 HydrophobicContact CD1-CB 3.69Å; L183-L188 HydrophobicContact CD1-CD1 4.12Å; L183-L188 HydrophobicContact CG-CB 3.99Å; L183-L188 PolarHBondContact O-N 2.89Å; L183-H190 HydrophobicContact CD2-CB 3.55Å; L183-L212 HydrophobicContact CB-CD2 4.02Å; L183-L212 HydrophobicContact CD1-CD2 4.44Å; L183-L212 HydrophobicContact CD2-CD2 4.11Å; L183-L212 HydrophobicContact CG-CD2 4.42Å; L183-L215 HydrophobicContact CD1-CD2 4.25Å; L183-I218 HydrophobicContact CD1-CG2 4.36Å
184	H	98.6	Very high	98.1	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-69.4	-33.8	-179	-65.9	173.1	0	0	0	111.1	L180 Q181 D182 V186 G187 L188 Y221 R256 D259 Y324	L180-H184 VanDerWaalsContact O-CB 3.31Å; L180-H184 WeakPolarHBondContact O-CB 3.17Å; L180-H184 PolarHBondContact O-CD2 3.44Å; L180-H184 PolarHBondContact O-N 3.48Å; Q181-H184 PolarHBondContact O-N 3.42Å; D182-H184 PolarHBondContact O-N 3Å; H184-V186 VanDerWaalsContact C-N 3.28Å; H184-V186 PolarHBondContact O-N 3.21Å; H184-G187 PolarHBondContact O-N 3.42Å; H184-L188 WeakPolarHBondContact CA-O 3.38Å; H184-L188 PolarHBondContact CD2-O 3.45Å; H184-Y221 HydrophobicContact CB-CE1 4.5Å; H184-Y221 WeakPolarHBondContact O-CE1 3.23Å; H184-Y221 PolarHBondContact O-OH 2.88Å; H184-R256 HydrophobicContact CB-CG 4.26Å; H184-D259 IonicContact NE2-OD2 3.07Å; H184-D259 PolarHBondContact NE2-OD2 2.91Å; H184-D259 VanDerWaalsContact NE2-OD2 3.11Å; H184-Y324 WeakPolarHBondContact CB-OH 3.28Å; H184-Y324 VanDerWaalsContact CG-OH 3.31Å; H184-Y324 AromaticContact ND1-CE1 3.77Å; H184-Y324 AromaticContact ND1-CZ 3.61Å; H184-Y324 PolarHBondContact ND1-OH 3.42Å
185	S	97.2	Very high	97.9	Very high	71 Å²	71	19.7 Å²	19.7	50%	0.497	10%	0.099	S	C	.	.	H	α-helix	trans	-61.1	-36.4	177.6	81.2	0	0	0	0	112.1	Q181 D182 L183 G187	Q181-S185 VanDerWaalsContact O-CB 3.32Å; Q181-S185 WeakPolarHBondContact O-CB 3.44Å; Q181-S185 PolarHBondContact O-N 3.33Å; D182-S185 WeakPolarHBondContact O-CB 3.29Å; D182-S185 PolarHBondContact O-N 3.5Å; D182-S185 PolarHBondContact O-OG 3.46Å; L183-S185 VanDerWaalsContact C-N 3.32Å; L183-S185 PolarHBondContact O-N 2.76Å; S185-G187 PolarHBondContact O-N 3.41Å
186	V	96.5	Very high	97.7	Very high	33 Å²	33	23.2 Å²	23.2	20%	0.2	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	9	177.3	-58.2	0	0	0	0	113.9	K121 L122 D182 L183 H184 L188	K121-V186 HydrophobicContact CB-CB 3.98Å; K121-V186 HydrophobicContact CB-CG1 4.18Å; K121-V186 HydrophobicContact CB-CG2 4.07Å; K121-V186 HydrophobicContact CD-CB 4.3Å; K121-V186 PolarHBondContact NZ-O 3.28Å; L122-V186 HydrophobicContact CD2-CG1 4.3Å; L122-V186 HydrophobicContact CD2-CG2 3.85Å; L122-V186 HydrophobicContact CG-CG2 4.29Å; D182-V186 PolarHBondContact O-N 3.19Å; L183-V186 WeakPolarHBondContact O-CG2 3.34Å; L183-V186 PolarHBondContact O-N 3.05Å; H184-V186 VanDerWaalsContact C-N 3.28Å; H184-V186 PolarHBondContact O-N 3.21Å; V186-L188 HydrophobicContact CG2-CB 4.47Å; V186-L188 HydrophobicContact CG2-CD1 4.09Å; V186-L188 HydrophobicContact CG2-CG 4.1Å
187	G	97.7	Very high	97.5	Very high	8 Å²	8	23.2 Å²	23.2	8%	0.082	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	20.1	173.1	0	0	0	0	0	114.5	H184 S185 P220 Y221	H184-G187 PolarHBondContact O-N 3.42Å; S185-G187 PolarHBondContact O-N 3.41Å; G187-P220 VanDerWaalsContact O-CA 3.31Å; G187-P220 WeakPolarHBondContact O-CA 3.21Å; G187-Y221 VanDerWaalsContact CA-CE1 3.43Å; G187-Y221 WeakPolarHBondContact O-CD1 3.38Å; G187-Y221 PolarHBondContact O-N 2.91Å
188	L	98.3	Very high	97.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	154.4	-179.5	-56.5	-179.9	0	0	0	111.5	Y117 A118 K121 L183 H184 V186 I218 R219 P220 Y221	Y117-L188 HydrophobicContact CE1-CD1 4.31Å; Y117-L188 HydrophobicContact CE1-CD2 3.71Å; A118-L188 HydrophobicContact CB-CD1 3.73Å; K121-L188 HydrophobicContact CD-CD1 4.26Å; L183-L188 HydrophobicContact CD1-CB 3.69Å; L183-L188 HydrophobicContact CD1-CD1 4.12Å; L183-L188 HydrophobicContact CG-CB 3.99Å; L183-L188 PolarHBondContact O-N 2.89Å; H184-L188 WeakPolarHBondContact CA-O 3.38Å; H184-L188 PolarHBondContact CD2-O 3.45Å; V186-L188 HydrophobicContact CG2-CB 4.47Å; V186-L188 HydrophobicContact CG2-CD1 4.09Å; V186-L188 HydrophobicContact CG2-CG 4.1Å; L188-I218 HydrophobicContact CD1-CD1 4.36Å; L188-I218 HydrophobicContact CD2-CD1 4.35Å; L188-R219 WeakPolarHBondContact CA-O 3.5Å; L188-P220 HydrophobicContact CD2-CB 4.31Å; L188-P220 HydrophobicContact CD2-CG 3.97Å; L188-Y221 WeakPolarHBondContact O-CD1 3.49Å; L188-Y221 WeakPolarHBondContact O-CE1 3.35Å
189	T	98.3	Very high	97.3	Very high	2 Å²	2	18 Å²	18	1%	0.012	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147.2	166.7	45.7	0	0	0	0	107.9	R191 I218 R219 Y221 R256 D259	T189-R191 WeakPolarHBondContact OG1-CD 3.49Å; T189-R191 WeakPolarHBondContact OG1-CG 3.36Å; T189-I218 CarbonylContact O-C 3.59Å; T189-I218 WeakPolarHBondContact O-CA 3.47Å; T189-R219 PolarHBondContact N-O 3.11Å; T189-R219 PolarHBondContact O-N 2.9Å; T189-R219 PolarHBondContact OG1-O 2.81Å; T189-R219 VanDerWaalsContact OG1-O 3.09Å; T189-Y221 HydrophobicContact CG2-CD1 3.79Å; T189-Y221 HydrophobicContact CG2-CG 4.11Å; T189-R256 HydrophobicContact CG2-CG 4.02Å; T189-D259 WeakPolarHBondContact CA-OD2 3.43Å; T189-D259 WeakPolarHBondContact CB-OD2 3.45Å
190	H	98.4	Very high	97	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.			trans	-80.3	-46	-176.6	-166.6	-82.9	0	0	0	111.8	L183 R192 I193 T213 D214 F217 D259	L183-H190 HydrophobicContact CD2-CB 3.55Å; H190-R192 PolarHBondContact CE1-O 2.75Å; H190-R192 VanDerWaalsContact ND1-C 3.27Å; H190-R192 PolarHBondContact ND1-N 3.33Å; H190-R192 PolarHBondContact ND1-O 3.03Å; H190-R192 PolarHBondContact O-N 3.02Å; H190-I193 HydrophobicContact CB-CD1 3.6Å; H190-I193 HydrophobicContact CB-CG1 3.91Å; H190-T213 PolarHBondContact NE2-O 3.33Å; H190-T213 VanDerWaalsContact NE2-O 3.12Å; H190-D214 PolarHBondContact CE1-O 2.67Å; H190-D214 PolarHBondContact NE2-O 3.13Å; H190-F217 CarbonylContact O-C 3.58Å; H190-D259 PolarHBondContact N-OD2 2.9Å
191	R	97.6	Very high	96.7	Very high	14 Å²	14	18.7 Å²	18.7	5%	0.053	10%	0.099	C	C	.	.	S	Bend	trans	66.6	9.9	174.4	-54.8	170.2	61.7	-125.9	-4.8	115	T189 F217 L254 D259	T189-R191 WeakPolarHBondContact OG1-CD 3.49Å; T189-R191 WeakPolarHBondContact OG1-CG 3.36Å; R191-F217 PolarHBondContact NH1-O 3.17Å; R191-L254 HydrophobicContact CB-CD1 3.95Å; R191-L254 HydrophobicContact CG-CB 4.06Å; R191-L254 HydrophobicContact CG-CD1 4.3Å; R191-D259 WeakPolarHBondContact CA-OD1 3.26Å; R191-D259 PolarHBondContact N-OD1 3.42Å
192	R	96.4	Very high	96.2	Very high	48 Å²	48	18.1 Å²	18.1	18%	0.181	10%	0.098	C	C	.	.			trans	-156.2	44.7	179.6	-164.7	169.8	75.1	163.9	-1.9	112.7	H190 S194 D214 F217 H240	H190-R192 PolarHBondContact CE1-O 2.75Å; H190-R192 VanDerWaalsContact ND1-C 3.27Å; H190-R192 PolarHBondContact ND1-N 3.33Å; H190-R192 PolarHBondContact ND1-O 3.03Å; H190-R192 PolarHBondContact O-N 3.02Å; R192-S194 PolarHBondContact O-N 3.04Å; R192-D214 IonicContact CZ-OD1 2.75Å; R192-D214 IonicContact CZ-OD2 2.85Å; R192-D214 IonicContact NE-OD2 3.66Å; R192-D214 PolarHBondContact NE-OD2 2.85Å; R192-D214 IonicContact NH2-OD1 3.59Å; R192-D214 PolarHBondContact NH2-OD1 2.91Å; R192-D214 IonicContact NH2-OD2 3.85Å; R192-D214 PolarHBondContact NH2-OD2 2.92Å; R192-F217 HydrophobicContact CB-CB 4.27Å; R192-F217 VanDerWaalsContact NE-CD2 3.34Å; R192-H240 VanDerWaalsContact CG-CD2 3.46Å; R192-H240 WeakPolarHBondContact CG-CD2 3.42Å
193	I	98.2	Very high	95.7	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.101	C	C	.	.			trans	-65.6	135.1	179	-66.9	-63.3	0	0	0	110.4	L180 H190 F198 L212 D259 L266	L180-I193 HydrophobicContact CD2-CD1 3.6Å; L180-I193 HydrophobicContact CD2-CG1 4.08Å; L180-I193 HydrophobicContact CG-CD1 4.49Å; H190-I193 HydrophobicContact CB-CD1 3.6Å; H190-I193 HydrophobicContact CB-CG1 3.91Å; I193-F198 HydrophobicContact CD1-CE2 4.47Å; I193-F198 HydrophobicContact CD1-CZ 4.2Å; I193-F198 HydrophobicContact CG2-CE2 4.09Å; I193-L212 HydrophobicContact CD1-CD1 4.29Å; I193-D259 HydrophobicContact CG1-CB 4.14Å; I193-L266 HydrophobicContact CG2-CD1 3.51Å
194	S	96	Very high	94.9	Very high	3 Å²	3	24 Å²	24	2%	0.021	14%	0.138	C	C	.	.			trans	-160	168.5	175.7	72.4	0	0	0	0	110.1	R192 K196 C197 L266	R192-S194 PolarHBondContact O-N 3.04Å; S194-K196 PolarHBondContact O-N 3.07Å; S194-K196 PolarHBondContact OG-N 3.45Å; S194-C197 PolarHBondContact N-SG 3.01Å; S194-C197 VanDerWaalsContact N-SG 3.43Å; S194-C197 PolarHBondContact O-N 3.04Å; S194-C197 PolarHBondContact O-SG 3.41Å; S194-L266 VanDerWaalsContact C-CD1 3.48Å
195	G	94.9	Very high	94.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-60	-15.2	175.7	0	0	0	0	0	113.8	L152 H153	L152-G195 WeakPolarHBondContact CA-O 3.42Å; L152-G195 WeakPolarHBondContact CB-O 3.47Å; L152-G195 PolarHBondContact N-O 3.18Å; H153-G195 PolarHBondContact N-O 2.95Å
196	K	93.1	Very high	93.9	Very high	94 Å²	94	31.2 Å²	31.2	41%	0.409	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-82.4	-18.1	178.1	-65.4	-179.4	174.6	174.2	0	114.1	H153 S194 F198 C363	H153-K196 HydrophobicContact CB-CG 3.87Å; H153-K196 WeakPolarHBondContact CD2-CE 3.38Å; S194-K196 PolarHBondContact O-N 3.07Å; S194-K196 PolarHBondContact OG-N 3.45Å; K196-F198 VanDerWaalsContact C-N 3.3Å; K196-C363 VanDerWaalsContact O-CB 3.23Å; K196-C363 WeakPolarHBondContact O-CB 3.26Å; K196-C363 PolarHBondContact O-SG 2.77Å; K196-C363 VanDerWaalsContact O-SG 3.36Å
197	C	95.8	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-88.6	4.8	-179.5	70.4	0	0	0	0	113.5	S194 L212 T213 D214	S194-C197 PolarHBondContact N-SG 3.01Å; S194-C197 VanDerWaalsContact N-SG 3.43Å; S194-C197 PolarHBondContact O-N 3.04Å; S194-C197 PolarHBondContact O-SG 3.41Å; C197-L212 HydrophobicContact CB-CD1 4.47Å; C197-L212 CarbonylContact O-C 3.59Å; C197-L212 WeakPolarHBondContact O-CA 3.24Å; C197-T213 WeakPolarHBondContact CA-OG1 3.45Å; C197-T213 PolarHBondContact O-N 3.41Å; C197-T213 PolarHBondContact O-OG1 3.17Å; C197-D214 HydrophobicContact CB-CB 4.29Å
198	F	97.1	Very high	92.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	112.8	177	-62	-78.2	0	0	0	108.7	D151 L152 C176 A179 I193 K196 L210 F211 L212 L266	D151-F198 CarbonylContact C-O 3.53Å; D151-F198 WeakPolarHBondContact CA-O 3.33Å; D151-F198 WeakPolarHBondContact CB-O 3.3Å; L152-F198 HydrophobicContact CD1-CB 3.66Å; L152-F198 HydrophobicContact CD1-CD2 4.28Å; L152-F198 HydrophobicContact CD1-CG 4.18Å; L152-F198 HydrophobicContact CG-CB 3.78Å; L152-F198 PolarHBondContact N-O 2.72Å; C176-F198 HydrophobicContact CB-CD1 4.44Å; C176-F198 HydrophobicContact CB-CE1 3.89Å; C176-F198 HydrophobicContact CB-CE2 4.29Å; C176-F198 HydrophobicContact CB-CZ 3.81Å; A179-F198 HydrophobicContact CB-CE1 4.01Å; I193-F198 HydrophobicContact CD1-CE2 4.47Å; I193-F198 HydrophobicContact CD1-CZ 4.2Å; I193-F198 HydrophobicContact CG2-CE2 4.09Å; K196-F198 VanDerWaalsContact C-N 3.3Å; F198-L210 HydrophobicContact CB-CD1 4.41Å; F198-L210 HydrophobicContact CB-CD2 4.45Å; F198-F211 WeakPolarHBondContact CA-O 3.12Å; F198-L212 HydrophobicContact CD1-CD1 4.17Å; F198-L212 HydrophobicContact CE1-CD1 3.68Å; F198-L212 HydrophobicContact CZ-CD1 4.07Å; F198-L266 HydrophobicContact CD2-CD1 4.43Å; F198-L266 HydrophobicContact CE2-CD1 4Å
199	A	94.5	Very high	92.7	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145.3	-177.6	0	0	0	0	0	111.4	L148 L210 F211 T213	L148-A199 HydrophobicContact CB-CB 4.06Å; L148-A199 HydrophobicContact CD1-CB 3.98Å; A199-L210 CarbonylContact O-C 3.54Å; A199-L210 WeakPolarHBondContact O-CA 3.12Å; A199-F211 PolarHBondContact N-O 2.78Å; A199-F211 PolarHBondContact O-N 3.12Å; A199-T213 HydrophobicContact CB-CG2 4.18Å
200	L	93.6	Very high	92.7	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145.4	176.8	-73.7	175.8	0	0	0	112	G149 P150 L155 T209 L210 W349 L357	G149-L200 WeakPolarHBondContact CA-O 3.31Å; G149-L200 PolarHBondContact N-O 3.09Å; P150-L200 HydrophobicContact CG-CD1 4.33Å; P150-L200 PolarHBondContact O-N 2.85Å; P150-L200 VanDerWaalsContact O-N 3.13Å; L155-L200 HydrophobicContact CD1-CD1 3.5Å; L155-L200 HydrophobicContact CD1-CG 3.87Å; L155-L200 HydrophobicContact CD2-CD1 4.29Å; L155-L200 HydrophobicContact CG-CD1 4.47Å; L200-T209 CarbonylContact C-O 3.54Å; L200-T209 WeakPolarHBondContact CA-O 3.28Å; L200-L210 HydrophobicContact CD2-CD2 3.71Å; L200-L210 HydrophobicContact CG-CD2 4.23Å; L200-W349 HydrophobicContact CD1-CZ2 3.66Å; L200-W349 HydrophobicContact CD2-CH2 4.46Å; L200-W349 HydrophobicContact CD2-CZ2 3.82Å; L200-W349 HydrophobicContact CG-CZ2 4.31Å; L200-L357 HydrophobicContact CD1-CD2 4.01Å
201	S	92.4	Very high	92.6	Very high	11 Å²	11	37.5 Å²	37.5	8%	0.077	19%	0.19	C	C	.	.			trans	-63.5	139.8	162.7	-173.1	0	0	0	0	110.7	S203 T209 F211	S201-S203 WeakPolarHBondContact OG-CB 3.45Å; S201-S203 PolarHBondContact OG-N 3.39Å; S201-S203 VanDerWaalsContact OG-N 3.08Å; S201-T209 PolarHBondContact N-O 2.78Å; S201-F211 VanDerWaalsContact CB-CE2 3.46Å
202	L	89.1	Confident	92.6	Very high	58 Å²	58	37 Å²	37	30%	0.304	19%	0.188	S	C	.	.			trans	-86.4	-12.5	167.5	-67.4	174.9	0	0	0	112.6	P147 P204 H360	P147-L202 HydrophobicContact CB-CD1 4.04Å; P147-L202 WeakPolarHBondContact O-CD1 3.46Å; L202-P204 WeakPolarHBondContact O-CD 3.13Å; L202-H360 WeakPolarHBondContact CD1-CD2 3.48Å
203	S	87	Confident	92.6	Very high	31 Å²	31	34.8 Å²	34.8	22%	0.217	18%	0.18	C	C	.	.			trans	-69.4	125.7	-177.7	177.8	0	0	0	0	110.3	S201 K205 Q206 K207	S201-S203 WeakPolarHBondContact OG-CB 3.45Å; S201-S203 PolarHBondContact OG-N 3.39Å; S201-S203 VanDerWaalsContact OG-N 3.08Å; S203-K205 PolarHBondContact O-N 3.47Å; S203-K205 VanDerWaalsContact O-N 3.14Å; S203-K205 PolarHBondContact OG-N 2.96Å; S203-Q206 CarbonylContact O-C 3.57Å; S203-Q206 PolarHBondContact O-N 3.38Å; S203-K207 PolarHBondContact O-N 3.43Å
204	P	82.9	Confident	92.3	Very high	120 Å²	120	35.2 Å²	35.2	78%	0.779	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-57.5	-27.8	172.5	-24.9	34.5	0	0	0	113	L202 Q206	L202-P204 WeakPolarHBondContact O-CD 3.13Å; P204-Q206 VanDerWaalsContact C-N 3.29Å; P204-Q206 PolarHBondContact O-N 3.48Å
205	K	87.1	Confident	92.3	Very high	156 Å²	156	35.1 Å²	35.1	68%	0.678	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-74	-18.3	178.4	-62.8	-179.9	-177.8	171.6	0	112.8	E39 S203	E39-K205 IonicContact OE2-NZ 3.15Å; E39-K205 PolarHBondContact OE2-NZ 3.2Å; S203-K205 PolarHBondContact O-N 3.47Å; S203-K205 VanDerWaalsContact O-N 3.14Å; S203-K205 PolarHBondContact OG-N 2.96Å
206	Q	87.5	Confident	92.3	Very high	67 Å²	67	35.2 Å²	35.2	31%	0.313	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-124.9	32	-179.5	-66.8	176.1	-74	0	0	111.2	S203 P204 G208 T209	S203-Q206 CarbonylContact O-C 3.57Å; S203-Q206 PolarHBondContact O-N 3.38Å; P204-Q206 VanDerWaalsContact C-N 3.29Å; P204-Q206 PolarHBondContact O-N 3.48Å; Q206-G208 PolarHBondContact O-N 3.37Å; Q206-T209 WeakPolarHBondContact O-CB 3.43Å; Q206-T209 PolarHBondContact O-N 2.99Å; Q206-T209 PolarHBondContact O-OG1 2.95Å
207	K	85.5	Confident	92.4	Very high	133 Å²	133	33.9 Å²	33.9	58%	0.578	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	129.8	-179.3	-166.3	-171.5	-173.4	-144.3	0	110.9	S203 T209 E350	S203-K207 PolarHBondContact O-N 3.43Å; K207-T209 PolarHBondContact O-N 3.45Å; K207-E350 WeakPolarHBondContact CE-OE1 3.46Å; K207-E350 IonicContact NZ-OE1 2.87Å; K207-E350 PolarHBondContact NZ-OE1 3.47Å
208	G	87.4	Confident	92.5	Very high	11 Å²	11	34.4 Å²	34.4	11%	0.113	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	-1	-178.9	0	0	0	0	0	115	Q175 Q206	Q175-G208 PolarHBondContact NE2-O 2.84Å; Q175-G208 PolarHBondContact OE1-O 3.31Å; Q206-G208 PolarHBondContact O-N 3.37Å
209	T	94.6	Very high	92.4	Very high	31 Å²	31	36.9 Å²	36.9	19%	0.19	19%	0.189	C	C	.	.			trans	-75.6	133.7	176	-56.2	0	0	0	0	110.4	L200 S201 Q206 K207 F211	L200-T209 CarbonylContact C-O 3.54Å; L200-T209 WeakPolarHBondContact CA-O 3.28Å; S201-T209 PolarHBondContact N-O 2.78Å; Q206-T209 WeakPolarHBondContact O-CB 3.43Å; Q206-T209 PolarHBondContact O-N 2.99Å; Q206-T209 PolarHBondContact O-OG1 2.95Å; K207-T209 PolarHBondContact O-N 3.45Å; T209-F211 HydrophobicContact CG2-CD1 4.37Å; T209-F211 HydrophobicContact CG2-CE1 3.98Å
210	L	96.9	Very high	92.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.5	171.6	-65.4	175.9	0	0	0	111.6	H127 L152 L172 Q175 F198 A199 L200	H127-L210 PolarHBondContact ND1-O 2.78Å; L152-L210 HydrophobicContact CD1-CD1 3.81Å; L152-L210 HydrophobicContact CD1-CD2 4.44Å; L152-L210 HydrophobicContact CD2-CD1 4.15Å; L152-L210 HydrophobicContact CD2-CD2 3.59Å; L152-L210 HydrophobicContact CG-CD1 4.31Å; L152-L210 HydrophobicContact CG-CD2 4.04Å; L172-L210 HydrophobicContact CB-CD1 4.31Å; L172-L210 HydrophobicContact CD2-CD1 3.79Å; L172-L210 HydrophobicContact CD2-CD2 4.33Å; L172-L210 HydrophobicContact CD2-CG 4.18Å; Q175-L210 HydrophobicContact CB-CB 4.37Å; Q175-L210 HydrophobicContact CB-CD1 3.96Å; Q175-L210 HydrophobicContact CB-CG 4.42Å; F198-L210 HydrophobicContact CB-CD1 4.41Å; F198-L210 HydrophobicContact CB-CD2 4.45Å; A199-L210 CarbonylContact O-C 3.54Å; A199-L210 WeakPolarHBondContact O-CA 3.12Å; L200-L210 HydrophobicContact CD2-CD2 3.71Å; L200-L210 HydrophobicContact CG-CD2 4.23Å
211	F	97.4	Very high	92.7	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.6	169.6	-62.5	-45.9	0	0	0	110.7	H127 P129 E146 L148 F198 A199 S201 T209	H127-F211 WeakPolarHBondContact O-CA 3.5Å; P129-F211 HydrophobicContact CB-CB 4.32Å; P129-F211 HydrophobicContact CB-CD2 4.12Å; P129-F211 HydrophobicContact CB-CG 4.24Å; E146-F211 WeakPolarHBondContact OE1-CE2 3.1Å; L148-F211 HydrophobicContact CD2-CD2 3.52Å; L148-F211 HydrophobicContact CD2-CE2 4Å; F198-F211 WeakPolarHBondContact CA-O 3.12Å; A199-F211 PolarHBondContact N-O 2.78Å; A199-F211 PolarHBondContact O-N 3.12Å; S201-F211 VanDerWaalsContact CB-CE2 3.46Å; T209-F211 HydrophobicContact CG2-CD1 4.37Å; T209-F211 HydrophobicContact CG2-CE1 3.98Å
212	L	98.2	Very high	92.9	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.6	174.7	-175.8	67.1	0	0	0	110.2	H127 A179 L183 I193 C197 F198 L215	H127-L212 PolarHBondContact O-N 2.84Å; A179-L212 HydrophobicContact CB-CB 4.26Å; L183-L212 HydrophobicContact CB-CD2 4.02Å; L183-L212 HydrophobicContact CD1-CD2 4.44Å; L183-L212 HydrophobicContact CD2-CD2 4.11Å; L183-L212 HydrophobicContact CG-CD2 4.42Å; I193-L212 HydrophobicContact CD1-CD1 4.29Å; C197-L212 HydrophobicContact CB-CD1 4.47Å; C197-L212 CarbonylContact O-C 3.59Å; C197-L212 WeakPolarHBondContact O-CA 3.24Å; F198-L212 HydrophobicContact CD1-CD1 4.17Å; F198-L212 HydrophobicContact CE1-CD1 3.68Å; F198-L212 HydrophobicContact CZ-CD1 4.07Å; L212-L215 HydrophobicContact CD2-CD2 3.95Å; L212-L215 HydrophobicContact CG-CD2 3.97Å
213	T	95.2	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.			trans	-124.7	-173.2	-176.5	64.1	0	0	0	0	111	L148 H190 C197 A199 L215	L148-T213 HydrophobicContact CD1-CG2 3.46Å; L148-T213 VanDerWaalsContact CD1-CG2 3.46Å; H190-T213 PolarHBondContact NE2-O 3.33Å; H190-T213 VanDerWaalsContact NE2-O 3.12Å; C197-T213 WeakPolarHBondContact CA-OG1 3.45Å; C197-T213 PolarHBondContact O-N 3.41Å; C197-T213 PolarHBondContact O-OG1 3.17Å; A199-T213 HydrophobicContact CB-CG2 4.18Å; T213-L215 VanDerWaalsContact C-N 3.33Å; T213-L215 PolarHBondContact O-N 3.47Å
214	D	92.9	Very high	93.4	Very high	11 Å²	11	47 Å²	47	6%	0.059	24%	0.241	C	C	.	.			trans	53.4	43.8	178.2	-165.4	17.5	0	0	0	115.2	R101 H190 R192 C197 G216	R101-D214 IonicContact NH1-OD1 3.43Å; H190-D214 PolarHBondContact CE1-O 2.67Å; H190-D214 PolarHBondContact NE2-O 3.13Å; R192-D214 IonicContact CZ-OD1 2.75Å; R192-D214 IonicContact CZ-OD2 2.85Å; R192-D214 IonicContact NE-OD2 3.66Å; R192-D214 PolarHBondContact NE-OD2 2.85Å; R192-D214 IonicContact NH2-OD1 3.59Å; R192-D214 PolarHBondContact NH2-OD1 2.91Å; R192-D214 IonicContact NH2-OD2 3.85Å; R192-D214 PolarHBondContact NH2-OD2 2.92Å; C197-D214 HydrophobicContact CB-CB 4.29Å; D214-G216 PolarHBondContact O-N 3.27Å
215	L	96	Very high	93.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-74.9	18.9	-178.6	-58.5	174.3	0	0	0	113.7	E115 A118 M119 L122 L183 L212 T213 F217 I218	E115-L215 HydrophobicContact CB-CB 4.23Å; E115-L215 HydrophobicContact CG-CB 4.18Å; A118-L215 HydrophobicContact CB-CB 4.01Å; A118-L215 HydrophobicContact CB-CD1 3.63Å; A118-L215 HydrophobicContact CB-CG 4.32Å; M119-L215 HydrophobicContact CE-CD1 3.69Å; M119-L215 HydrophobicContact CE-CG 4.39Å; M119-L215 HydrophobicContact CG-CD1 4.08Å; M119-L215 HydrophobicContact SD-CD1 3.77Å; L122-L215 HydrophobicContact CD1-CD1 4.01Å; L183-L215 HydrophobicContact CD1-CD2 4.25Å; L212-L215 HydrophobicContact CD2-CD2 3.95Å; L212-L215 HydrophobicContact CG-CD2 3.97Å; T213-L215 VanDerWaalsContact C-N 3.33Å; T213-L215 PolarHBondContact O-N 3.47Å; L215-F217 PolarHBondContact O-N 3.1Å; L215-I218 HydrophobicContact CB-CG2 3.83Å; L215-I218 HydrophobicContact CD2-CG2 3.89Å; L215-I218 HydrophobicContact CG-CG2 4.47Å; L215-I218 WeakPolarHBondContact O-CG1 3.05Å; L215-I218 WeakPolarHBondContact O-CG2 3.34Å; L215-I218 PolarHBondContact O-N 2.95Å
216	G	93.8	Very high	94.1	Very high	4 Å²	4	42.4 Å²	42.4	4%	0.041	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-67.6	-21	-173.9	0	0	0	0	0	115	S111 N114 D214	S111-G216 WeakPolarHBondContact O-CA 2.91Å; N114-G216 PolarHBondContact ND2-O 3.46Å; D214-G216 PolarHBondContact O-N 3.27Å
217	F	95.3	Very high	94.5	Very high	66 Å²	66	40.8 Å²	40.8	29%	0.289	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-109.1	4.6	-174.9	-73.2	-96	0	0	0	113.9	H190 R191 R192 L215 Y238	H190-F217 CarbonylContact O-C 3.58Å; R191-F217 PolarHBondContact NH1-O 3.17Å; R192-F217 HydrophobicContact CB-CB 4.27Å; R192-F217 VanDerWaalsContact NE-CD2 3.34Å; L215-F217 PolarHBondContact O-N 3.1Å; F217-Y238 AromaticContact CD1-CD1 3.91Å; F217-Y238 HydrophobicContact CD1-CD1 3.91Å; F217-Y238 HydrophobicContact CD1-CE1 4.31Å; F217-Y238 HydrophobicContact CE1-CD1 4.4Å
218	I	97.3	Very high	95	Very high	10 Å²	10	36.6 Å²	36.6	5%	0.051	21%	0.211	C	C	.	.			trans	-53	152.3	-179.6	58.8	93.7	0	0	0	111.6	N114 Y117 A118 L183 L188 T189 L215	N114-I218 HydrophobicContact CB-CD1 4.25Å; N114-I218 HydrophobicContact CB-CG1 4.05Å; Y117-I218 HydrophobicContact CD1-CD1 3.81Å; Y117-I218 HydrophobicContact CE1-CD1 4.2Å; A118-I218 HydrophobicContact CB-CD1 4.36Å; A118-I218 HydrophobicContact CB-CG1 4.09Å; A118-I218 HydrophobicContact CB-CG2 4.38Å; L183-I218 HydrophobicContact CD1-CG2 4.36Å; L188-I218 HydrophobicContact CD1-CD1 4.36Å; L188-I218 HydrophobicContact CD2-CD1 4.35Å; T189-I218 CarbonylContact O-C 3.59Å; T189-I218 WeakPolarHBondContact O-CA 3.47Å; L215-I218 HydrophobicContact CB-CG2 3.83Å; L215-I218 HydrophobicContact CD2-CG2 3.89Å; L215-I218 HydrophobicContact CG-CG2 4.47Å; L215-I218 WeakPolarHBondContact O-CG1 3.05Å; L215-I218 WeakPolarHBondContact O-CG2 3.34Å; L215-I218 PolarHBondContact O-N 2.95Å
219	R	95.8	Very high	95.4	Very high	53 Å²	53	39.7 Å²	39.7	20%	0.2	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138.1	172.8	-167.8	175.8	177.6	-97.3	-2.8	111.5	L188 T189 Y221 D253	L188-R219 WeakPolarHBondContact CA-O 3.5Å; T189-R219 PolarHBondContact N-O 3.11Å; T189-R219 PolarHBondContact O-N 2.9Å; T189-R219 PolarHBondContact OG1-O 2.81Å; T189-R219 VanDerWaalsContact OG1-O 3.09Å; R219-Y221 PolarHBondContact O-N 3.12Å; R219-D253 IonicContact NH1-OD2 2.66Å
220	P	97.1	Very high	95.3	Very high	40 Å²	40	42.8 Å²	42.8	26%	0.26	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	122.5	166.1	-22.6	33.7	0	0	0	111.1	Y117 G187 L188 R229	Y117-P220 HydrophobicContact CE1-CG 4.41Å; G187-P220 VanDerWaalsContact O-CA 3.31Å; G187-P220 WeakPolarHBondContact O-CA 3.21Å; L188-P220 HydrophobicContact CD2-CB 4.31Å; L188-P220 HydrophobicContact CD2-CG 3.97Å; P220-R229 WeakPolarHBondContact O-CD 3.46Å
221	Y	97.3	Very high	95.1	Very high	6 Å²	6	45.7 Å²	45.7	2%	0.024	26%	0.262	C	S	.	.			trans	-99.3	-16.8	171.2	76.1	-89.6	0	0	0	111.8	H184 G187 L188 T189 R219 H228 R229 R256	H184-Y221 HydrophobicContact CB-CE1 4.5Å; H184-Y221 WeakPolarHBondContact O-CE1 3.23Å; H184-Y221 PolarHBondContact O-OH 2.88Å; G187-Y221 VanDerWaalsContact CA-CE1 3.43Å; G187-Y221 WeakPolarHBondContact O-CD1 3.38Å; G187-Y221 PolarHBondContact O-N 2.91Å; L188-Y221 WeakPolarHBondContact O-CD1 3.49Å; L188-Y221 WeakPolarHBondContact O-CE1 3.35Å; T189-Y221 HydrophobicContact CG2-CD1 3.79Å; T189-Y221 HydrophobicContact CG2-CG 4.11Å; R219-Y221 PolarHBondContact O-N 3.12Å; Y221-H228 AromaticContact CD2-CD2 3.5Å; Y221-H228 VanDerWaalsContact CD2-CD2 3.5Å; Y221-H228 WeakPolarHBondContact CD2-CD2 3.18Å; Y221-H228 AromaticContact CD2-NE2 3.46Å; Y221-H228 WeakPolarHBondContact CD2-NE2 3.28Å; Y221-H228 AromaticContact CE2-CD2 3.97Å; Y221-R229 WeakPolarHBondContact O-CB 3.03Å; Y221-R229 WeakPolarHBondContact O-CG 3.09Å; Y221-R229 PolarHBondContact O-N 2.64Å; Y221-R256 HydrophobicContact CD1-CG 4.4Å; Y221-R256 HydrophobicContact CE1-CG 4.14Å; Y221-R256 HydrophobicContact CE2-CG 4.28Å; Y221-R256 VanDerWaalsContact CE2-CZ 3.46Å; Y221-R256 PolarHBondContact OH-NH1 2.8Å
222	R	96.8	Very high	94.7	Very high	66 Å²	66	51.2 Å²	51.2	25%	0.249	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-98.5	149.2	171.7	-63.9	-178.6	173.4	160	-4.8	111.6	G227 R229 E321	R222-G227 CarbonylContact C-O 3.34Å; R222-G227 VanDerWaalsContact CA-O 3.32Å; R222-G227 WeakPolarHBondContact CA-O 3.45Å; R222-R229 PolarHBondContact O-NE 3.4Å; R222-E321 IonicContact NH2-OE1 2.7Å; R222-E321 IonicContact NH2-OE2 3.25Å; R222-E321 PolarHBondContact NH2-OE2 3.3Å
223	H	95.6	Very high	94.1	Very high	73 Å²	73	52.9 Å²	52.9	34%	0.338	30%	0.302	S	S	.	.			trans	-74.4	162.4	161.5	-72.4	-82.2	0	0	0	110	N225 G226 G227 R229	H223-N225 WeakPolarHBondContact CB-OD1 3.48Å; H223-N225 PolarHBondContact O-N 3.3Å; H223-N225 VanDerWaalsContact O-N 3.14Å; H223-G226 PolarHBondContact O-N 3.23Å; H223-G227 PolarHBondContact N-O 2.92Å; H223-R229 WeakPolarHBondContact NE2-CG 3.09Å
224	P	92.1	Very high	94	Very high	135 Å²	135	58.8 Å²	58.8	88%	0.877	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-26.2	174.9	-26.9	36.2	0	0	0	114.2	G226	P224-G226 PolarHBondContact O-N 3.46Å
225	N	93.4	Very high	94	Very high	136 Å²	136	59.2 Å²	59.2	73%	0.727	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	4.1	175.1	69.6	-1.4	0	0	0	114.1	H223 G227	H223-N225 WeakPolarHBondContact CB-OD1 3.48Å; H223-N225 PolarHBondContact O-N 3.3Å; H223-N225 VanDerWaalsContact O-N 3.14Å; N225-G227 VanDerWaalsContact C-N 3.34Å; N225-G227 PolarHBondContact O-N 2.88Å; N225-G227 PolarHBondContact OD1-N 2.72Å
226	G	91.2	Very high	93.8	Very high	43 Å²	43	64.8 Å²	64.8	44%	0.443	36%	0.361	S	S	.	.	S	Bend	trans	88.8	-16.8	179.5	0	0	0	0	0	115.4	H223 P224	H223-G226 PolarHBondContact O-N 3.23Å; P224-G226 PolarHBondContact O-N 3.46Å
227	G	94.3	Very high	93.9	Very high	33 Å²	33	66.8 Å²	66.8	34%	0.34	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-66.2	144.4	-179.6	0	0	0	0	0	113.1	R222 H223 N225	R222-G227 CarbonylContact C-O 3.34Å; R222-G227 VanDerWaalsContact CA-O 3.32Å; R222-G227 WeakPolarHBondContact CA-O 3.45Å; H223-G227 PolarHBondContact N-O 2.92Å; N225-G227 VanDerWaalsContact C-N 3.34Å; N225-G227 PolarHBondContact O-N 2.88Å; N225-G227 PolarHBondContact OD1-N 2.72Å
228	H	96.4	Very high	93.6	Very high	46 Å²	46	64.9 Å²	64.9	21%	0.213	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-66.6	134.3	175.2	-159.7	-70.1	0	0	0	110.2	Y221 F318 T319	Y221-H228 AromaticContact CD2-CD2 3.5Å; Y221-H228 VanDerWaalsContact CD2-CD2 3.5Å; Y221-H228 WeakPolarHBondContact CD2-CD2 3.18Å; Y221-H228 AromaticContact CD2-NE2 3.46Å; Y221-H228 WeakPolarHBondContact CD2-NE2 3.28Å; Y221-H228 AromaticContact CE2-CD2 3.97Å; H228-F318 AromaticContact CE1-CD1 3.95Å; H228-F318 AromaticContact CE1-CE1 3.57Å; H228-F318 PolarHBondContact CE1-O 2.97Å; H228-F318 AromaticContact ND1-CE1 3.93Å; H228-F318 PolarHBondContact NE2-O 2.74Å; H228-T319 HydrophobicContact CB-CG2 4.34Å
229	R	95.9	Very high	93.1	Very high	75 Å²	75	65.5 Å²	65.5	28%	0.283	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-67.2	142.3	174.7	-70.2	174.1	178.8	-89.9	3.1	109.7	P220 Y221 R222 H223 F318	P220-R229 WeakPolarHBondContact O-CD 3.46Å; Y221-R229 WeakPolarHBondContact O-CB 3.03Å; Y221-R229 WeakPolarHBondContact O-CG 3.09Å; Y221-R229 PolarHBondContact O-N 2.64Å; R222-R229 PolarHBondContact O-NE 3.4Å; H223-R229 WeakPolarHBondContact NE2-CG 3.09Å; R229-F318 WeakPolarHBondContact O-CE1 3.46Å
230	S	93.2	Very high	92.9	Very high	97 Å²	97	66.1 Å²	66.1	68%	0.678	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-65.5	153.8	173.7	52.2	0	0	0	0	111.8	R232	S230-R232 PolarHBondContact O-N 3.08Å
231	C	92.2	Very high	92.9	Very high	60 Å²	60	66.7 Å²	66.7	41%	0.405	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-63.3	131.3	173.4	-178.6	0	0	0	0	109.5	G233 F318	C231-G233 PolarHBondContact O-N 3.42Å; C231-G233 PolarHBondContact SG-N 2.94Å; C231-F318 HydrophobicContact CB-CD1 3.98Å; C231-F318 HydrophobicContact CB-CE1 3.81Å; C231-F318 HydrophobicContact CB-CG 4.43Å; C231-F318 HydrophobicContact CB-CZ 4.14Å
232	R	88.3	Confident	92.8	Very high	117 Å²	117	69.3 Å²	69.3	44%	0.442	38%	0.384	S	S	.	.			trans	-76.3	8.4	177.4	-68.7	179.5	-68.9	162.7	4.8	114.2	S230 I235 D253	S230-R232 PolarHBondContact O-N 3.08Å; R232-I235 HydrophobicContact CB-CG2 4.17Å; R232-D253 WeakPolarHBondContact CG-OD2 3.25Å; R232-D253 IonicContact CZ-OD1 3.94Å; R232-D253 IonicContact CZ-OD2 3.84Å; R232-D253 PolarHBondContact N-OD2 2.74Å; R232-D253 IonicContact NE-OD1 3.55Å; R232-D253 IonicContact NE-OD2 3.05Å; R232-D253 PolarHBondContact NE-OD2 2.92Å; R232-D253 IonicContact NH2-OD1 3.94Å; R232-D253 PolarHBondContact NH2-OD1 2.79Å; R232-D253 IonicContact NH2-OD2 3.94Å
233	G	87.1	Confident	92.9	Very high	40 Å²	40	66.8 Å²	66.8	41%	0.412	37%	0.374	S	S	.	.	S	Bend	trans	69.8	-135.4	-168.9	0	0	0	0	0	111	C231	C231-G233 PolarHBondContact O-N 3.42Å; C231-G233 PolarHBondContact SG-N 2.94Å
234	T	92.4	Very high	93	Very high	124 Å²	124	63.4 Å²	63.4	76%	0.761	36%	0.359	S	S	*	.	B	Isolated β-bridge	trans	-74.8	125.4	-176.6	-51.7	0	0	0	0	111.8	R251	T234-R251 CarbonylContact C-O 3.58Å; T234-R251 VanDerWaalsContact CA-O 3.26Å; T234-R251 WeakPolarHBondContact CA-O 3.35Å; T234-R251 HydrophobicContact CG2-CB 3.67Å
235	I	93.5	Very high	93.3	Very high	20 Å²	20	57 Å²	57	10%	0.103	32%	0.318	C	S	.	.			trans	-122.5	163.4	174.6	65.6	158	0	0	0	110.8	R232 Y238 R251 Q252 D253 L254	R232-I235 HydrophobicContact CB-CG2 4.17Å; I235-Y238 HydrophobicContact CD1-CD2 3.83Å; I235-Y238 HydrophobicContact CD1-CE2 3.94Å; I235-R251 PolarHBondContact N-O 3.43Å; I235-R251 WeakPolarHBondContact O-CA 3.14Å; I235-R251 VanDerWaalsContact O-CB 3.23Å; I235-R251 WeakPolarHBondContact O-CB 3.45Å; I235-R251 VanDerWaalsContact O-CD 3.24Å; I235-R251 WeakPolarHBondContact O-CD 3.39Å; I235-Q252 WeakPolarHBondContact CD1-O 3.39Å; I235-Q252 VanDerWaalsContact CG1-O 3.26Å; I235-Q252 WeakPolarHBondContact CG1-O 3.27Å; I235-D253 HydrophobicContact CG2-CB 4.39Å; I235-L254 HydrophobicContact CD1-CG 4.39Å
236	R	92.1	Very high	93.4	Very high	116 Å²	116	51.8 Å²	51.8	44%	0.438	29%	0.289	S	S	.	.			trans	-63.9	160.1	169.2	66.9	-176.3	175.4	142	14.9	112	Y238	R236-Y238 HydrophobicContact CG-CD2 4.19Å; R236-Y238 HydrophobicContact CG-CE2 3.54Å; R236-Y238 VanDerWaalsContact NE-CZ 3.29Å; R236-Y238 PolarHBondContact NE-OH 3.23Å; R236-Y238 VanDerWaalsContact NH2-CE1 3.29Å; R236-Y238 PolarHBondContact NH2-OH 2.93Å; R236-Y238 WeakPolarHBondContact O-CD2 3.44Å; R236-Y238 WeakPolarHBondContact O-CE2 3.5Å
237	F	94.1	Very high	93.7	Very high	46 Å²	46	51.6 Å²	51.6	20%	0.202	28%	0.276	C	S	.	.			trans	-56.6	139.4	172.5	-169.9	-109.9	0	0	0	112.3	G239 I241 A244 A248 H249 R251	F237-G239 VanDerWaalsContact CE1-O 3.28Å; F237-G239 WeakPolarHBondContact CE1-O 3.5Å; F237-I241 HydrophobicContact CE1-CG1 4Å; F237-I241 HydrophobicContact CZ-CG1 4.02Å; F237-A244 HydrophobicContact CE2-CB 3.68Å; F237-A244 HydrophobicContact CZ-CB 3.54Å; F237-A248 HydrophobicContact CD2-CB 4.49Å; F237-A248 HydrophobicContact CE2-CB 4.24Å; F237-H249 AromaticContact CE2-ND1 3.76Å; F237-R251 VanDerWaalsContact CB-NH1 3.32Å; F237-R251 VanDerWaalsContact CD2-NH1 3.31Å
238	Y	89.9	Confident	93.8	Very high	26 Å²	26	50.3 Å²	50.3	10%	0.102	26%	0.261	C	S	.	.			trans	-136.6	152.6	166.2	-68.8	-91.6	0	0	0	108.6	F217 I235 R236	F217-Y238 AromaticContact CD1-CD1 3.91Å; F217-Y238 HydrophobicContact CD1-CD1 3.91Å; F217-Y238 HydrophobicContact CD1-CE1 4.31Å; F217-Y238 HydrophobicContact CE1-CD1 4.4Å; I235-Y238 HydrophobicContact CD1-CD2 3.83Å; I235-Y238 HydrophobicContact CD1-CE2 3.94Å; R236-Y238 HydrophobicContact CG-CD2 4.19Å; R236-Y238 HydrophobicContact CG-CE2 3.54Å; R236-Y238 VanDerWaalsContact NE-CZ 3.29Å; R236-Y238 PolarHBondContact NE-OH 3.23Å; R236-Y238 VanDerWaalsContact NH2-CE1 3.29Å; R236-Y238 PolarHBondContact NH2-OH 2.93Å; R236-Y238 WeakPolarHBondContact O-CD2 3.44Å; R236-Y238 WeakPolarHBondContact O-CE2 3.5Å
239	G	86.5	Confident	93.9	Very high	24 Å²	24	48.3 Å²	48.3	25%	0.247	25%	0.252	C	S	.	.	S	Bend	trans	105.7	-178.6	179.7	0	0	0	0	0	113.1	F237	F237-G239 VanDerWaalsContact CE1-O 3.28Å; F237-G239 WeakPolarHBondContact CE1-O 3.5Å
240	H	92.1	Very high	93.9	Very high	66 Å²	66	47.4 Å²	47.4	31%	0.306	26%	0.258	S	S	.	.			trans	-92.4	130	171	-70.4	-84.1	0	0	0	108.8	R192 R242 Y243 A244	R192-H240 VanDerWaalsContact CG-CD2 3.46Å; R192-H240 WeakPolarHBondContact CG-CD2 3.42Å; H240-R242 PolarHBondContact O-N 2.96Å; H240-Y243 HydrophobicContact CB-CD2 3.93Å; H240-Y243 CarbonylContact O-C 3.59Å; H240-Y243 PolarHBondContact O-N 3.01Å; H240-A244 VanDerWaalsContact O-CB 3.31Å; H240-A244 WeakPolarHBondContact O-CB 3.41Å; H240-A244 PolarHBondContact O-N 2.97Å
241	I	96.1	Very high	94	Very high	51 Å²	51	46.4 Å²	46.4	26%	0.262	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-41.3	178.6	-67.3	172.7	0	0	0	111.5	F237 Y243 I281 E283 V286 K290	F237-I241 HydrophobicContact CE1-CG1 4Å; F237-I241 HydrophobicContact CZ-CG1 4.02Å; I241-Y243 PolarHBondContact O-N 3.25Å; I241-I281 WeakPolarHBondContact CD1-O 3.44Å; I241-E283 HydrophobicContact CD1-CB 4.11Å; I241-E283 HydrophobicContact CG1-CB 4.47Å; I241-V286 HydrophobicContact CG2-CB 3.74Å; I241-V286 HydrophobicContact CG2-CG1 3.86Å; I241-V286 HydrophobicContact CG2-CG2 3.73Å; I241-K290 PolarHBondContact O-NZ 3.13Å
242	R	96.3	Very high	94.2	Very high	62 Å²	62	47.3 Å²	47.3	23%	0.234	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-45	175.6	-175.2	178.9	-74.8	-135	0.3	113.8	H240 E269 L275 W277 E278 K290	H240-R242 PolarHBondContact O-N 2.96Å; R242-E269 IonicContact CZ-OE1 3.75Å; R242-E269 IonicContact NH1-OE1 3.74Å; R242-E269 PolarHBondContact NH1-OE1 3.31Å; R242-L275 HydrophobicContact CG-CD1 3.67Å; R242-W277 PolarHBondContact O-NE1 3.29Å; R242-E278 IonicContact CZ-OE1 3.59Å; R242-E278 IonicContact NH1-OE1 3.11Å; R242-E278 PolarHBondContact NH1-OE1 3.44Å; R242-E278 PolarHBondContact NH2-O 3.48Å; R242-E278 IonicContact NH2-OE1 2.76Å; R242-E278 PolarHBondContact NH2-OE1 3.12Å; R242-E278 VanDerWaalsContact NH2-OE1 3.09Å; R242-K290 WeakPolarHBondContact O-CE 3.23Å; R242-K290 PolarHBondContact O-NZ 3.19Å
243	Y	97.8	Very high	94.5	Very high	12 Å²	12	41.7 Å²	41.7	5%	0.047	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-11.1	-172.7	-51.6	-64.7	0	0	0	114.5	H240 I241 S262 Y265 L266 E269 L275	H240-Y243 HydrophobicContact CB-CD2 3.93Å; H240-Y243 CarbonylContact O-C 3.59Å; H240-Y243 PolarHBondContact O-N 3.01Å; I241-Y243 PolarHBondContact O-N 3.25Å; Y243-S262 VanDerWaalsContact O-CA 3.31Å; Y243-S262 WeakPolarHBondContact O-CA 3.18Å; Y243-S262 WeakPolarHBondContact O-CB 3.39Å; Y243-S262 PolarHBondContact O-OG 3.13Å; Y243-S262 VanDerWaalsContact O-OG 3.09Å; Y243-Y265 VanDerWaalsContact O-CD2 3.28Å; Y243-Y265 WeakPolarHBondContact O-CD2 3.47Å; Y243-L266 HydrophobicContact CD1-CD2 3.83Å; Y243-L266 HydrophobicContact CD1-CG 4.22Å; Y243-L266 HydrophobicContact CE1-CD2 3.38Å; Y243-L266 HydrophobicContact CE1-CG 4.22Å; Y243-L266 HydrophobicContact CE2-CD2 4.16Å; Y243-L266 HydrophobicContact CG-CD2 4.39Å; Y243-E269 PolarHBondContact OH-OE1 3.06Å; Y243-E269 PolarHBondContact OH-OE2 3.3Å; Y243-L275 HydrophobicContact CD1-CD1 4.08Å; Y243-L275 HydrophobicContact CE1-CD1 3.87Å
244	A	97.7	Very high	95	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.017	20%	0.198	C	C	.	.			trans	-60	141.1	-176.8	0	0	0	0	0	112	F237 H240 A248 K290	F237-A244 HydrophobicContact CE2-CB 3.68Å; F237-A244 HydrophobicContact CZ-CB 3.54Å; H240-A244 VanDerWaalsContact O-CB 3.31Å; H240-A244 WeakPolarHBondContact O-CB 3.41Å; H240-A244 PolarHBondContact O-N 2.97Å; A244-A248 HydrophobicContact CB-CB 4Å; A244-K290 PolarHBondContact O-NZ 3.28Å
245	S	97.9	Very high	95.2	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.007	16%	0.163	C	C	.	.			trans	-65.2	164.1	176	70.3	0	0	0	0	111.9	Y247 A248 H249 D258	S245-Y247 PolarHBondContact O-N 3.49Å; S245-Y247 PolarHBondContact OG-N 2.97Å; S245-A248 PolarHBondContact O-N 2.83Å; S245-A248 PolarHBondContact OG-N 3.23Å; S245-H249 PolarHBondContact O-CD2 3.13Å; S245-H249 PolarHBondContact O-N 2.98Å; S245-D258 WeakPolarHBondContact CB-OD1 3.45Å; S245-D258 PolarHBondContact OG-OD1 2.97Å
246	I	97.2	Very high	95.4	Very high	26 Å²	26	33.8 Å²	33.8	13%	0.133	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-27.1	171	61.4	173.8	0	0	0	112.1	S250 W261 K290 L294	I246-S250 WeakPolarHBondContact O-CB 3.49Å; I246-S250 PolarHBondContact O-N 3.28Å; I246-S250 PolarHBondContact O-OG 3.02Å; I246-W261 HydrophobicContact CB-CZ2 4.31Å; I246-W261 HydrophobicContact CD1-CH2 3.42Å; I246-W261 VanDerWaalsContact CD1-CH2 3.42Å; I246-W261 HydrophobicContact CD1-CZ2 3.86Å; I246-W261 HydrophobicContact CD1-CZ3 4.16Å; I246-W261 HydrophobicContact CG1-CH2 3.59Å; I246-W261 HydrophobicContact CG1-CZ2 3.71Å; I246-W261 HydrophobicContact CG1-CZ3 4.13Å; I246-W261 HydrophobicContact CG2-CH2 4.47Å; I246-W261 HydrophobicContact CG2-CZ2 3.8Å; I246-K290 HydrophobicContact CG2-CB 3.96Å; I246-L294 HydrophobicContact CD1-CD2 3.92Å
247	Y	96.8	Very high	95.7	Very high	40 Å²	40	29 Å²	29	16%	0.157	14%	0.141	C	C	.	.	H	α-helix	trans	-72.5	-39.5	177.5	-53.4	-64.1	0	0	0	111.7	S245 S250 R251 Q252 R257 W261	S245-Y247 PolarHBondContact O-N 3.49Å; S245-Y247 PolarHBondContact OG-N 2.97Å; Y247-S250 CarbonylContact O-C 3.53Å; Y247-S250 PolarHBondContact O-N 3.15Å; Y247-R251 PolarHBondContact O-N 3.33Å; Y247-R251 VanDerWaalsContact O-N 3.16Å; Y247-Q252 PolarHBondContact O-N 3.2Å; Y247-R257 VanDerWaalsContact CD1-NH2 3.29Å; Y247-R257 HydrophobicContact CD2-CG 4.41Å; Y247-R257 VanDerWaalsContact CD2-CZ 3.48Å; Y247-R257 HydrophobicContact CE2-CG 4.37Å; Y247-R257 VanDerWaalsContact CE2-CZ 3.42Å; Y247-R257 VanDerWaalsContact CG-NH2 3.29Å; Y247-R257 VanDerWaalsContact CZ-NH1 3.28Å; Y247-W261 HydrophobicContact CD2-CE3 4.39Å; Y247-W261 HydrophobicContact CD2-CZ3 4.49Å; Y247-W261 AromaticContact CE2-CE3 3.9Å; Y247-W261 HydrophobicContact CE2-CE3 3.9Å; Y247-W261 AromaticContact CE2-CZ3 3.71Å; Y247-W261 HydrophobicContact CE2-CZ3 3.71Å
248	A	97.3	Very high	95.9	Very high	5 Å²	5	27 Å²	27	4%	0.041	13%	0.133	C	C	.	.	H	α-helix	trans	-61.5	-44.9	173.6	0	0	0	0	0	111.9	F237 A244 S245 S250 R251 L254	F237-A248 HydrophobicContact CD2-CB 4.49Å; F237-A248 HydrophobicContact CE2-CB 4.24Å; A244-A248 HydrophobicContact CB-CB 4Å; S245-A248 PolarHBondContact O-N 2.83Å; S245-A248 PolarHBondContact OG-N 3.23Å; A248-S250 VanDerWaalsContact C-N 3.3Å; A248-S250 PolarHBondContact O-N 3.02Å; A248-R251 PolarHBondContact O-N 2.98Å; A248-R251 VanDerWaalsContact O-N 3.09Å; A248-R251 PolarHBondContact O-NH1 3.05Å; A248-L254 HydrophobicContact CB-CD2 3.69Å
249	H	97.1	Very high	96.4	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.019	13%	0.128	C	C	.	.	H	α-helix	trans	-59.3	-42.6	172.7	-76	-55.7	0	0	0	111.7	F237 S245 R251 E283 Q287	F237-H249 AromaticContact CE2-ND1 3.76Å; S245-H249 PolarHBondContact O-CD2 3.13Å; S245-H249 PolarHBondContact O-N 2.98Å; H249-R251 PolarHBondContact O-N 3.32Å; H249-R251 VanDerWaalsContact O-N 3.07Å; H249-R251 PolarHBondContact O-NH1 3.1Å; H249-E283 WeakPolarHBondContact ND1-CG 3.42Å; H249-E283 IonicContact ND1-OE1 3.56Å; H249-Q287 HydrophobicContact CB-CB 3.96Å; H249-Q287 HydrophobicContact CB-CG 3.63Å
250	S	95.7	Very high	96.9	Very high	57 Å²	57	24.7 Å²	24.7	40%	0.399	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	13	176	-53.5	0	0	0	0	114.3	I246 Y247 A248 Q252	I246-S250 WeakPolarHBondContact O-CB 3.49Å; I246-S250 PolarHBondContact O-N 3.28Å; I246-S250 PolarHBondContact O-OG 3.02Å; Y247-S250 CarbonylContact O-C 3.53Å; Y247-S250 PolarHBondContact O-N 3.15Å; A248-S250 VanDerWaalsContact C-N 3.3Å; A248-S250 PolarHBondContact O-N 3.02Å; S250-Q252 PolarHBondContact O-N 3.05Å; S250-Q252 VanDerWaalsContact O-N 3.14Å
251	R	96.3	Very high	97.3	Very high	76 Å²	76	21.7 Å²	21.7	29%	0.287	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	25.9	175.3	-57.7	-67.8	177.9	-103.6	6.4	113.5	T234 I235 F237 Y247 A248 H249 E283	T234-R251 CarbonylContact C-O 3.58Å; T234-R251 VanDerWaalsContact CA-O 3.26Å; T234-R251 WeakPolarHBondContact CA-O 3.35Å; T234-R251 HydrophobicContact CG2-CB 3.67Å; I235-R251 PolarHBondContact N-O 3.43Å; I235-R251 WeakPolarHBondContact O-CA 3.14Å; I235-R251 VanDerWaalsContact O-CB 3.23Å; I235-R251 WeakPolarHBondContact O-CB 3.45Å; I235-R251 VanDerWaalsContact O-CD 3.24Å; I235-R251 WeakPolarHBondContact O-CD 3.39Å; F237-R251 VanDerWaalsContact CB-NH1 3.32Å; F237-R251 VanDerWaalsContact CD2-NH1 3.31Å; Y247-R251 PolarHBondContact O-N 3.33Å; Y247-R251 VanDerWaalsContact O-N 3.16Å; A248-R251 PolarHBondContact O-N 2.98Å; A248-R251 VanDerWaalsContact O-N 3.09Å; A248-R251 PolarHBondContact O-NH1 3.05Å; H249-R251 PolarHBondContact O-N 3.32Å; H249-R251 VanDerWaalsContact O-N 3.07Å; H249-R251 PolarHBondContact O-NH1 3.1Å; R251-E283 IonicContact CZ-OE1 2.64Å; R251-E283 IonicContact CZ-OE2 2.85Å; R251-E283 IonicContact NH1-OE1 2.64Å; R251-E283 PolarHBondContact NH1-OE1 3.13Å; R251-E283 IonicContact NH1-OE2 3.54Å; R251-E283 IonicContact NH2-OE1 2.63Å; R251-E283 PolarHBondContact NH2-OE1 3.49Å; R251-E283 IonicContact NH2-OE2 3.67Å; R251-E283 PolarHBondContact NH2-OE2 2.96Å
252	Q	96.1	Very high	97.4	Very high	78 Å²	78	19.7 Å²	19.7	36%	0.364	9%	0.093	S	C	.	.	B	Isolated β-bridge	trans	-83.8	156.6	175.6	-60.4	-174.9	23.8	0	0	111.1	I235 Y247 S250	I235-Q252 WeakPolarHBondContact CD1-O 3.39Å; I235-Q252 VanDerWaalsContact CG1-O 3.26Å; I235-Q252 WeakPolarHBondContact CG1-O 3.27Å; Y247-Q252 PolarHBondContact O-N 3.2Å; S250-Q252 PolarHBondContact O-N 3.05Å; S250-Q252 VanDerWaalsContact O-N 3.14Å
253	D	94.8	Very high	97.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	P	Polyproline II helix	trans	-62.9	146	174.2	-152.2	3.7	0	0	0	110.9	R219 R232 I235 F318	R219-D253 IonicContact NH1-OD2 2.66Å; R232-D253 WeakPolarHBondContact CG-OD2 3.25Å; R232-D253 IonicContact CZ-OD1 3.94Å; R232-D253 IonicContact CZ-OD2 3.84Å; R232-D253 PolarHBondContact N-OD2 2.74Å; R232-D253 IonicContact NE-OD1 3.55Å; R232-D253 IonicContact NE-OD2 3.05Å; R232-D253 PolarHBondContact NE-OD2 2.92Å; R232-D253 IonicContact NH2-OD1 3.94Å; R232-D253 PolarHBondContact NH2-OD1 2.79Å; R232-D253 IonicContact NH2-OD2 3.94Å; I235-D253 HydrophobicContact CG2-CB 4.39Å; D253-F318 HydrophobicContact CB-CE2 3.76Å; D253-F318 HydrophobicContact CB-CZ 4.04Å; D253-F318 WeakPolarHBondContact O-CD2 3.35Å; D253-F318 WeakPolarHBondContact O-CE2 3.31Å
254	L	96.9	Very high	97.5	Very high	7 Å²	7	16.1 Å²	16.1	4%	0.037	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-97.3	144.2	-174.3	-56.1	-174.9	0	0	0	111.5	R191 I235 A248 D258	R191-L254 HydrophobicContact CB-CD1 3.95Å; R191-L254 HydrophobicContact CG-CB 4.06Å; R191-L254 HydrophobicContact CG-CD1 4.3Å; I235-L254 HydrophobicContact CD1-CG 4.39Å; A248-L254 HydrophobicContact CB-CD2 3.69Å; L254-D258 WeakPolarHBondContact CA-OD2 3.43Å; L254-D258 HydrophobicContact CB-CB 4.3Å; L254-D258 HydrophobicContact CD2-CB 4.1Å
255	S	97.4	Very high	97.6	Very high	2 Å²	2	16 Å²	16	1%	0.014	8%	0.078	C	C	.	.			trans	-139	-172.5	-176.5	66.8	0	0	0	0	111	R257 D258 F318	S255-R257 PolarHBondContact O-N 2.78Å; S255-R257 WeakPolarHBondContact OG-CG 3.42Å; S255-D258 PolarHBondContact N-OD2 3.31Å; S255-D258 WeakPolarHBondContact O-CB 3.06Å; S255-D258 PolarHBondContact O-N 3.37Å; S255-D258 VanDerWaalsContact O-N 3.07Å; S255-D258 PolarHBondContact OG-OD2 3.15Å; S255-D258 VanDerWaalsContact OG-OD2 3.1Å; S255-F318 WeakPolarHBondContact CB-O 3.35Å; S255-F318 PolarHBondContact OG-O 3.03Å
256	R	98.3	Very high	97.6	Very high	8 Å²	8	16 Å²	16	3%	0.03	8%	0.078	C	C	.	.	H	α-helix	trans	-57.1	-33.5	177.6	-62.7	176.7	-77.7	-167.9	2.4	112.9	H184 T189 Y221 D258 D259 L260 T319 A320 E321 P322	H184-R256 HydrophobicContact CB-CG 4.26Å; T189-R256 HydrophobicContact CG2-CG 4.02Å; Y221-R256 HydrophobicContact CD1-CG 4.4Å; Y221-R256 HydrophobicContact CE1-CG 4.14Å; Y221-R256 HydrophobicContact CE2-CG 4.28Å; Y221-R256 VanDerWaalsContact CE2-CZ 3.46Å; Y221-R256 PolarHBondContact OH-NH1 2.8Å; R256-D258 PolarHBondContact O-N 2.92Å; R256-D259 PolarHBondContact O-N 3.27Å; R256-L260 PolarHBondContact O-N 2.87Å; R256-T319 PolarHBondContact NH2-O 2.83Å; R256-A320 PolarHBondContact NE-O 3.01Å; R256-A320 VanDerWaalsContact NH2-C 3.31Å; R256-A320 PolarHBondContact NH2-O 3.44Å; R256-E321 IonicContact CZ-OE2 3.68Å; R256-E321 IonicContact NH1-OE2 2.79Å; R256-E321 PolarHBondContact NH1-OE2 2.75Å; R256-E321 IonicContact NH2-OE2 3.67Å; R256-P322 HydrophobicContact CB-CG 3.97Å
257	R	97.9	Very high	97.6	Very high	17 Å²	17	14.9 Å²	14.9	6%	0.064	7%	0.072	C	C	.	.	H	α-helix	trans	-62.5	-33.3	178	82.9	-168.5	172.6	162.3	-2.4	112.1	Y247 S255 L260 W261 M316 D317	Y247-R257 VanDerWaalsContact CD1-NH2 3.29Å; Y247-R257 HydrophobicContact CD2-CG 4.41Å; Y247-R257 VanDerWaalsContact CD2-CZ 3.48Å; Y247-R257 HydrophobicContact CE2-CG 4.37Å; Y247-R257 VanDerWaalsContact CE2-CZ 3.42Å; Y247-R257 VanDerWaalsContact CG-NH2 3.29Å; Y247-R257 VanDerWaalsContact CZ-NH1 3.28Å; S255-R257 PolarHBondContact O-N 2.78Å; S255-R257 WeakPolarHBondContact OG-CG 3.42Å; R257-L260 PolarHBondContact O-N 3.22Å; R257-W261 WeakPolarHBondContact O-CB 3.16Å; R257-W261 PolarHBondContact O-N 2.86Å; R257-M316 HydrophobicContact CB-CB 3.75Å; R257-M316 HydrophobicContact CB-SD 4.31Å; R257-M316 VanDerWaalsContact CD-O 3.25Å; R257-M316 WeakPolarHBondContact CD-O 3.33Å; R257-M316 PolarHBondContact NH1-O 3.05Å; R257-M316 VanDerWaalsContact NH1-O 3.15Å; R257-D317 WeakPolarHBondContact CD-O 3.44Å
258	D	98.5	Very high	97.7	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.021	7%	0.069	C	C	.	.	H	α-helix	trans	-75.8	-32.5	-176.1	-59.3	-81.1	0	0	0	111.6	S245 L254 S255 R256 S262	S245-D258 WeakPolarHBondContact CB-OD1 3.45Å; S245-D258 PolarHBondContact OG-OD1 2.97Å; L254-D258 WeakPolarHBondContact CA-OD2 3.43Å; L254-D258 HydrophobicContact CB-CB 4.3Å; L254-D258 HydrophobicContact CD2-CB 4.1Å; S255-D258 PolarHBondContact N-OD2 3.31Å; S255-D258 WeakPolarHBondContact O-CB 3.06Å; S255-D258 PolarHBondContact O-N 3.37Å; S255-D258 VanDerWaalsContact O-N 3.07Å; S255-D258 PolarHBondContact OG-OD2 3.15Å; S255-D258 VanDerWaalsContact OG-OD2 3.1Å; R256-D258 PolarHBondContact O-N 2.92Å; D258-S262 WeakPolarHBondContact O-CB 3.41Å; D258-S262 PolarHBondContact O-N 3.16Å; D258-S262 PolarHBondContact O-OG 3.3Å
259	D	98.8	Very high	97.7	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.5	-42.6	170.2	-70.3	-29.4	0	0	0	110.7	L180 H184 T189 H190 R191 I193 R256 S262 L263	L180-D259 HydrophobicContact CD1-CB 4.23Å; L180-D259 HydrophobicContact CD2-CB 4.03Å; H184-D259 IonicContact NE2-OD2 3.07Å; H184-D259 PolarHBondContact NE2-OD2 2.91Å; H184-D259 VanDerWaalsContact NE2-OD2 3.11Å; T189-D259 WeakPolarHBondContact CA-OD2 3.43Å; T189-D259 WeakPolarHBondContact CB-OD2 3.45Å; H190-D259 PolarHBondContact N-OD2 2.9Å; R191-D259 WeakPolarHBondContact CA-OD1 3.26Å; R191-D259 PolarHBondContact N-OD1 3.42Å; I193-D259 HydrophobicContact CG1-CB 4.14Å; R256-D259 PolarHBondContact O-N 3.27Å; D259-S262 PolarHBondContact O-N 2.84Å; D259-L263 WeakPolarHBondContact O-CB 3.12Å; D259-L263 PolarHBondContact O-N 3.18Å
260	L	98.9	Very high	97.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-70.8	-33.6	176.3	-68.7	172.7	0	0	0	113.6	L180 R256 R257 S262 L263 F264 F309 V313 M316 P322 L327	L180-L260 HydrophobicContact CD1-CD2 4.01Å; R256-L260 PolarHBondContact O-N 2.87Å; R257-L260 PolarHBondContact O-N 3.22Å; L260-S262 VanDerWaalsContact C-N 3.34Å; L260-L263 HydrophobicContact CD2-CD2 4.36Å; L260-L263 PolarHBondContact O-N 3.29Å; L260-F264 PolarHBondContact O-N 2.7Å; L260-F309 HydrophobicContact CD2-CZ 4.5Å; L260-V313 HydrophobicContact CB-CG1 4.29Å; L260-V313 HydrophobicContact CB-CG2 3.92Å; L260-M316 HydrophobicContact CD1-CE 4.08Å; L260-M316 HydrophobicContact CD1-SD 3.96Å; L260-P322 HydrophobicContact CD1-CB 3.42Å; L260-P322 VanDerWaalsContact CD1-CB 3.42Å; L260-P322 HydrophobicContact CD1-CG 3.46Å; L260-P322 VanDerWaalsContact CD1-CG 3.46Å; L260-L327 HydrophobicContact CD1-CD1 3.81Å; L260-L327 HydrophobicContact CD2-CD1 4Å
261	W	98.5	Very high	97.6	Very high	3 Å²	3	12 Å²	12	1%	0.011	5%	0.053	C	C	.	.	H	α-helix	trans	-63.1	-43.9	172.2	-163.5	-59.5	0	0	0	111	I246 Y247 R257 L263 F264 Y265 L295 V313 E314	I246-W261 HydrophobicContact CB-CZ2 4.31Å; I246-W261 HydrophobicContact CD1-CH2 3.42Å; I246-W261 VanDerWaalsContact CD1-CH2 3.42Å; I246-W261 HydrophobicContact CD1-CZ2 3.86Å; I246-W261 HydrophobicContact CD1-CZ3 4.16Å; I246-W261 HydrophobicContact CG1-CH2 3.59Å; I246-W261 HydrophobicContact CG1-CZ2 3.71Å; I246-W261 HydrophobicContact CG1-CZ3 4.13Å; I246-W261 HydrophobicContact CG2-CH2 4.47Å; I246-W261 HydrophobicContact CG2-CZ2 3.8Å; Y247-W261 HydrophobicContact CD2-CE3 4.39Å; Y247-W261 HydrophobicContact CD2-CZ3 4.49Å; Y247-W261 AromaticContact CE2-CE3 3.9Å; Y247-W261 HydrophobicContact CE2-CE3 3.9Å; Y247-W261 AromaticContact CE2-CZ3 3.71Å; Y247-W261 HydrophobicContact CE2-CZ3 3.71Å; R257-W261 WeakPolarHBondContact O-CB 3.16Å; R257-W261 PolarHBondContact O-N 2.86Å; W261-L263 VanDerWaalsContact C-N 3.32Å; W261-F264 WeakPolarHBondContact O-CB 3.25Å; W261-F264 PolarHBondContact O-N 3.21Å; W261-Y265 AromaticContact CD1-CD2 3.92Å; W261-Y265 AromaticContact CD1-CE2 3.27Å; W261-Y265 AromaticContact CD1-CZ 3.63Å; W261-Y265 AromaticContact NE1-CE2 3.33Å; W261-Y265 VanDerWaalsContact NE1-CE2 3.33Å; W261-Y265 AromaticContact NE1-CZ 3.21Å; W261-Y265 PolarHBondContact NE1-OH 3.38Å; W261-Y265 PolarHBondContact O-N 2.87Å; W261-L295 HydrophobicContact CD2-CD1 4.01Å; W261-L295 HydrophobicContact CD2-CD2 4.16Å; W261-L295 HydrophobicContact CD2-CG 4.22Å; W261-L295 VanDerWaalsContact CE2-CD2 3.46Å; W261-L295 HydrophobicContact CE3-CD1 4.29Å; W261-L295 HydrophobicContact CG-CD1 4.34Å; W261-L295 HydrophobicContact CG-CD2 4.33Å; W261-L295 HydrophobicContact CH2-CG 4.2Å; W261-L295 HydrophobicContact CZ2-CD1 4.37Å; W261-L295 HydrophobicContact CZ2-CD2 3.77Å; W261-L295 HydrophobicContact CZ2-CG 3.73Å; W261-L295 VanDerWaalsContact NE1-CD2 3.25Å; W261-V313 HydrophobicContact CB-CG1 4.04Å; W261-V313 HydrophobicContact CD2-CG1 4.47Å; W261-V313 HydrophobicContact CE3-CG1 4.07Å; W261-E314 HydrophobicContact CH2-CG 4.04Å; W261-E314 HydrophobicContact CZ3-CG 4.23Å
262	S	98.7	Very high	97.5	Very high	9 Å²	9	10.8 Å²	10.8	6%	0.063	5%	0.052	C	C	.	.	H	α-helix	trans	-64.9	-38.6	175.2	-56.9	0	0	0	0	111.4	Y243 D258 D259 L260 Y265 L266	Y243-S262 VanDerWaalsContact O-CA 3.31Å; Y243-S262 WeakPolarHBondContact O-CA 3.18Å; Y243-S262 WeakPolarHBondContact O-CB 3.39Å; Y243-S262 PolarHBondContact O-OG 3.13Å; Y243-S262 VanDerWaalsContact O-OG 3.09Å; D258-S262 WeakPolarHBondContact O-CB 3.41Å; D258-S262 PolarHBondContact O-N 3.16Å; D258-S262 PolarHBondContact O-OG 3.3Å; D259-S262 PolarHBondContact O-N 2.84Å; L260-S262 VanDerWaalsContact C-N 3.34Å; S262-Y265 PolarHBondContact O-N 3.08Å; S262-L266 PolarHBondContact O-N 2.95Å
263	L	98.8	Very high	97.4	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-65.5	-40.3	175.1	179.8	58.3	0	0	0	112.2	C176 I177 L180 D259 L260 W261 Y265 L266 I267	C176-L263 HydrophobicContact CB-CD1 3.49Å; C176-L263 VanDerWaalsContact CB-CD1 3.49Å; C176-L263 HydrophobicContact CB-CD2 4.12Å; C176-L263 HydrophobicContact CB-CG 4.48Å; I177-L263 HydrophobicContact CG1-CD2 3.68Å; L180-L263 HydrophobicContact CD1-CB 4.1Å; L180-L263 HydrophobicContact CD1-CD2 3.73Å; L180-L263 HydrophobicContact CD1-CG 4.49Å; D259-L263 WeakPolarHBondContact O-CB 3.12Å; D259-L263 PolarHBondContact O-N 3.18Å; L260-L263 HydrophobicContact CD2-CD2 4.36Å; L260-L263 PolarHBondContact O-N 3.29Å; W261-L263 VanDerWaalsContact C-N 3.32Å; L263-Y265 VanDerWaalsContact C-N 3.27Å; L263-Y265 PolarHBondContact O-N 3.23Å; L263-L266 HydrophobicContact CD1-CB 4.4Å; L263-L266 HydrophobicContact CD1-CD1 4.41Å; L263-L266 WeakPolarHBondContact O-CA 3.49Å; L263-L266 WeakPolarHBondContact O-CB 3.07Å; L263-L266 PolarHBondContact O-N 3.49Å; L263-I267 HydrophobicContact CD1-CD1 4.25Å; L263-I267 HydrophobicContact CD1-CG1 4.12Å; L263-I267 HydrophobicContact CD2-CD1 4.47Å; L263-I267 HydrophobicContact CG-CD1 3.92Å; L263-I267 HydrophobicContact CG-CG1 4.26Å; L263-I267 WeakPolarHBondContact O-CG1 3.38Å; L263-I267 PolarHBondContact O-N 2.64Å
264	F	98.7	Very high	97.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-54	-46.6	174.4	174.2	-91.3	0	0	0	111.5	L260 W261 L266 I267 Y268 L295 L298 C299 L306 F309 A310	L260-F264 PolarHBondContact O-N 2.7Å; W261-F264 WeakPolarHBondContact O-CB 3.25Å; W261-F264 PolarHBondContact O-N 3.21Å; F264-L266 VanDerWaalsContact C-N 3.27Å; F264-L266 PolarHBondContact O-N 2.94Å; F264-I267 PolarHBondContact O-N 3.12Å; F264-Y268 WeakPolarHBondContact O-CB 3.22Å; F264-Y268 PolarHBondContact O-N 3.43Å; F264-L295 HydrophobicContact CB-CD1 4.15Å; F264-L295 HydrophobicContact CD1-CB 4.06Å; F264-L295 HydrophobicContact CD1-CD1 4.01Å; F264-L295 HydrophobicContact CD1-CD2 3.44Å; F264-L295 VanDerWaalsContact CD1-CD2 3.44Å; F264-L295 HydrophobicContact CD1-CG 4.03Å; F264-L295 HydrophobicContact CD2-CD1 4.46Å; F264-L295 HydrophobicContact CE1-CB 3.79Å; F264-L295 HydrophobicContact CE1-CD2 3.79Å; F264-L295 HydrophobicContact CE1-CG 4.25Å; F264-L295 HydrophobicContact CG-CD1 3.93Å; F264-L295 HydrophobicContact CG-CD2 4.2Å; F264-L295 HydrophobicContact CG-CG 4.44Å; F264-L295 HydrophobicContact CZ-CB 4.03Å; F264-L298 HydrophobicContact CE1-CB 4.2Å; F264-L298 HydrophobicContact CE1-CD1 3.79Å; F264-L298 HydrophobicContact CZ-CB 4.33Å; F264-C299 VanDerWaalsContact CZ-SG 3.57Å; F264-L306 HydrophobicContact CD2-CD1 3.87Å; F264-L306 HydrophobicContact CE2-CD1 3.55Å; F264-L306 HydrophobicContact CE2-CD2 4.44Å; F264-L306 HydrophobicContact CE2-CG 3.72Å; F264-L306 HydrophobicContact CZ-CD1 4.44Å; F264-L306 HydrophobicContact CZ-CG 4.33Å; F264-F309 HydrophobicContact CB-CD1 4.29Å; F264-F309 HydrophobicContact CB-CE1 3.91Å; F264-F309 AromaticContact CD2-CD1 3.77Å; F264-F309 HydrophobicContact CD2-CD1 3.77Å; F264-F309 HydrophobicContact CD2-CE1 4.25Å; F264-A310 HydrophobicContact CD2-CB 4.16Å; F264-A310 HydrophobicContact CE2-CB 3.54Å; F264-A310 HydrophobicContact CZ-CB 3.98Å
265	Y	98.5	Very high	97.3	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-62.9	-33.7	177.1	-67.5	-40.3	0	0	0	113	Y243 W261 S262 L263 E269 L275 W277 K290 L295 L298	Y243-Y265 VanDerWaalsContact O-CD2 3.28Å; Y243-Y265 WeakPolarHBondContact O-CD2 3.47Å; W261-Y265 AromaticContact CD1-CD2 3.92Å; W261-Y265 AromaticContact CD1-CE2 3.27Å; W261-Y265 AromaticContact CD1-CZ 3.63Å; W261-Y265 AromaticContact NE1-CE2 3.33Å; W261-Y265 VanDerWaalsContact NE1-CE2 3.33Å; W261-Y265 AromaticContact NE1-CZ 3.21Å; W261-Y265 PolarHBondContact NE1-OH 3.38Å; W261-Y265 PolarHBondContact O-N 2.87Å; S262-Y265 PolarHBondContact O-N 3.08Å; L263-Y265 VanDerWaalsContact C-N 3.27Å; L263-Y265 PolarHBondContact O-N 3.23Å; Y265-E269 WeakPolarHBondContact O-CB 3.5Å; Y265-E269 PolarHBondContact O-N 2.97Å; Y265-L275 HydrophobicContact CD1-CD2 3.94Å; Y265-L275 HydrophobicContact CG-CD2 4.31Å; Y265-W277 AromaticContact CD1-CH2 3.9Å; Y265-W277 HydrophobicContact CD1-CH2 3.9Å; Y265-W277 AromaticContact CD1-CZ2 3.67Å; Y265-W277 HydrophobicContact CD1-CZ2 3.67Å; Y265-W277 HydrophobicContact CD2-CZ2 4.37Å; Y265-W277 AromaticContact CE1-CH2 3.31Å; Y265-W277 HydrophobicContact CE1-CH2 3.31Å; Y265-W277 AromaticContact CE1-CZ2 3.44Å; Y265-W277 HydrophobicContact CE1-CZ2 3.44Å; Y265-W277 VanDerWaalsContact CE1-CZ2 3.44Å; Y265-W277 HydrophobicContact CE2-CZ2 4.11Å; Y265-W277 HydrophobicContact CG-CZ2 4.15Å; Y265-W277 AromaticContact CZ-CH2 3.66Å; Y265-W277 AromaticContact CZ-CZ2 3.64Å; Y265-K290 HydrophobicContact CE2-CD 4.21Å; Y265-K290 WeakPolarHBondContact OH-CG 3.06Å; Y265-L295 HydrophobicContact CD1-CD2 4.22Å; Y265-L295 HydrophobicContact CE1-CD2 3.44Å; Y265-L295 VanDerWaalsContact CE1-CD2 3.44Å; Y265-L298 HydrophobicContact CD1-CD1 3.83Å; Y265-L298 HydrophobicContact CE1-CD1 3.64Å
266	L	98.3	Very high	97.2	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-67.4	-45.2	173.3	-69.4	176	0	0	0	112.1	I193 S194 F198 Y243 S262 L263 F264 Y268 E269 F270	I193-L266 HydrophobicContact CG2-CD1 3.51Å; S194-L266 VanDerWaalsContact C-CD1 3.48Å; F198-L266 HydrophobicContact CD2-CD1 4.43Å; F198-L266 HydrophobicContact CE2-CD1 4Å; Y243-L266 HydrophobicContact CD1-CD2 3.83Å; Y243-L266 HydrophobicContact CD1-CG 4.22Å; Y243-L266 HydrophobicContact CE1-CD2 3.38Å; Y243-L266 HydrophobicContact CE1-CG 4.22Å; Y243-L266 HydrophobicContact CE2-CD2 4.16Å; Y243-L266 HydrophobicContact CG-CD2 4.39Å; S262-L266 PolarHBondContact O-N 2.95Å; L263-L266 HydrophobicContact CD1-CB 4.4Å; L263-L266 HydrophobicContact CD1-CD1 4.41Å; L263-L266 WeakPolarHBondContact O-CA 3.49Å; L263-L266 WeakPolarHBondContact O-CB 3.07Å; L263-L266 PolarHBondContact O-N 3.49Å; F264-L266 VanDerWaalsContact C-N 3.27Å; F264-L266 PolarHBondContact O-N 2.94Å; L266-Y268 VanDerWaalsContact C-N 3.32Å; L266-Y268 PolarHBondContact O-N 2.92Å; L266-E269 CarbonylContact O-C 3.53Å; L266-E269 PolarHBondContact O-N 3.41Å; L266-E269 VanDerWaalsContact O-N 3.13Å; L266-F270 HydrophobicContact CB-CE1 4.31Å; L266-F270 HydrophobicContact CB-CE2 4.35Å; L266-F270 HydrophobicContact CB-CZ 3.97Å; L266-F270 WeakPolarHBondContact O-CD1 3.38Å; L266-F270 WeakPolarHBondContact O-CG 3.36Å; L266-F270 PolarHBondContact O-N 2.64Å
267	I	98.3	Very high	97.2	Very high	2 Å²	2	14 Å²	14	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-61.8	-44.2	178.3	-61.8	170.2	0	0	0	110	A173 L263 F264 E269 F270 M271 L306 F309 I331	A173-I267 HydrophobicContact CB-CD1 3.77Å; A173-I267 HydrophobicContact CB-CG1 3.71Å; A173-I267 HydrophobicContact CB-CG2 4.25Å; L263-I267 HydrophobicContact CD1-CD1 4.25Å; L263-I267 HydrophobicContact CD1-CG1 4.12Å; L263-I267 HydrophobicContact CD2-CD1 4.47Å; L263-I267 HydrophobicContact CG-CD1 3.92Å; L263-I267 HydrophobicContact CG-CG1 4.26Å; L263-I267 WeakPolarHBondContact O-CG1 3.38Å; L263-I267 PolarHBondContact O-N 2.64Å; F264-I267 PolarHBondContact O-N 3.12Å; I267-E269 VanDerWaalsContact C-N 3.32Å; I267-E269 PolarHBondContact O-N 3.06Å; I267-F270 WeakPolarHBondContact O-CB 3.49Å; I267-F270 PolarHBondContact O-N 2.8Å; I267-M271 HydrophobicContact CG2-SD 4.3Å; I267-M271 WeakPolarHBondContact O-CG 3.19Å; I267-M271 PolarHBondContact O-N 2.74Å; I267-M271 VanDerWaalsContact O-N 3.16Å; I267-L306 HydrophobicContact CB-CD1 4.43Å; I267-L306 HydrophobicContact CG2-CD1 3.83Å; I267-F309 HydrophobicContact CD1-CE2 4.28Å; I267-F309 HydrophobicContact CD1-CZ 4.23Å; I267-I331 HydrophobicContact CD1-CD1 3.97Å; I267-I331 HydrophobicContact CD1-CG1 4.39Å; I267-I331 HydrophobicContact CG2-CD1 4.14Å
268	Y	97.8	Very high	96.9	Very high	24 Å²	24	15.4 Å²	15.4	9%	0.094	8%	0.078	C	C	.	.	H	α-helix	trans	-58.1	-44.4	173.7	-178.2	-84.5	0	0	0	111.9	F264 L266 F270 M271 N272 F274 L275 L298 M302 L306	F264-Y268 WeakPolarHBondContact O-CB 3.22Å; F264-Y268 PolarHBondContact O-N 3.43Å; L266-Y268 VanDerWaalsContact C-N 3.32Å; L266-Y268 PolarHBondContact O-N 2.92Å; Y268-F270 VanDerWaalsContact C-N 3.34Å; Y268-M271 PolarHBondContact O-N 3.42Å; Y268-N272 HydrophobicContact CD1-CB 4.35Å; Y268-N272 WeakPolarHBondContact CD2-ND2 3.23Å; Y268-N272 HydrophobicContact CE1-CB 3.91Å; Y268-N272 WeakPolarHBondContact CE2-ND2 3.37Å; Y268-N272 VanDerWaalsContact CZ-ND2 3.33Å; Y268-N272 WeakPolarHBondContact O-CB 3Å; Y268-N272 PolarHBondContact O-N 3.31Å; Y268-N272 PolarHBondContact O-ND2 3.41Å; Y268-N272 VanDerWaalsContact O-ND2 3.1Å; Y268-F274 VanDerWaalsContact CE1-O 3.22Å; Y268-F274 WeakPolarHBondContact CE1-O 3.29Å; Y268-L275 HydrophobicContact CD1-CD2 3.6Å; Y268-L275 HydrophobicContact CD1-CG 4.46Å; Y268-L275 HydrophobicContact CE1-CD2 4.27Å; Y268-L275 HydrophobicContact CG-CD2 4.34Å; Y268-L298 HydrophobicContact CD2-CB 3.94Å; Y268-L298 HydrophobicContact CE2-CB 3.8Å; Y268-L298 HydrophobicContact CE2-CD2 4.43Å; Y268-L298 WeakPolarHBondContact CE2-O 3.48Å; Y268-M302 HydrophobicContact CD2-CE 4.36Å; Y268-M302 HydrophobicContact CD2-CG 4.48Å; Y268-M302 HydrophobicContact CD2-SD 4.5Å; Y268-M302 HydrophobicContact CE2-CE 4.49Å; Y268-M302 HydrophobicContact CE2-CG 4.15Å; Y268-M302 HydrophobicContact CE2-SD 4.08Å; Y268-L306 HydrophobicContact CD2-CD2 4.26Å
269	E	96.3	Very high	96.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69.1	-31	178.3	-162.4	-174	-122.1	0	0	112.1	R156 R242 Y243 Y265 L266 I267 M271 G273 L275	R156-E269 IonicContact CZ-OE1 3.87Å; R156-E269 IonicContact CZ-OE2 2.69Å; R156-E269 IonicContact NE-OE2 2.85Å; R156-E269 PolarHBondContact NE-OE2 3.12Å; R156-E269 IonicContact NH2-OE1 3.45Å; R156-E269 PolarHBondContact NH2-OE1 3.31Å; R156-E269 VanDerWaalsContact NH2-OE1 3.12Å; R156-E269 IonicContact NH2-OE2 2.75Å; R156-E269 PolarHBondContact NH2-OE2 2.92Å; R242-E269 IonicContact CZ-OE1 3.75Å; R242-E269 IonicContact NH1-OE1 3.74Å; R242-E269 PolarHBondContact NH1-OE1 3.31Å; Y243-E269 PolarHBondContact OH-OE1 3.06Å; Y243-E269 PolarHBondContact OH-OE2 3.3Å; Y265-E269 WeakPolarHBondContact O-CB 3.5Å; Y265-E269 PolarHBondContact O-N 2.97Å; L266-E269 CarbonylContact O-C 3.53Å; L266-E269 PolarHBondContact O-N 3.41Å; L266-E269 VanDerWaalsContact O-N 3.13Å; I267-E269 VanDerWaalsContact C-N 3.32Å; I267-E269 PolarHBondContact O-N 3.06Å; E269-M271 VanDerWaalsContact C-N 3.31Å; E269-M271 PolarHBondContact O-N 3.36Å; E269-G273 WeakPolarHBondContact O-CA 3.49Å; E269-G273 PolarHBondContact O-N 2.82Å; E269-L275 HydrophobicContact CB-CG 4.39Å
270	F	96.1	Very high	96.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-39.9	172.9	-65.7	-13.2	0	0	0	111.2	L152 S163 F164 A169 L172 L266 I267 Y268	L152-F270 HydrophobicContact CB-CE1 4.21Å; L152-F270 HydrophobicContact CB-CZ 4.12Å; L152-F270 HydrophobicContact CD1-CE1 4.28Å; L152-F270 HydrophobicContact CD1-CE2 3.91Å; L152-F270 HydrophobicContact CD1-CZ 3.41Å; L152-F270 VanDerWaalsContact CD1-CZ 3.41Å; L152-F270 HydrophobicContact CG-CZ 4.39Å; S163-F270 CarbonylContact C-O 3.49Å; S163-F270 WeakPolarHBondContact CA-O 3.47Å; S163-F270 WeakPolarHBondContact CB-O 3.48Å; F164-F270 HydrophobicContact CD2-CB 3.89Å; F164-F270 HydrophobicContact CD2-CD1 4.05Å; F164-F270 AromaticContact CD2-CG 3.98Å; F164-F270 HydrophobicContact CD2-CG 3.98Å; F164-F270 AromaticContact CE2-CD1 3.88Å; F164-F270 HydrophobicContact CE2-CD1 3.88Å; F164-F270 HydrophobicContact CE2-CE1 4.33Å; F164-F270 HydrophobicContact CE2-CG 4.21Å; F164-F270 PolarHBondContact N-O 2.66Å; A169-F270 HydrophobicContact CB-CB 4.04Å; L172-F270 HydrophobicContact CB-CE2 4.35Å; L266-F270 HydrophobicContact CB-CE1 4.31Å; L266-F270 HydrophobicContact CB-CE2 4.35Å; L266-F270 HydrophobicContact CB-CZ 3.97Å; L266-F270 WeakPolarHBondContact O-CD1 3.38Å; L266-F270 WeakPolarHBondContact O-CG 3.36Å; L266-F270 PolarHBondContact O-N 2.64Å; I267-F270 WeakPolarHBondContact O-CB 3.49Å; I267-F270 PolarHBondContact O-N 2.8Å; Y268-F270 VanDerWaalsContact C-N 3.34Å
271	M	95	Very high	95.9	Very high	22 Å²	22	34.6 Å²	34.6	11%	0.108	17%	0.171	C	C	.	.	H	α-helix	trans	-82.5	-41.9	-177.7	-60.8	175	74.5	0	0	112.6	S163 A169 I267 Y268 E269 M302 P303 L306 I334	S163-M271 WeakPolarHBondContact CB-O 3.43Å; A169-M271 HydrophobicContact CB-CG 3.88Å; I267-M271 HydrophobicContact CG2-SD 4.3Å; I267-M271 WeakPolarHBondContact O-CG 3.19Å; I267-M271 PolarHBondContact O-N 2.74Å; I267-M271 VanDerWaalsContact O-N 3.16Å; Y268-M271 PolarHBondContact O-N 3.42Å; E269-M271 VanDerWaalsContact C-N 3.31Å; E269-M271 PolarHBondContact O-N 3.36Å; M271-M302 HydrophobicContact CB-CE 3.98Å; M271-M302 HydrophobicContact CE-CE 3.85Å; M271-M302 HydrophobicContact SD-CE 3.87Å; M271-P303 HydrophobicContact CE-CG 3.86Å; M271-L306 HydrophobicContact SD-CD2 4.11Å; M271-I334 HydrophobicContact CE-CD1 4.4Å; M271-I334 HydrophobicContact CE-CG2 3.63Å; M271-I334 HydrophobicContact SD-CD1 4.25Å
272	N	94.5	Very high	95.7	Very high	51 Å²	51	37.7 Å²	37.7	27%	0.273	19%	0.188	S	C	.	.	H	α-helix	trans	-99.3	-16.4	-173.3	-66.6	-76.4	0	0	0	114.3	Y268 F274 M302	Y268-N272 HydrophobicContact CD1-CB 4.35Å; Y268-N272 WeakPolarHBondContact CD2-ND2 3.23Å; Y268-N272 HydrophobicContact CE1-CB 3.91Å; Y268-N272 WeakPolarHBondContact CE2-ND2 3.37Å; Y268-N272 VanDerWaalsContact CZ-ND2 3.33Å; Y268-N272 WeakPolarHBondContact O-CB 3Å; Y268-N272 PolarHBondContact O-N 3.31Å; Y268-N272 PolarHBondContact O-ND2 3.41Å; Y268-N272 VanDerWaalsContact O-ND2 3.1Å; N272-F274 VanDerWaalsContact O-CD1 3.22Å; N272-F274 WeakPolarHBondContact O-CD1 3.44Å; N272-F274 PolarHBondContact O-N 2.92Å; N272-M302 WeakPolarHBondContact ND2-CE 3.1Å; N272-M302 PolarHBondContact ND2-SD 3.27Å
273	G	93.8	Very high	95.5	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.031	19%	0.194	C	C	.	.	S	Bend	trans	81.9	-17.2	-179.6	0	0	0	0	0	116	R156 R162 E269	R156-G273 PolarHBondContact NH1-O 2.83Å; R162-G273 WeakPolarHBondContact O-CA 3.43Å; E269-G273 WeakPolarHBondContact O-CA 3.49Å; E269-G273 PolarHBondContact O-N 2.82Å
274	F	94.6	Very high	95.4	Very high	107 Å²	107	43.5 Å²	43.5	47%	0.469	22%	0.222	S	C	.	.	S	Bend	trans	-143.6	161.8	177.6	63.9	-85.4	0	0	0	111.7	Y268 N272 E278	Y268-F274 VanDerWaalsContact CE1-O 3.22Å; Y268-F274 WeakPolarHBondContact CE1-O 3.29Å; N272-F274 VanDerWaalsContact O-CD1 3.22Å; N272-F274 WeakPolarHBondContact O-CD1 3.44Å; N272-F274 PolarHBondContact O-N 2.92Å; F274-E278 HydrophobicContact CB-CB 4.49Å; F274-E278 WeakPolarHBondContact CB-OE2 3.46Å
275	L	95.9	Very high	95.3	Very high	1 Å²	1	46 Å²	46	1%	0.005	24%	0.237	C	C	.	.			trans	-104.1	150.3	165.4	-73.5	160.6	0	0	0	108.8	R242 Y243 Y265 Y268 E269 W277 E278	R242-L275 HydrophobicContact CG-CD1 3.67Å; Y243-L275 HydrophobicContact CD1-CD1 4.08Å; Y243-L275 HydrophobicContact CE1-CD1 3.87Å; Y265-L275 HydrophobicContact CD1-CD2 3.94Å; Y265-L275 HydrophobicContact CG-CD2 4.31Å; Y268-L275 HydrophobicContact CD1-CD2 3.6Å; Y268-L275 HydrophobicContact CD1-CG 4.46Å; Y268-L275 HydrophobicContact CE1-CD2 4.27Å; Y268-L275 HydrophobicContact CG-CD2 4.34Å; E269-L275 HydrophobicContact CB-CG 4.39Å; L275-W277 HydrophobicContact CB-CD2 4.45Å; L275-W277 HydrophobicContact CB-CZ2 4.35Å; L275-W277 HydrophobicContact CD1-CZ2 4.34Å; L275-W277 HydrophobicContact CD2-CZ2 3.94Å; L275-W277 HydrophobicContact CG-CZ2 4.45Å; L275-W277 PolarHBondContact O-N 3.14Å; L275-E278 VanDerWaalsContact O-CB 3.25Å; L275-E278 WeakPolarHBondContact O-CB 3.42Å; L275-E278 PolarHBondContact O-N 3.17Å
276	P	95.9	Very high	95.3	Very high	48 Å²	48	46 Å²	46	31%	0.312	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.2	-178.3	-29.3	38.2	0	0	0	114.9	M289 L293 L298	P276-M289 HydrophobicContact CB-CE 4.31Å; P276-M289 WeakPolarHBondContact O-CE 3.32Å; P276-L293 HydrophobicContact CB-CD1 4.35Å; P276-L293 HydrophobicContact CG-CD1 4.4Å; P276-L298 HydrophobicContact CG-CD2 3.45Å; P276-L298 VanDerWaalsContact CG-CD2 3.45Å
277	W	96.4	Very high	95.3	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.008	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	18.8	176.5	53.1	77.3	0	0	0	114	R242 Y265 L275 M279 F280 V286 M289 K290 L293 L298	R242-W277 PolarHBondContact O-NE1 3.29Å; Y265-W277 AromaticContact CD1-CH2 3.9Å; Y265-W277 HydrophobicContact CD1-CH2 3.9Å; Y265-W277 AromaticContact CD1-CZ2 3.67Å; Y265-W277 HydrophobicContact CD1-CZ2 3.67Å; Y265-W277 HydrophobicContact CD2-CZ2 4.37Å; Y265-W277 AromaticContact CE1-CH2 3.31Å; Y265-W277 HydrophobicContact CE1-CH2 3.31Å; Y265-W277 AromaticContact CE1-CZ2 3.44Å; Y265-W277 HydrophobicContact CE1-CZ2 3.44Å; Y265-W277 VanDerWaalsContact CE1-CZ2 3.44Å; Y265-W277 HydrophobicContact CE2-CZ2 4.11Å; Y265-W277 HydrophobicContact CG-CZ2 4.15Å; Y265-W277 AromaticContact CZ-CH2 3.66Å; Y265-W277 AromaticContact CZ-CZ2 3.64Å; L275-W277 HydrophobicContact CB-CD2 4.45Å; L275-W277 HydrophobicContact CB-CZ2 4.35Å; L275-W277 HydrophobicContact CD1-CZ2 4.34Å; L275-W277 HydrophobicContact CD2-CZ2 3.94Å; L275-W277 HydrophobicContact CG-CZ2 4.45Å; L275-W277 PolarHBondContact O-N 3.14Å; W277-M279 PolarHBondContact O-N 3.31Å; W277-F280 HydrophobicContact CB-CD2 4.16Å; W277-F280 PolarHBondContact O-N 2.75Å; W277-F280 VanDerWaalsContact O-N 3.07Å; W277-V286 HydrophobicContact CB-CG1 4.35Å; W277-V286 HydrophobicContact CB-CG2 4.2Å; W277-V286 HydrophobicContact CD2-CG1 4.39Å; W277-V286 HydrophobicContact CG-CG1 3.9Å; W277-M289 HydrophobicContact CB-CE 4.05Å; W277-M289 HydrophobicContact CB-SD 3.8Å; W277-M289 HydrophobicContact CE3-CB 4.2Å; W277-K290 HydrophobicContact CD2-CG 4.19Å; W277-K290 HydrophobicContact CE3-CG 3.99Å; W277-K290 HydrophobicContact CH2-CD 4.42Å; W277-K290 HydrophobicContact CH2-CG 3.61Å; W277-K290 HydrophobicContact CZ2-CD 4.19Å; W277-K290 HydrophobicContact CZ2-CG 3.84Å; W277-K290 HydrophobicContact CZ3-CG 3.7Å; W277-L293 HydrophobicContact CZ3-CD1 4.07Å; W277-L298 HydrophobicContact CH2-CD1 3.84Å; W277-L298 HydrophobicContact CZ3-CD1 4.45Å; W277-L298 HydrophobicContact CZ3-CD2 4.47Å
278	E	92.2	Very high	95.2	Very high	48 Å²	48	52.1 Å²	52.1	22%	0.224	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-38.8	-176.7	161.3	147.1	-115	0	0	113.3	R242 F274 L275 F280	R242-E278 IonicContact CZ-OE1 3.59Å; R242-E278 IonicContact NH1-OE1 3.11Å; R242-E278 PolarHBondContact NH1-OE1 3.44Å; R242-E278 PolarHBondContact NH2-O 3.48Å; R242-E278 IonicContact NH2-OE1 2.76Å; R242-E278 PolarHBondContact NH2-OE1 3.12Å; R242-E278 VanDerWaalsContact NH2-OE1 3.09Å; F274-E278 HydrophobicContact CB-CB 4.49Å; F274-E278 WeakPolarHBondContact CB-OE2 3.46Å; L275-E278 VanDerWaalsContact O-CB 3.25Å; L275-E278 WeakPolarHBondContact O-CB 3.42Å; L275-E278 PolarHBondContact O-N 3.17Å; E278-F280 VanDerWaalsContact C-N 3.3Å; E278-F280 PolarHBondContact O-N 2.69Å
279	M	91.9	Very high	95.2	Very high	167 Å²	167	52.2 Å²	52.2	82%	0.823	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-1.1	-176.6	-60	-58.1	-68.8	0	0	114	W277	W277-M279 PolarHBondContact O-N 3.31Å
280	F	94.3	Very high	95.3	Very high	88 Å²	88	52.2 Å²	52.2	39%	0.386	28%	0.276	S	S	.	.			trans	-107.1	126	-178.2	-56.8	-90.8	0	0	0	110.4	W277 E278 T285 V286 M289	W277-F280 HydrophobicContact CB-CD2 4.16Å; W277-F280 PolarHBondContact O-N 2.75Å; W277-F280 VanDerWaalsContact O-N 3.07Å; E278-F280 VanDerWaalsContact C-N 3.3Å; E278-F280 PolarHBondContact O-N 2.69Å; F280-T285 HydrophobicContact CB-CG2 4.47Å; F280-T285 HydrophobicContact CD1-CG2 3.53Å; F280-T285 HydrophobicContact CE1-CG2 3.92Å; F280-T285 HydrophobicContact CG-CG2 4.06Å; F280-V286 HydrophobicContact CB-CG2 3.74Å; F280-M289 HydrophobicContact CD2-SD 3.88Å; F280-M289 HydrophobicContact CE2-CE 4.11Å; F280-M289 HydrophobicContact CE2-SD 3.82Å; F280-M289 HydrophobicContact CG-SD 4.41Å; F280-M289 HydrophobicContact CZ-SD 4.34Å
281	I	90.1	Very high	95.3	Very high	152 Å²	152	55 Å²	55	78%	0.779	30%	0.295	S	S	*	.			trans	-107.4	-13.2	179.8	62.1	170.5	0	0	0	113	I241	I241-I281 WeakPolarHBondContact CD1-O 3.44Å
282	D	93.8	Very high	95.3	Very high	68 Å²	68	63.1 Å²	63.1	36%	0.364	32%	0.324	S	S	.	.			trans	-83.8	137.1	179.3	72.2	-76.5	0	0	0	111.1	T285 V286	D282-T285 VanDerWaalsContact CG-OG1 3.3Å; D282-T285 WeakPolarHBondContact OD1-CB 3.32Å; D282-T285 PolarHBondContact OD1-OG1 3.16Å; D282-T285 WeakPolarHBondContact OD2-CB 3.48Å; D282-T285 PolarHBondContact OD2-N 3.33Å; D282-T285 PolarHBondContact OD2-OG1 3.22Å; D282-V286 VanDerWaalsContact O-CG2 3.3Å; D282-V286 WeakPolarHBondContact O-CG2 3.38Å; D282-V286 PolarHBondContact O-N 3.36Å
283	E	94.4	Very high	95.3	Very high	39 Å²	39	63 Å²	63	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-46.2	-175.9	-169.1	-169.7	160.5	0	0	113.5	I241 H249 R251 T285 V286 Q287	I241-E283 HydrophobicContact CD1-CB 4.11Å; I241-E283 HydrophobicContact CG1-CB 4.47Å; H249-E283 WeakPolarHBondContact ND1-CG 3.42Å; H249-E283 IonicContact ND1-OE1 3.56Å; R251-E283 IonicContact CZ-OE1 2.64Å; R251-E283 IonicContact CZ-OE2 2.85Å; R251-E283 IonicContact NH1-OE1 2.64Å; R251-E283 PolarHBondContact NH1-OE1 3.13Å; R251-E283 IonicContact NH1-OE2 3.54Å; R251-E283 IonicContact NH2-OE1 2.63Å; R251-E283 PolarHBondContact NH2-OE1 3.49Å; R251-E283 IonicContact NH2-OE2 3.67Å; R251-E283 PolarHBondContact NH2-OE2 2.96Å; E283-T285 PolarHBondContact O-N 2.76Å; E283-V286 PolarHBondContact O-N 2.99Å; E283-Q287 WeakPolarHBondContact O-CB 3.32Å; E283-Q287 PolarHBondContact O-N 2.81Å
284	P	96.4	Very high	95.3	Very high	91 Å²	91	65 Å²	65	59%	0.591	33%	0.333	S	S	*	.	H	α-helix	trans	-62.7	-40.8	-175.6	-24	36.3	0	0	0	113.6	Q287 S288	P284-Q287 PolarHBondContact O-N 3.47Å; P284-S288 WeakPolarHBondContact O-CB 3.42Å; P284-S288 PolarHBondContact O-N 3.23Å
285	T	97.5	Very high	95.4	Very high	52 Å²	52	60 Å²	60	32%	0.319	31%	0.311	S	S	.	.	H	α-helix	trans	-65.8	-47	178	-59	0	0	0	0	110.8	F280 D282 E283 Q287 S288 M289	F280-T285 HydrophobicContact CB-CG2 4.47Å; F280-T285 HydrophobicContact CD1-CG2 3.53Å; F280-T285 HydrophobicContact CE1-CG2 3.92Å; F280-T285 HydrophobicContact CG-CG2 4.06Å; D282-T285 VanDerWaalsContact CG-OG1 3.3Å; D282-T285 WeakPolarHBondContact OD1-CB 3.32Å; D282-T285 PolarHBondContact OD1-OG1 3.16Å; D282-T285 WeakPolarHBondContact OD2-CB 3.48Å; D282-T285 PolarHBondContact OD2-N 3.33Å; D282-T285 PolarHBondContact OD2-OG1 3.22Å; E283-T285 PolarHBondContact O-N 2.76Å; T285-Q287 VanDerWaalsContact C-N 3.34Å; T285-Q287 PolarHBondContact O-N 2.99Å; T285-S288 PolarHBondContact O-N 3.27Å; T285-M289 HydrophobicContact CG2-SD 4.26Å; T285-M289 WeakPolarHBondContact O-CG 3.38Å; T285-M289 PolarHBondContact O-N 3.08Å
286	V	97.8	Very high	95.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.6	-40.5	179	177.4	0	0	0	0	111.2	I241 W277 F280 D282 E283 M289 K290	I241-V286 HydrophobicContact CG2-CB 3.74Å; I241-V286 HydrophobicContact CG2-CG1 3.86Å; I241-V286 HydrophobicContact CG2-CG2 3.73Å; W277-V286 HydrophobicContact CB-CG1 4.35Å; W277-V286 HydrophobicContact CB-CG2 4.2Å; W277-V286 HydrophobicContact CD2-CG1 4.39Å; W277-V286 HydrophobicContact CG-CG1 3.9Å; F280-V286 HydrophobicContact CB-CG2 3.74Å; D282-V286 VanDerWaalsContact O-CG2 3.3Å; D282-V286 WeakPolarHBondContact O-CG2 3.38Å; D282-V286 PolarHBondContact O-N 3.36Å; E283-V286 PolarHBondContact O-N 2.99Å; V286-M289 PolarHBondContact O-N 3.29Å; V286-K290 HydrophobicContact CG1-CD 3.94Å; V286-K290 HydrophobicContact CG1-CG 4.39Å; V286-K290 WeakPolarHBondContact O-CB 3.26Å; V286-K290 VanDerWaalsContact O-CG 3.28Å; V286-K290 WeakPolarHBondContact O-CG 3.31Å; V286-K290 PolarHBondContact O-N 2.91Å
287	Q	97.6	Very high	95.2	Very high	58 Å²	58	64.5 Å²	64.5	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-46.5	174.2	175	176.3	2.9	0	0	111.8	H249 E283 P284 T285 K290 S291	H249-Q287 HydrophobicContact CB-CB 3.96Å; H249-Q287 HydrophobicContact CB-CG 3.63Å; E283-Q287 WeakPolarHBondContact O-CB 3.32Å; E283-Q287 PolarHBondContact O-N 2.81Å; P284-Q287 PolarHBondContact O-N 3.47Å; T285-Q287 VanDerWaalsContact C-N 3.34Å; T285-Q287 PolarHBondContact O-N 2.99Å; Q287-K290 PolarHBondContact O-N 3.31Å; Q287-S291 WeakPolarHBondContact O-CB 3.33Å; Q287-S291 PolarHBondContact O-N 3.14Å; Q287-S291 PolarHBondContact O-OG 2.94Å
288	S	97.7	Very high	95.1	Very high	73 Å²	73	64.7 Å²	64.7	51%	0.51	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-46.8	178.6	-178.8	0	0	0	0	111.5	P284 T285 K290 S291 R292	P284-S288 WeakPolarHBondContact O-CB 3.42Å; P284-S288 PolarHBondContact O-N 3.23Å; T285-S288 PolarHBondContact O-N 3.27Å; S288-K290 PolarHBondContact O-N 3.49Å; S288-S291 PolarHBondContact O-N 3.25Å; S288-R292 WeakPolarHBondContact O-CB 3.4Å; S288-R292 PolarHBondContact O-N 3.18Å
289	M	97.7	Very high	95.3	Very high	27 Å²	27	62.9 Å²	62.9	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-46.5	176.7	-68.2	-179.8	74.3	0	0	112.1	P276 W277 F280 T285 V286 R292 L293	P276-M289 HydrophobicContact CB-CE 4.31Å; P276-M289 WeakPolarHBondContact O-CE 3.32Å; W277-M289 HydrophobicContact CB-CE 4.05Å; W277-M289 HydrophobicContact CB-SD 3.8Å; W277-M289 HydrophobicContact CE3-CB 4.2Å; F280-M289 HydrophobicContact CD2-SD 3.88Å; F280-M289 HydrophobicContact CE2-CE 4.11Å; F280-M289 HydrophobicContact CE2-SD 3.82Å; F280-M289 HydrophobicContact CG-SD 4.41Å; F280-M289 HydrophobicContact CZ-SD 4.34Å; T285-M289 HydrophobicContact CG2-SD 4.26Å; T285-M289 WeakPolarHBondContact O-CG 3.38Å; T285-M289 PolarHBondContact O-N 3.08Å; V286-M289 PolarHBondContact O-N 3.29Å; M289-R292 PolarHBondContact O-N 2.97Å; M289-L293 WeakPolarHBondContact O-CB 3.48Å; M289-L293 PolarHBondContact O-N 3.01Å
290	K	97.9	Very high	95.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-40.6	178.5	-74.9	176.6	173.2	-175	0	112.7	I241 R242 A244 I246 Y265 W277 V286 Q287 S288 R292 L294	I241-K290 PolarHBondContact O-NZ 3.13Å; R242-K290 WeakPolarHBondContact O-CE 3.23Å; R242-K290 PolarHBondContact O-NZ 3.19Å; A244-K290 PolarHBondContact O-NZ 3.28Å; I246-K290 HydrophobicContact CG2-CB 3.96Å; Y265-K290 HydrophobicContact CE2-CD 4.21Å; Y265-K290 WeakPolarHBondContact OH-CG 3.06Å; W277-K290 HydrophobicContact CD2-CG 4.19Å; W277-K290 HydrophobicContact CE3-CG 3.99Å; W277-K290 HydrophobicContact CH2-CD 4.42Å; W277-K290 HydrophobicContact CH2-CG 3.61Å; W277-K290 HydrophobicContact CZ2-CD 4.19Å; W277-K290 HydrophobicContact CZ2-CG 3.84Å; W277-K290 HydrophobicContact CZ3-CG 3.7Å; V286-K290 HydrophobicContact CG1-CD 3.94Å; V286-K290 HydrophobicContact CG1-CG 4.39Å; V286-K290 WeakPolarHBondContact O-CB 3.26Å; V286-K290 VanDerWaalsContact O-CG 3.28Å; V286-K290 WeakPolarHBondContact O-CG 3.31Å; V286-K290 PolarHBondContact O-N 2.91Å; Q287-K290 PolarHBondContact O-N 3.31Å; S288-K290 PolarHBondContact O-N 3.49Å; K290-R292 VanDerWaalsContact C-N 3.31Å; K290-R292 PolarHBondContact O-N 3.23Å; K290-L294 VanDerWaalsContact O-CA 3.29Å; K290-L294 WeakPolarHBondContact O-CA 3.16Å; K290-L294 PolarHBondContact O-N 3.34Å
291	S	96.3	Very high	94.9	Very high	58 Å²	58	63.3 Å²	63.3	41%	0.406	34%	0.34	S	S	.	.	H	α-helix	trans	-69.1	-32.1	-179.9	-54.4	0	0	0	0	111.8	Q287 S288	Q287-S291 WeakPolarHBondContact O-CB 3.33Å; Q287-S291 PolarHBondContact O-N 3.14Å; Q287-S291 PolarHBondContact O-OG 2.94Å; S288-S291 PolarHBondContact O-N 3.25Å
292	R	95.5	Very high	95	Very high	193 Å²	193	57.4 Å²	57.4	73%	0.728	31%	0.31	S	S	*	.	H	α-helix	trans	-76	-44.9	176.6	-175.8	175.7	65.6	-171.2	-0.1	112.9	S288 M289 K290	S288-R292 WeakPolarHBondContact O-CB 3.4Å; S288-R292 PolarHBondContact O-N 3.18Å; M289-R292 PolarHBondContact O-N 2.97Å; K290-R292 VanDerWaalsContact C-N 3.31Å; K290-R292 PolarHBondContact O-N 3.23Å
293	L	93.1	Very high	95	Very high	48 Å²	48	56.3 Å²	56.3	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-77.9	-39.1	-178.2	-71.7	169.2	0	0	0	112	P276 W277 M289 G297 L298	P276-L293 HydrophobicContact CB-CD1 4.35Å; P276-L293 HydrophobicContact CG-CD1 4.4Å; W277-L293 HydrophobicContact CZ3-CD1 4.07Å; M289-L293 WeakPolarHBondContact O-CB 3.48Å; M289-L293 PolarHBondContact O-N 3.01Å; L293-G297 WeakPolarHBondContact O-CA 3.37Å; L293-G297 PolarHBondContact O-N 2.9Å; L293-L298 HydrophobicContact CD1-CD2 4.24Å
294	L	94.5	Very high	95	Very high	46 Å²	46	58.3 Å²	58.3	24%	0.241	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	-169.1	-160.4	-56.5	173.4	0	0	0	110.8	I246 K290 K296 E314	I246-L294 HydrophobicContact CD1-CD2 3.92Å; K290-L294 VanDerWaalsContact O-CA 3.29Å; K290-L294 WeakPolarHBondContact O-CA 3.16Å; K290-L294 PolarHBondContact O-N 3.34Å; L294-K296 HydrophobicContact CB-CG 4.4Å; L294-E314 VanDerWaalsContact CB-OE1 3.24Å; L294-E314 WeakPolarHBondContact CB-OE1 3.39Å
295	L	96.6	Very high	94.9	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-43	174.5	-54	-170.7	0	0	0	110.6	W261 F264 Y265 G297 L298 C299 A310 V313 E314	W261-L295 HydrophobicContact CD2-CD1 4.01Å; W261-L295 HydrophobicContact CD2-CD2 4.16Å; W261-L295 HydrophobicContact CD2-CG 4.22Å; W261-L295 VanDerWaalsContact CE2-CD2 3.46Å; W261-L295 HydrophobicContact CE3-CD1 4.29Å; W261-L295 HydrophobicContact CG-CD1 4.34Å; W261-L295 HydrophobicContact CG-CD2 4.33Å; W261-L295 HydrophobicContact CH2-CG 4.2Å; W261-L295 HydrophobicContact CZ2-CD1 4.37Å; W261-L295 HydrophobicContact CZ2-CD2 3.77Å; W261-L295 HydrophobicContact CZ2-CG 3.73Å; W261-L295 VanDerWaalsContact NE1-CD2 3.25Å; F264-L295 HydrophobicContact CB-CD1 4.15Å; F264-L295 HydrophobicContact CD1-CB 4.06Å; F264-L295 HydrophobicContact CD1-CD1 4.01Å; F264-L295 HydrophobicContact CD1-CD2 3.44Å; F264-L295 VanDerWaalsContact CD1-CD2 3.44Å; F264-L295 HydrophobicContact CD1-CG 4.03Å; F264-L295 HydrophobicContact CD2-CD1 4.46Å; F264-L295 HydrophobicContact CE1-CB 3.79Å; F264-L295 HydrophobicContact CE1-CD2 3.79Å; F264-L295 HydrophobicContact CE1-CG 4.25Å; F264-L295 HydrophobicContact CG-CD1 3.93Å; F264-L295 HydrophobicContact CG-CD2 4.2Å; F264-L295 HydrophobicContact CG-CG 4.44Å; F264-L295 HydrophobicContact CZ-CB 4.03Å; Y265-L295 HydrophobicContact CD1-CD2 4.22Å; Y265-L295 HydrophobicContact CE1-CD2 3.44Å; Y265-L295 VanDerWaalsContact CE1-CD2 3.44Å; L295-G297 PolarHBondContact O-N 3.45Å; L295-L298 WeakPolarHBondContact O-CB 2.91Å; L295-L298 PolarHBondContact O-N 2.87Å; L295-C299 PolarHBondContact O-N 3.48Å; L295-A310 HydrophobicContact CB-CB 3.78Å; L295-V313 HydrophobicContact CD1-CB 4.03Å; L295-V313 HydrophobicContact CD1-CG1 3.81Å; L295-E314 VanDerWaalsContact CA-OE1 3.25Å; L295-E314 WeakPolarHBondContact CA-OE1 3.15Å; L295-E314 HydrophobicContact CB-CG 4Å; L295-E314 VanDerWaalsContact CB-OE1 3.22Å; L295-E314 WeakPolarHBondContact CB-OE1 3.4Å; L295-E314 HydrophobicContact CD1-CG 4.1Å; L295-E314 HydrophobicContact CG-CG 3.95Å; L295-E314 PolarHBondContact N-OE1 2.81Å
296	K	92.5	Very high	94.9	Very high	117 Å²	117	51.5 Å²	51.5	51%	0.509	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-57.2	-33.6	-179.4	70.1	-175.8	-177.7	-176	0	113.7	L294 L298 C299 E314	L294-K296 HydrophobicContact CB-CG 4.4Å; K296-L298 PolarHBondContact O-N 3.21Å; K296-C299 WeakPolarHBondContact O-CB 3.29Å; K296-C299 PolarHBondContact O-N 3.05Å; K296-E314 PolarHBondContact N-OE1 2.94Å
297	G	94	Very high	94.9	Very high	27 Å²	27	53.4 Å²	53.4	28%	0.278	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-69.8	-20.5	177.5	0	0	0	0	0	113.4	L293 L295	L293-G297 WeakPolarHBondContact O-CA 3.37Å; L293-G297 PolarHBondContact O-N 2.9Å; L295-G297 PolarHBondContact O-N 3.45Å
298	L	95.5	Very high	94.9	Very high	7 Å²	7	52 Å²	52	4%	0.037	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-80.2	-19.2	170.7	-64.2	176.1	0	0	0	112.2	F264 Y265 Y268 P276 W277 L293 L295 K296 V300 M302	F264-L298 HydrophobicContact CE1-CB 4.2Å; F264-L298 HydrophobicContact CE1-CD1 3.79Å; F264-L298 HydrophobicContact CZ-CB 4.33Å; Y265-L298 HydrophobicContact CD1-CD1 3.83Å; Y265-L298 HydrophobicContact CE1-CD1 3.64Å; Y268-L298 HydrophobicContact CD2-CB 3.94Å; Y268-L298 HydrophobicContact CE2-CB 3.8Å; Y268-L298 HydrophobicContact CE2-CD2 4.43Å; Y268-L298 WeakPolarHBondContact CE2-O 3.48Å; P276-L298 HydrophobicContact CG-CD2 3.45Å; P276-L298 VanDerWaalsContact CG-CD2 3.45Å; W277-L298 HydrophobicContact CH2-CD1 3.84Å; W277-L298 HydrophobicContact CZ3-CD1 4.45Å; W277-L298 HydrophobicContact CZ3-CD2 4.47Å; L293-L298 HydrophobicContact CD1-CD2 4.24Å; L295-L298 WeakPolarHBondContact O-CB 2.91Å; L295-L298 PolarHBondContact O-N 2.87Å; K296-L298 PolarHBondContact O-N 3.21Å; L298-V300 VanDerWaalsContact C-N 3.26Å; L298-V300 PolarHBondContact O-N 2.93Å; L298-M302 VanDerWaalsContact O-CG 3.28Å; L298-M302 WeakPolarHBondContact O-CG 3.46Å
299	C	95.2	Very high	94.9	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.068	26%	0.264	C	S	.	.			trans	-83.4	2.2	-176.8	-63.2	0	0	0	0	114.1	F264 L295 K296 N301 M302 D307	F264-C299 VanDerWaalsContact CZ-SG 3.57Å; L295-C299 PolarHBondContact O-N 3.48Å; K296-C299 WeakPolarHBondContact O-CB 3.29Å; K296-C299 PolarHBondContact O-N 3.05Å; C299-N301 PolarHBondContact O-N 3.05Å; C299-M302 PolarHBondContact O-N 2.95Å; C299-D307 HydrophobicContact CB-CB 3.88Å
300	V	91	Very high	94.9	Very high	100 Å²	100	47.3 Å²	47.3	61%	0.606	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	121.3	175	-178.2	0	0	0	0	109	L298 M302	L298-V300 VanDerWaalsContact C-N 3.26Å; L298-V300 PolarHBondContact O-N 2.93Å; V300-M302 PolarHBondContact O-N 2.79Å
301	N	87.8	Confident	94.9	Very high	163 Å²	163	52.7 Å²	52.7	87%	0.872	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	12.8	-174	-49.9	-41.7	0	0	0	115.4	C299	C299-N301 PolarHBondContact O-N 3.05Å
302	M	92.7	Very high	95	Very high	29 Å²	29	51.6 Å²	51.6	14%	0.143	27%	0.274	C	S	.	.	S	Bend	trans	-88.3	156.8	171	-63.4	-59.4	-65	0	0	110.7	Y268 M271 N272 L298 C299 V300 L306	Y268-M302 HydrophobicContact CD2-CE 4.36Å; Y268-M302 HydrophobicContact CD2-CG 4.48Å; Y268-M302 HydrophobicContact CD2-SD 4.5Å; Y268-M302 HydrophobicContact CE2-CE 4.49Å; Y268-M302 HydrophobicContact CE2-CG 4.15Å; Y268-M302 HydrophobicContact CE2-SD 4.08Å; M271-M302 HydrophobicContact CB-CE 3.98Å; M271-M302 HydrophobicContact CE-CE 3.85Å; M271-M302 HydrophobicContact SD-CE 3.87Å; N272-M302 WeakPolarHBondContact ND2-CE 3.1Å; N272-M302 PolarHBondContact ND2-SD 3.27Å; L298-M302 VanDerWaalsContact O-CG 3.28Å; L298-M302 WeakPolarHBondContact O-CG 3.46Å; C299-M302 PolarHBondContact O-N 2.95Å; V300-M302 PolarHBondContact O-N 2.79Å; M302-L306 HydrophobicContact CB-CB 4.48Å; M302-L306 HydrophobicContact CB-CD2 4.04Å; M302-L306 HydrophobicContact CE-CD2 3.47Å; M302-L306 VanDerWaalsContact CE-CD2 3.47Å; M302-L306 HydrophobicContact CG-CD2 4.09Å
303	P	93.3	Very high	95.1	Very high	45 Å²	45	42.4 Å²	42.4	29%	0.292	24%	0.239	S	C	.	.			trans	-54.5	141.6	174.2	-29.8	39.9	0	0	0	112.3	M271 G305 L306 D307 I334	M271-P303 HydrophobicContact CE-CG 3.86Å; P303-G305 PolarHBondContact O-N 2.88Å; P303-G305 VanDerWaalsContact O-N 3.08Å; P303-L306 WeakPolarHBondContact O-CB 3.08Å; P303-L306 PolarHBondContact O-N 3.11Å; P303-D307 PolarHBondContact O-N 3.3Å; P303-I334 HydrophobicContact CB-CB 4.3Å; P303-I334 HydrophobicContact CB-CG1 4.05Å; P303-I334 HydrophobicContact CB-CG2 3.92Å; P303-I334 HydrophobicContact CG-CG2 3.93Å
304	S	94	Very high	95.3	Very high	81 Å²	81	42.1 Å²	42.1	57%	0.566	24%	0.236	S	C	*	.	H	α-helix	trans	-57.5	-28.1	-174.4	55.1	0	0	0	0	114	L306 D307 S308	S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 3.04Å; S304-D307 PolarHBondContact O-N 3.02Å; S304-S308 WeakPolarHBondContact O-CB 3.4Å; S304-S308 PolarHBondContact O-N 3.48Å; S304-S308 PolarHBondContact O-OG 3.34Å
305	G	95.5	Very high	95.4	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-43.1	171.8	0	0	0	0	0	112.8	P303 S308 F309 Y330	P303-G305 PolarHBondContact O-N 2.88Å; P303-G305 VanDerWaalsContact O-N 3.08Å; G305-S308 PolarHBondContact O-N 3.23Å; G305-F309 PolarHBondContact O-N 3.36Å; G305-Y330 CarbonylContact C-O 3.6Å; G305-Y330 WeakPolarHBondContact CA-O 3.36Å; G305-Y330 WeakPolarHBondContact O-CB 3.42Å
306	L	96.7	Very high	95.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.8	-37.8	178.4	-171.1	61.9	0	0	0	112	F264 I267 Y268 M271 M302 P303 S304 F309 A310 I331 I334	F264-L306 HydrophobicContact CD2-CD1 3.87Å; F264-L306 HydrophobicContact CE2-CD1 3.55Å; F264-L306 HydrophobicContact CE2-CD2 4.44Å; F264-L306 HydrophobicContact CE2-CG 3.72Å; F264-L306 HydrophobicContact CZ-CD1 4.44Å; F264-L306 HydrophobicContact CZ-CG 4.33Å; I267-L306 HydrophobicContact CB-CD1 4.43Å; I267-L306 HydrophobicContact CG2-CD1 3.83Å; Y268-L306 HydrophobicContact CD2-CD2 4.26Å; M271-L306 HydrophobicContact SD-CD2 4.11Å; M302-L306 HydrophobicContact CB-CB 4.48Å; M302-L306 HydrophobicContact CB-CD2 4.04Å; M302-L306 HydrophobicContact CE-CD2 3.47Å; M302-L306 VanDerWaalsContact CE-CD2 3.47Å; M302-L306 HydrophobicContact CG-CD2 4.09Å; P303-L306 WeakPolarHBondContact O-CB 3.08Å; P303-L306 PolarHBondContact O-N 3.11Å; S304-L306 VanDerWaalsContact C-N 3.34Å; S304-L306 PolarHBondContact O-N 3.04Å; L306-F309 PolarHBondContact O-N 2.98Å; L306-A310 WeakPolarHBondContact O-CB 3.24Å; L306-A310 PolarHBondContact O-N 2.85Å; L306-I331 HydrophobicContact CD1-CD1 4.47Å; L306-I334 HydrophobicContact CB-CD1 4.02Å
307	D	96.9	Very high	95.7	Very high	39 Å²	39	43.7 Å²	43.7	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-42.6	173.4	177.1	58.4	0	0	0	112.1	C299 P303 S304 A310 K311	C299-D307 HydrophobicContact CB-CB 3.88Å; P303-D307 PolarHBondContact O-N 3.3Å; S304-D307 PolarHBondContact O-N 3.02Å; D307-A310 WeakPolarHBondContact O-CB 3.3Å; D307-A310 PolarHBondContact O-N 3.02Å; D307-K311 WeakPolarHBondContact O-CG 3.41Å; D307-K311 PolarHBondContact O-N 3.33Å; D307-K311 WeakPolarHBondContact OD1-CE 2.9Å; D307-K311 IonicContact OD1-NZ 3.74Å; D307-K311 WeakPolarHBondContact OD2-CE 2.93Å; D307-K311 IonicContact OD2-NZ 2.63Å; D307-K311 PolarHBondContact OD2-NZ 2.8Å
308	S	97.7	Very high	95.9	Very high	30 Å²	30	43.8 Å²	43.8	21%	0.21	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-42.1	177.1	-57.9	0	0	0	0	111.7	S304 G305 K311 C312 Y330	S304-S308 WeakPolarHBondContact O-CB 3.4Å; S304-S308 PolarHBondContact O-N 3.48Å; S304-S308 PolarHBondContact O-OG 3.34Å; G305-S308 PolarHBondContact O-N 3.23Å; S308-K311 PolarHBondContact O-N 3.24Å; S308-C312 PolarHBondContact O-N 2.83Å; S308-C312 VanDerWaalsContact O-N 3.13Å; S308-Y330 VanDerWaalsContact CB-CD1 3.45Å
309	F	98.1	Very high	95.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.5	-47.9	171.9	-172.6	-71.5	0	0	0	111.6	I177 L260 F264 I267 G305 L306 K311 C312 V313 L327 I331	I177-F309 HydrophobicContact CD1-CE2 3.83Å; I177-F309 HydrophobicContact CG1-CE2 4.27Å; L260-F309 HydrophobicContact CD2-CZ 4.5Å; F264-F309 HydrophobicContact CB-CD1 4.29Å; F264-F309 HydrophobicContact CB-CE1 3.91Å; F264-F309 AromaticContact CD2-CD1 3.77Å; F264-F309 HydrophobicContact CD2-CD1 3.77Å; F264-F309 HydrophobicContact CD2-CE1 4.25Å; I267-F309 HydrophobicContact CD1-CE2 4.28Å; I267-F309 HydrophobicContact CD1-CZ 4.23Å; G305-F309 PolarHBondContact O-N 3.36Å; L306-F309 PolarHBondContact O-N 2.98Å; F309-K311 PolarHBondContact O-N 2.92Å; F309-C312 PolarHBondContact O-N 2.87Å; F309-V313 HydrophobicContact CD1-CG2 3.82Å; F309-V313 HydrophobicContact CE1-CG2 3.49Å; F309-V313 VanDerWaalsContact CE1-CG2 3.49Å; F309-V313 HydrophobicContact CZ-CG2 4.22Å; F309-V313 PolarHBondContact O-N 3.23Å; F309-L327 HydrophobicContact CD2-CB 3.93Å; F309-L327 HydrophobicContact CD2-CD2 3.68Å; F309-L327 HydrophobicContact CD2-CG 4.31Å; F309-L327 HydrophobicContact CE2-CB 3.77Å; F309-L327 HydrophobicContact CE2-CD1 4.19Å; F309-L327 HydrophobicContact CE2-CD2 3.88Å; F309-L327 HydrophobicContact CE2-CG 4.15Å; F309-L327 HydrophobicContact CG-CD2 4.04Å; F309-L327 HydrophobicContact CZ-CD1 4.43Å; F309-L327 HydrophobicContact CZ-CD2 4.4Å; F309-I331 HydrophobicContact CB-CD1 4.46Å; F309-I331 HydrophobicContact CD2-CD1 3.87Å; F309-I331 HydrophobicContact CD2-CG1 3.86Å; F309-I331 HydrophobicContact CE2-CD1 4.46Å; F309-I331 HydrophobicContact CE2-CG1 4.25Å; F309-I331 HydrophobicContact CG-CD1 4.34Å
310	A	98.3	Very high	96	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.3	-49.1	179.7	0	0	0	0	0	111.8	F264 L295 L306 D307 C312 V313 E314	F264-A310 HydrophobicContact CD2-CB 4.16Å; F264-A310 HydrophobicContact CE2-CB 3.54Å; F264-A310 HydrophobicContact CZ-CB 3.98Å; L295-A310 HydrophobicContact CB-CB 3.78Å; L306-A310 WeakPolarHBondContact O-CB 3.24Å; L306-A310 PolarHBondContact O-N 2.85Å; D307-A310 WeakPolarHBondContact O-CB 3.3Å; D307-A310 PolarHBondContact O-N 3.02Å; A310-C312 VanDerWaalsContact C-N 3.34Å; A310-C312 PolarHBondContact O-N 3.14Å; A310-V313 PolarHBondContact O-N 3.15Å; A310-E314 WeakPolarHBondContact O-CG 3.36Å; A310-E314 PolarHBondContact O-N 2.8Å
311	K	97.5	Very high	96.3	Very high	113 Å²	113	48.9 Å²	48.9	49%	0.491	28%	0.28	S	S	.	.	H	α-helix	trans	-58.8	-44	178.7	-73.4	167.2	176.5	167.4	0	111.9	D307 S308 F309 A315	D307-K311 WeakPolarHBondContact O-CG 3.41Å; D307-K311 PolarHBondContact O-N 3.33Å; D307-K311 WeakPolarHBondContact OD1-CE 2.9Å; D307-K311 IonicContact OD1-NZ 3.74Å; D307-K311 WeakPolarHBondContact OD2-CE 2.93Å; D307-K311 IonicContact OD2-NZ 2.63Å; D307-K311 PolarHBondContact OD2-NZ 2.8Å; S308-K311 PolarHBondContact O-N 3.24Å; F309-K311 PolarHBondContact O-N 2.92Å; K311-A315 WeakPolarHBondContact O-CB 3.23Å; K311-A315 PolarHBondContact O-N 2.86Å; K311-A315 VanDerWaalsContact O-N 3.14Å
312	C	97.7	Very high	96.8	Very high	36 Å²	36	41.4 Å²	41.4	24%	0.243	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-45.2	176.8	-78.4	0	0	0	0	112.3	S308 F309 A310 A315 M316 L327	S308-C312 PolarHBondContact O-N 2.83Å; S308-C312 VanDerWaalsContact O-N 3.13Å; F309-C312 PolarHBondContact O-N 2.87Å; A310-C312 VanDerWaalsContact C-N 3.34Å; A310-C312 PolarHBondContact O-N 3.14Å; C312-A315 PolarHBondContact O-N 3.45Å; C312-M316 WeakPolarHBondContact O-CG 3.35Å; C312-L327 HydrophobicContact CB-CD2 3.88Å
313	V	98.3	Very high	97.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-40.3	-179.4	173.8	0	0	0	0	112.1	L260 W261 L295 F309 A310 A315 M316	L260-V313 HydrophobicContact CB-CG1 4.29Å; L260-V313 HydrophobicContact CB-CG2 3.92Å; W261-V313 HydrophobicContact CB-CG1 4.04Å; W261-V313 HydrophobicContact CD2-CG1 4.47Å; W261-V313 HydrophobicContact CE3-CG1 4.07Å; L295-V313 HydrophobicContact CD1-CB 4.03Å; L295-V313 HydrophobicContact CD1-CG1 3.81Å; F309-V313 HydrophobicContact CD1-CG2 3.82Å; F309-V313 HydrophobicContact CE1-CG2 3.49Å; F309-V313 VanDerWaalsContact CE1-CG2 3.49Å; F309-V313 HydrophobicContact CZ-CG2 4.22Å; F309-V313 PolarHBondContact O-N 3.23Å; A310-V313 PolarHBondContact O-N 3.15Å; V313-A315 VanDerWaalsContact C-N 3.28Å; V313-A315 PolarHBondContact O-N 2.88Å; V313-M316 PolarHBondContact O-N 3.43Å
314	E	97.3	Very high	97.3	Very high	41 Å²	41	43 Å²	43	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-35.1	176.4	-77.2	-174.9	-179.9	0	0	112.7	W261 L294 L295 K296 A310 M316	W261-E314 HydrophobicContact CH2-CG 4.04Å; W261-E314 HydrophobicContact CZ3-CG 4.23Å; L294-E314 VanDerWaalsContact CB-OE1 3.24Å; L294-E314 WeakPolarHBondContact CB-OE1 3.39Å; L295-E314 VanDerWaalsContact CA-OE1 3.25Å; L295-E314 WeakPolarHBondContact CA-OE1 3.15Å; L295-E314 HydrophobicContact CB-CG 4Å; L295-E314 VanDerWaalsContact CB-OE1 3.22Å; L295-E314 WeakPolarHBondContact CB-OE1 3.4Å; L295-E314 HydrophobicContact CD1-CG 4.1Å; L295-E314 HydrophobicContact CG-CG 3.95Å; L295-E314 PolarHBondContact N-OE1 2.81Å; K296-E314 PolarHBondContact N-OE1 2.94Å; A310-E314 WeakPolarHBondContact O-CG 3.36Å; A310-E314 PolarHBondContact O-N 2.8Å; E314-M316 VanDerWaalsContact C-N 3.29Å; E314-M316 PolarHBondContact O-N 2.76Å
315	A	97.3	Very high	97.6	Very high	87 Å²	87	42.3 Å²	42.3	72%	0.719	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-10.6	-179	0	0	0	0	0	114.3	K311 C312 V313 D317	K311-A315 WeakPolarHBondContact O-CB 3.23Å; K311-A315 PolarHBondContact O-N 2.86Å; K311-A315 VanDerWaalsContact O-N 3.14Å; C312-A315 PolarHBondContact O-N 3.45Å; V313-A315 VanDerWaalsContact C-N 3.28Å; V313-A315 PolarHBondContact O-N 2.88Å; A315-D317 PolarHBondContact O-N 2.85Å
316	M	98.1	Very high	97.7	Very high	22 Å²	22	44.6 Å²	44.6	11%	0.108	25%	0.253	C	S	.	.			trans	-75	126.3	-176.4	-71.3	178.5	-165.4	0	0	112.8	R257 L260 C312 V313 E314 A320 P322 L327	R257-M316 HydrophobicContact CB-CB 3.75Å; R257-M316 HydrophobicContact CB-SD 4.31Å; R257-M316 VanDerWaalsContact CD-O 3.25Å; R257-M316 WeakPolarHBondContact CD-O 3.33Å; R257-M316 PolarHBondContact NH1-O 3.05Å; R257-M316 VanDerWaalsContact NH1-O 3.15Å; L260-M316 HydrophobicContact CD1-CE 4.08Å; L260-M316 HydrophobicContact CD1-SD 3.96Å; C312-M316 WeakPolarHBondContact O-CG 3.35Å; V313-M316 PolarHBondContact O-N 3.43Å; E314-M316 VanDerWaalsContact C-N 3.29Å; E314-M316 PolarHBondContact O-N 2.76Å; M316-A320 HydrophobicContact CB-CB 3.93Å; M316-A320 HydrophobicContact CG-CB 4.09Å; M316-P322 HydrophobicContact CE-CB 3.91Å; M316-P322 HydrophobicContact CE-CG 4.45Å; M316-P322 HydrophobicContact SD-CB 4.21Å; M316-P322 HydrophobicContact SD-CG 4.1Å; M316-L327 HydrophobicContact CE-CD1 4.48Å
317	D	96.9	Very high	97.8	Very high	87 Å²	87	44.7 Å²	44.7	47%	0.465	25%	0.253	S	S	.	.			trans	-75.5	173.6	165.4	73.6	44.7	0	0	0	112.2	R257 A315 T319 A320	R257-D317 WeakPolarHBondContact CD-O 3.44Å; A315-D317 PolarHBondContact O-N 2.85Å; D317-T319 PolarHBondContact O-N 3.33Å; D317-T319 WeakPolarHBondContact OD1-CA 3.34Å; D317-T319 PolarHBondContact OD1-N 2.89Å; D317-T319 PolarHBondContact OD1-OG1 2.81Å; D317-A320 WeakPolarHBondContact O-CB 3.46Å; D317-A320 PolarHBondContact O-N 2.88Å; D317-A320 PolarHBondContact OD1-N 2.85Å
318	F	97.2	Very high	97.9	Very high	29 Å²	29	43.6 Å²	43.6	13%	0.127	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29	-177.7	175.4	-102.2	0	0	0	114.2	H228 R229 C231 D253 S255	H228-F318 AromaticContact CE1-CD1 3.95Å; H228-F318 AromaticContact CE1-CE1 3.57Å; H228-F318 PolarHBondContact CE1-O 2.97Å; H228-F318 AromaticContact ND1-CE1 3.93Å; H228-F318 PolarHBondContact NE2-O 2.74Å; R229-F318 WeakPolarHBondContact O-CE1 3.46Å; C231-F318 HydrophobicContact CB-CD1 3.98Å; C231-F318 HydrophobicContact CB-CE1 3.81Å; C231-F318 HydrophobicContact CB-CG 4.43Å; C231-F318 HydrophobicContact CB-CZ 4.14Å; D253-F318 HydrophobicContact CB-CE2 3.76Å; D253-F318 HydrophobicContact CB-CZ 4.04Å; D253-F318 WeakPolarHBondContact O-CD2 3.35Å; D253-F318 WeakPolarHBondContact O-CE2 3.31Å; S255-F318 WeakPolarHBondContact CB-O 3.35Å; S255-F318 PolarHBondContact OG-O 3.03Å
319	T	97.1	Very high	97.9	Very high	70 Å²	70	47 Å²	47	43%	0.429	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-9.6	-176.6	55.3	0	0	0	0	113.7	H228 R256 D317	H228-T319 HydrophobicContact CB-CG2 4.34Å; R256-T319 PolarHBondContact NH2-O 2.83Å; D317-T319 PolarHBondContact O-N 3.33Å; D317-T319 WeakPolarHBondContact OD1-CA 3.34Å; D317-T319 PolarHBondContact OD1-N 2.89Å; D317-T319 PolarHBondContact OD1-OG1 2.81Å
320	A	97.3	Very high	97.9	Very high	25 Å²	25	49.2 Å²	49.2	21%	0.207	27%	0.269	C	S	.	.			trans	-51.8	138.6	-173.6	0	0	0	0	0	112.7	R256 M316 D317 P322	R256-A320 PolarHBondContact NE-O 3.01Å; R256-A320 VanDerWaalsContact NH2-C 3.31Å; R256-A320 PolarHBondContact NH2-O 3.44Å; M316-A320 HydrophobicContact CB-CB 3.93Å; M316-A320 HydrophobicContact CG-CB 4.09Å; D317-A320 WeakPolarHBondContact O-CB 3.46Å; D317-A320 PolarHBondContact O-N 2.88Å; D317-A320 PolarHBondContact OD1-N 2.85Å; A320-P322 WeakPolarHBondContact O-CD 3.43Å
321	E	96.9	Very high	97.8	Very high	129 Å²	129	49.2 Å²	49.2	60%	0.603	27%	0.269	S	S	*	.			trans	-89.4	113.4	169	-173.2	118	169.8	0	0	108.4	R222 R256	R222-E321 IonicContact NH2-OE1 2.7Å; R222-E321 IonicContact NH2-OE2 3.25Å; R222-E321 PolarHBondContact NH2-OE2 3.3Å; R256-E321 IonicContact CZ-OE2 3.68Å; R256-E321 IonicContact NH1-OE2 2.79Å; R256-E321 PolarHBondContact NH1-OE2 2.75Å; R256-E321 IonicContact NH2-OE2 3.67Å
322	P	98.4	Very high	97.7	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.039	26%	0.262	C	S	.	.			trans	-65.5	138.6	178.6	-21.5	33.6	0	0	0	112.2	R256 L260 M316 A320 Y324	R256-P322 HydrophobicContact CB-CG 3.97Å; L260-P322 HydrophobicContact CD1-CB 3.42Å; L260-P322 VanDerWaalsContact CD1-CB 3.42Å; L260-P322 HydrophobicContact CD1-CG 3.46Å; L260-P322 VanDerWaalsContact CD1-CG 3.46Å; M316-P322 HydrophobicContact CE-CB 3.91Å; M316-P322 HydrophobicContact CE-CG 4.45Å; M316-P322 HydrophobicContact SD-CB 4.21Å; M316-P322 HydrophobicContact SD-CG 4.1Å; A320-P322 WeakPolarHBondContact O-CD 3.43Å; P322-Y324 HydrophobicContact CB-CD1 4.39Å; P322-Y324 HydrophobicContact CB-CE1 3.92Å; P322-Y324 HydrophobicContact CB-CE2 4.06Å; P322-Y324 WeakPolarHBondContact CD-OH 3.18Å; P322-Y324 HydrophobicContact CG-CE1 4.25Å; P322-Y324 HydrophobicContact CG-CE2 4.47Å; P322-Y324 WeakPolarHBondContact CG-OH 3.46Å; P322-Y324 VanDerWaalsContact O-CD2 3.26Å; P322-Y324 WeakPolarHBondContact O-CD2 3.28Å; P322-Y324 VanDerWaalsContact O-CE2 3.26Å; P322-Y324 WeakPolarHBondContact O-CE2 3.34Å; P322-Y324 PolarHBondContact O-N 2.84Å
323	N	98.4	Very high	97.5	Very high	91 Å²	91	49.8 Å²	49.8	49%	0.487	27%	0.269	S	S	.	.			trans	-84.6	84.4	168	-173.3	-16.6	0	0	0	109.7	S325 L326 L327	N323-S325 VanDerWaalsContact C-N 3.29Å; N323-S325 PolarHBondContact O-N 2.83Å; N323-S325 PolarHBondContact OD1-N 3.26Å; N323-L326 HydrophobicContact CB-CB 4.02Å; N323-L326 VanDerWaalsContact CG-CB 3.42Å; N323-L326 PolarHBondContact O-N 2.82Å; N323-L326 WeakPolarHBondContact OD1-CB 3.24Å; N323-L326 PolarHBondContact OD1-N 2.84Å; N323-L326 VanDerWaalsContact OD1-N 3.1Å; N323-L327 WeakPolarHBondContact O-CG 3.35Å; N323-L327 PolarHBondContact O-N 3.38Å
324	Y	98.8	Very high	97.2	Very high	17 Å²	17	50 Å²	50	7%	0.067	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-37.1	-176.7	-55.5	-85.3	0	0	0	113.1	I177 Q181 H184 P322 L326 L327 I328	I177-Y324 HydrophobicContact CG2-CD1 3.98Å; Q181-Y324 HydrophobicContact CB-CD1 3.72Å; Q181-Y324 HydrophobicContact CB-CD2 4.04Å; Q181-Y324 HydrophobicContact CB-CE1 4.06Å; Q181-Y324 HydrophobicContact CB-CE2 4.36Å; Q181-Y324 HydrophobicContact CB-CG 3.73Å; Q181-Y324 HydrophobicContact CG-CD1 4.25Å; Q181-Y324 HydrophobicContact CG-CD2 3.63Å; Q181-Y324 HydrophobicContact CG-CE2 4.05Å; Q181-Y324 HydrophobicContact CG-CG 3.76Å; H184-Y324 WeakPolarHBondContact CB-OH 3.28Å; H184-Y324 VanDerWaalsContact CG-OH 3.31Å; H184-Y324 AromaticContact ND1-CE1 3.77Å; H184-Y324 AromaticContact ND1-CZ 3.61Å; H184-Y324 PolarHBondContact ND1-OH 3.42Å; P322-Y324 HydrophobicContact CB-CD1 4.39Å; P322-Y324 HydrophobicContact CB-CE1 3.92Å; P322-Y324 HydrophobicContact CB-CE2 4.06Å; P322-Y324 WeakPolarHBondContact CD-OH 3.18Å; P322-Y324 HydrophobicContact CG-CE1 4.25Å; P322-Y324 HydrophobicContact CG-CE2 4.47Å; P322-Y324 WeakPolarHBondContact CG-OH 3.46Å; P322-Y324 VanDerWaalsContact O-CD2 3.26Å; P322-Y324 WeakPolarHBondContact O-CD2 3.28Å; P322-Y324 VanDerWaalsContact O-CE2 3.26Å; P322-Y324 WeakPolarHBondContact O-CE2 3.34Å; P322-Y324 PolarHBondContact O-N 2.84Å; Y324-L326 PolarHBondContact O-N 2.81Å; Y324-L327 PolarHBondContact O-N 3.43Å; Y324-I328 WeakPolarHBondContact O-CG1 3.38Å; Y324-I328 PolarHBondContact O-N 3.1Å
325	S	98.6	Very high	96.4	Very high	67 Å²	67	48.6 Å²	48.6	47%	0.469	27%	0.266	S	S	.	.	H	α-helix	trans	-60.2	-47	177.5	-55.7	0	0	0	0	111	N323 L327 I328 E329	N323-S325 VanDerWaalsContact C-N 3.29Å; N323-S325 PolarHBondContact O-N 2.83Å; N323-S325 PolarHBondContact OD1-N 3.26Å; S325-L327 PolarHBondContact O-N 3.29Å; S325-I328 WeakPolarHBondContact O-CB 3.39Å; S325-I328 PolarHBondContact O-N 3.03Å; S325-E329 WeakPolarHBondContact O-CG 3.43Å; S325-E329 PolarHBondContact O-N 3.33Å
326	L	98.6	Very high	95.3	Very high	47 Å²	47	47 Å²	47	25%	0.246	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-39.5	177	-176	65	0	0	0	112.4	N323 Y324 I328 E329 Y330	N323-L326 HydrophobicContact CB-CB 4.02Å; N323-L326 VanDerWaalsContact CG-CB 3.42Å; N323-L326 PolarHBondContact O-N 2.82Å; N323-L326 WeakPolarHBondContact OD1-CB 3.24Å; N323-L326 PolarHBondContact OD1-N 2.84Å; N323-L326 VanDerWaalsContact OD1-N 3.1Å; Y324-L326 PolarHBondContact O-N 2.81Å; L326-I328 VanDerWaalsContact C-N 3.32Å; L326-I328 PolarHBondContact O-N 3.37Å; L326-E329 PolarHBondContact O-N 3.46Å; L326-Y330 HydrophobicContact CD1-CE1 4.12Å; L326-Y330 HydrophobicContact CD1-CE2 4Å; L326-Y330 HydrophobicContact CD2-CE2 3.97Å; L326-Y330 HydrophobicContact CG-CD2 4.23Å; L326-Y330 HydrophobicContact CG-CE2 3.55Å; L326-Y330 VanDerWaalsContact O-CD2 3.3Å; L326-Y330 WeakPolarHBondContact O-CD2 3.15Å; L326-Y330 PolarHBondContact O-N 3.29Å
327	L	98.7	Very high	93.6	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-39.1	175	-66.7	176.4	0	0	0	111.8	I177 L260 F309 C312 M316 N323 Y324 S325 Y330 I331	I177-L327 HydrophobicContact CD1-CB 4.36Å; L260-L327 HydrophobicContact CD1-CD1 3.81Å; L260-L327 HydrophobicContact CD2-CD1 4Å; F309-L327 HydrophobicContact CD2-CB 3.93Å; F309-L327 HydrophobicContact CD2-CD2 3.68Å; F309-L327 HydrophobicContact CD2-CG 4.31Å; F309-L327 HydrophobicContact CE2-CB 3.77Å; F309-L327 HydrophobicContact CE2-CD1 4.19Å; F309-L327 HydrophobicContact CE2-CD2 3.88Å; F309-L327 HydrophobicContact CE2-CG 4.15Å; F309-L327 HydrophobicContact CG-CD2 4.04Å; F309-L327 HydrophobicContact CZ-CD1 4.43Å; F309-L327 HydrophobicContact CZ-CD2 4.4Å; C312-L327 HydrophobicContact CB-CD2 3.88Å; M316-L327 HydrophobicContact CE-CD1 4.48Å; N323-L327 WeakPolarHBondContact O-CG 3.35Å; N323-L327 PolarHBondContact O-N 3.38Å; Y324-L327 PolarHBondContact O-N 3.43Å; S325-L327 PolarHBondContact O-N 3.29Å; L327-Y330 PolarHBondContact O-N 2.76Å; L327-I331 WeakPolarHBondContact O-CG1 3.3Å; L327-I331 PolarHBondContact O-N 3.31Å; L327-I331 VanDerWaalsContact O-N 3.16Å
328	I	98.6	Very high	91.8	Very high	16 Å²	16	48.5 Å²	48.5	8%	0.082	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-46.4	174.2	-72.5	166.7	0	0	0	110.2	V174 I177 R178 Y324 S325 L326 Y330 I331 E332	V174-I328 HydrophobicContact CG1-CG1 4.39Å; V174-I328 HydrophobicContact CG1-CG2 4.09Å; V174-I328 HydrophobicContact CG2-CG2 4.12Å; I177-I328 HydrophobicContact CB-CD1 4.48Å; I177-I328 HydrophobicContact CB-CG1 4.03Å; I177-I328 HydrophobicContact CD1-CG1 3.98Å; I177-I328 HydrophobicContact CG2-CD1 4.08Å; I177-I328 HydrophobicContact CG2-CG1 3.76Å; R178-I328 HydrophobicContact CG-CD1 3.93Å; Y324-I328 WeakPolarHBondContact O-CG1 3.38Å; Y324-I328 PolarHBondContact O-N 3.1Å; S325-I328 WeakPolarHBondContact O-CB 3.39Å; S325-I328 PolarHBondContact O-N 3.03Å; L326-I328 VanDerWaalsContact C-N 3.32Å; L326-I328 PolarHBondContact O-N 3.37Å; I328-Y330 VanDerWaalsContact C-N 3.29Å; I328-Y330 PolarHBondContact O-N 2.78Å; I328-I331 PolarHBondContact O-N 2.98Å; I328-I331 VanDerWaalsContact O-N 3.08Å; I328-E332 HydrophobicContact CG2-CG 4.19Å; I328-E332 WeakPolarHBondContact O-CG 3.49Å; I328-E332 PolarHBondContact O-N 3.5Å
329	E	97.7	Very high	89.8	Confident	101 Å²	101	54 Å²	54	47%	0.472	29%	0.293	S	S	.	.	H	α-helix	trans	-56.1	-43.2	177.4	-73	169.3	-156.8	0	0	111.8	S325 L326 E332 Q333	S325-E329 WeakPolarHBondContact O-CG 3.43Å; S325-E329 PolarHBondContact O-N 3.33Å; L326-E329 PolarHBondContact O-N 3.46Å; E329-E332 PolarHBondContact O-N 2.81Å; E329-Q333 VanDerWaalsContact O-CG 3.31Å; E329-Q333 WeakPolarHBondContact O-CG 3.38Å; E329-Q333 PolarHBondContact O-N 3.04Å; E329-Q333 VanDerWaalsContact O-N 3.09Å
330	Y	97.9	Very high	87.6	Confident	48 Å²	48	60 Å²	60	19%	0.188	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-40.5	175.6	-67.8	-36.7	0	0	0	113.1	G305 S308 L326 L327 I328 Q333	G305-Y330 CarbonylContact C-O 3.6Å; G305-Y330 WeakPolarHBondContact CA-O 3.36Å; G305-Y330 WeakPolarHBondContact O-CB 3.42Å; S308-Y330 VanDerWaalsContact CB-CD1 3.45Å; L326-Y330 HydrophobicContact CD1-CE1 4.12Å; L326-Y330 HydrophobicContact CD1-CE2 4Å; L326-Y330 HydrophobicContact CD2-CE2 3.97Å; L326-Y330 HydrophobicContact CG-CD2 4.23Å; L326-Y330 HydrophobicContact CG-CE2 3.55Å; L326-Y330 VanDerWaalsContact O-CD2 3.3Å; L326-Y330 WeakPolarHBondContact O-CD2 3.15Å; L326-Y330 PolarHBondContact O-N 3.29Å; L327-Y330 PolarHBondContact O-N 2.76Å; I328-Y330 VanDerWaalsContact C-N 3.29Å; I328-Y330 PolarHBondContact O-N 2.78Å; Y330-Q333 WeakPolarHBondContact O-CB 3.43Å; Y330-Q333 PolarHBondContact O-N 2.8Å
331	I	97.2	Very high	85.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.9	-38.6	175.8	-68.1	-52.6	0	0	0	111.2	V170 A173 V174 I177 I267 L306 F309 L327 I328 Q333 I334	V170-I331 HydrophobicContact CB-CG2 4.36Å; V170-I331 HydrophobicContact CG1-CG2 4.08Å; V170-I331 HydrophobicContact CG2-CG2 4.31Å; V170-I331 WeakPolarHBondContact CG2-O 3.38Å; A173-I331 HydrophobicContact CB-CG1 4.49Å; A173-I331 HydrophobicContact CB-CG2 3.63Å; V174-I331 HydrophobicContact CG2-CG2 3.96Å; I177-I331 HydrophobicContact CD1-CG1 3.88Å; I267-I331 HydrophobicContact CD1-CD1 3.97Å; I267-I331 HydrophobicContact CD1-CG1 4.39Å; I267-I331 HydrophobicContact CG2-CD1 4.14Å; L306-I331 HydrophobicContact CD1-CD1 4.47Å; F309-I331 HydrophobicContact CB-CD1 4.46Å; F309-I331 HydrophobicContact CD2-CD1 3.87Å; F309-I331 HydrophobicContact CD2-CG1 3.86Å; F309-I331 HydrophobicContact CE2-CD1 4.46Å; F309-I331 HydrophobicContact CE2-CG1 4.25Å; F309-I331 HydrophobicContact CG-CD1 4.34Å; L327-I331 WeakPolarHBondContact O-CG1 3.3Å; L327-I331 PolarHBondContact O-N 3.31Å; L327-I331 VanDerWaalsContact O-N 3.16Å; I328-I331 PolarHBondContact O-N 2.98Å; I328-I331 VanDerWaalsContact O-N 3.08Å; I331-Q333 VanDerWaalsContact C-N 3.28Å; I331-Q333 PolarHBondContact O-N 2.71Å; I331-I334 HydrophobicContact CD1-CD1 3.93Å; I331-I334 VanDerWaalsContact O-CB 3.25Å; I331-I334 WeakPolarHBondContact O-CB 3.41Å; I331-I334 WeakPolarHBondContact O-CG1 3.5Å; I331-I334 PolarHBondContact O-N 2.85Å; I331-I334 VanDerWaalsContact O-N 3.14Å
332	E	95	Very high	83.2	Confident	73 Å²	73	60.2 Å²	60.2	34%	0.341	33%	0.325	S	S	.	.	H	α-helix	trans	-67.9	-26.4	178.4	-71.7	179.8	165.2	0	0	113.3	V174 I328 E329 I334 A335	V174-E332 HydrophobicContact CG2-CG 4.1Å; I328-E332 HydrophobicContact CG2-CG 4.19Å; I328-E332 WeakPolarHBondContact O-CG 3.49Å; I328-E332 PolarHBondContact O-N 3.5Å; E329-E332 PolarHBondContact O-N 2.81Å; E332-I334 PolarHBondContact O-N 3.31Å; E332-A335 PolarHBondContact O-N 2.87Å
333	Q	93.4	Very high	80.8	Confident	87 Å²	87	64.1 Å²	64.1	41%	0.407	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-26.4	172.6	-72.3	165.7	28.8	0	0	112.7	E329 Y330 I331 A335 A336	E329-Q333 VanDerWaalsContact O-CG 3.31Å; E329-Q333 WeakPolarHBondContact O-CG 3.38Å; E329-Q333 PolarHBondContact O-N 3.04Å; E329-Q333 VanDerWaalsContact O-N 3.09Å; Y330-Q333 WeakPolarHBondContact O-CB 3.43Å; Y330-Q333 PolarHBondContact O-N 2.8Å; I331-Q333 VanDerWaalsContact C-N 3.28Å; I331-Q333 PolarHBondContact O-N 2.71Å; Q333-A335 VanDerWaalsContact C-N 3.3Å; Q333-A335 PolarHBondContact O-N 3.48Å; Q333-A336 WeakPolarHBondContact O-CB 2.95Å; Q333-A336 PolarHBondContact O-N 2.72Å
334	I	91.4	Very high	78.7	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	38%	0.382	C	S	.	.	H	α-helix	trans	-63	-39.3	177.6	-57.7	178.4	0	0	0	110.8	V170 M271 P303 L306 I331 E332 A336 P337	V170-I334 HydrophobicContact CG2-CB 3.74Å; V170-I334 HydrophobicContact CG2-CG2 3.89Å; M271-I334 HydrophobicContact CE-CD1 4.4Å; M271-I334 HydrophobicContact CE-CG2 3.63Å; M271-I334 HydrophobicContact SD-CD1 4.25Å; P303-I334 HydrophobicContact CB-CB 4.3Å; P303-I334 HydrophobicContact CB-CG1 4.05Å; P303-I334 HydrophobicContact CB-CG2 3.92Å; P303-I334 HydrophobicContact CG-CG2 3.93Å; L306-I334 HydrophobicContact CB-CD1 4.02Å; I331-I334 HydrophobicContact CD1-CD1 3.93Å; I331-I334 VanDerWaalsContact O-CB 3.25Å; I331-I334 WeakPolarHBondContact O-CB 3.41Å; I331-I334 WeakPolarHBondContact O-CG1 3.5Å; I331-I334 PolarHBondContact O-N 2.85Å; I331-I334 VanDerWaalsContact O-N 3.14Å; E332-I334 PolarHBondContact O-N 3.31Å; I334-A336 VanDerWaalsContact C-N 3.35Å; I334-P337 WeakPolarHBondContact O-CD 3.49Å
335	A	81.6	Confident	77.1	Confident	10 Å²	10	66.2 Å²	66.2	8%	0.083	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.6	180	0	0	0	0	0	113.6	V170 E332 Q333 P337 C338 K339	V170-A335 HydrophobicContact CB-CB 4.23Å; V170-A335 HydrophobicContact CG1-CB 3.99Å; V170-A335 HydrophobicContact CG2-CB 4.03Å; E332-A335 PolarHBondContact O-N 2.87Å; Q333-A335 VanDerWaalsContact C-N 3.3Å; Q333-A335 PolarHBondContact O-N 3.48Å; A335-P337 VanDerWaalsContact C-CD 3.46Å; A335-C338 WeakPolarHBondContact O-CA 3.27Å; A335-C338 WeakPolarHBondContact O-CB 3.43Å; A335-C338 PolarHBondContact O-N 2.91Å; A335-K339 PolarHBondContact O-N 3.04Å
336	A	73.7	Confident	76.2	Confident	53 Å²	53	64.4 Å²	64.4	44%	0.438	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-55.4	-42.5	-177.2	0	0	0	0	0	113.5	Q333 I334 C338 K339	Q333-A336 WeakPolarHBondContact O-CB 2.95Å; Q333-A336 PolarHBondContact O-N 2.72Å; I334-A336 VanDerWaalsContact C-N 3.35Å; A336-C338 PolarHBondContact O-N 2.78Å; A336-K339 PolarHBondContact O-N 3.02Å
337	P	61.7	Low	75.7	Confident	109 Å²	109	62.8 Å²	62.8	71%	0.708	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.7	175	-20.3	34	0	0	0	113.8	I334 A335	I334-P337 WeakPolarHBondContact O-CD 3.49Å; A335-P337 VanDerWaalsContact C-CD 3.46Å
338	C	58.8	Low	75.2	Confident	33 Å²	33	63.2 Å²	63.2	22%	0.223	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-95.1	-19.9	-175.4	-62.9	0	0	0	0	113.6	A335 A336 E340 A341 H342	A335-C338 WeakPolarHBondContact O-CA 3.27Å; A335-C338 WeakPolarHBondContact O-CB 3.43Å; A335-C338 PolarHBondContact O-N 2.91Å; A336-C338 PolarHBondContact O-N 2.78Å; C338-E340 PolarHBondContact O-N 2.77Å; C338-A341 PolarHBondContact O-N 3.45Å; C338-H342 PolarHBondContact O-N 3.06Å
339	K	56.8	Low	74.4	Confident	145 Å²	145	62.8 Å²	62.8	63%	0.63	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.8	-177.1	-77.8	-174.8	-178.6	179.5	0	112.6	A335 A336 A341	A335-K339 PolarHBondContact O-N 3.04Å; A336-K339 PolarHBondContact O-N 3.02Å; K339-A341 VanDerWaalsContact C-N 3.29Å; K339-A341 PolarHBondContact O-N 2.91Å
340	E	50.9	Low	73.6	Confident	194 Å²	194	61.3 Å²	61.3	91%	0.907	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-20.5	177.5	-64.6	-174.1	175.7	0	0	113.3	C338	C338-E340 PolarHBondContact O-N 2.77Å
341	A	50.8	Low	72.1	Confident	71 Å²	71	65.8 Å²	65.8	59%	0.587	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-17.5	-174.1	0	0	0	0	0	114.8	C338 K339	C338-A341 PolarHBondContact O-N 3.45Å; K339-A341 VanDerWaalsContact C-N 3.29Å; K339-A341 PolarHBondContact O-N 2.91Å
342	H	50	Low	70.2	Confident	88 Å²	88	71.4 Å²	71.4	41%	0.407	41%	0.409	S	S	.	.			trans	-129.2	63.9	-164.2	-62.6	-50.9	0	0	0	113.6	C338 S344 C345	C338-H342 PolarHBondContact O-N 3.06Å; H342-S344 PolarHBondContact O-N 2.91Å; H342-C345 HydrophobicContact CB-CB 4.07Å; H342-C345 PolarHBondContact ND1-SG 3.47Å
343	G	47.7	Very low	68.2	Low	88 Å²	88	72.8 Å²	72.8	91%	0.907	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	3.6	176.5	0	0	0	0	0	116.6
344	S	54.9	Low	66.3	Low	116 Å²	116	72.5 Å²	72.5	81%	0.811	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.1	48	-178.7	-177.4	0	0	0	0	110.8	H342 G346	H342-S344 PolarHBondContact O-N 2.91Å; S344-G346 PolarHBondContact O-N 3.45Å
345	C	64.9	Low	64.6	Low	37 Å²	37	74.9 Å²	74.9	25%	0.25	44%	0.438	C	S	.	.			trans	-85.2	110.8	171.7	-83.6	0	0	0	0	109.2	H167 H342	H167-C345 PolarHBondContact CE1-O 3.26Å; H342-C345 HydrophobicContact CB-CB 4.07Å; H342-C345 PolarHBondContact ND1-SG 3.47Å
346	G	79.8	Confident	63.4	Low	29 Å²	29	75.5 Å²	75.5	30%	0.299	44%	0.439	S	S	.	.			trans	-58.3	166.8	162.1	0	0	0	0	0	111.5	S344 E350	S344-G346 PolarHBondContact O-N 3.45Å; G346-E350 WeakPolarHBondContact CA-OE2 3.38Å
347	L	87.4	Confident	62.5	Low	12 Å²	12	75.4 Å²	75.4	6%	0.063	43%	0.431	C	S	.	.			trans	-66	153.8	175	-56.7	173	0	0	0	109.9	T168 N171 W349 E350	T168-L347 HydrophobicContact CG2-CD2 4.28Å; N171-L347 HydrophobicContact CB-CD2 4.08Å; L347-W349 VanDerWaalsContact C-N 3.3Å; L347-W349 HydrophobicContact CB-CD2 4.21Å; L347-W349 HydrophobicContact CB-CE3 4.41Å; L347-W349 HydrophobicContact CB-CH2 4.04Å; L347-W349 HydrophobicContact CB-CZ2 3.77Å; L347-W349 HydrophobicContact CB-CZ3 4.33Å; L347-W349 HydrophobicContact CD1-CH2 3.79Å; L347-W349 HydrophobicContact CD1-CZ2 3.3Å; L347-W349 HydrophobicContact CG-CH2 4.41Å; L347-W349 HydrophobicContact CG-CZ2 4.13Å; L347-W349 PolarHBondContact O-N 2.83Å; L347-W349 VanDerWaalsContact O-N 3.16Å; L347-E350 HydrophobicContact CB-CG 4.07Å; L347-E350 PolarHBondContact N-OE2 3.08Å; L347-E350 VanDerWaalsContact O-CB 3.25Å; L347-E350 WeakPolarHBondContact O-CB 3.13Å; L347-E350 PolarHBondContact O-N 2.91Å
348	D	89	Confident	61.9	Low	11 Å²	11	76.1 Å²	76.1	6%	0.059	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-55.1	-43.3	-167.6	-65.1	-11.9	0	0	0	113.5	M159 F164 T165 T168 E350 K351 Y352	M159-D348 HydrophobicContact SD-CB 3.66Å; F164-D348 WeakPolarHBondContact CA-OD2 3.34Å; F164-D348 WeakPolarHBondContact CB-OD2 3.47Å; F164-D348 HydrophobicContact CD1-CB 4.37Å; T165-D348 WeakPolarHBondContact CB-OD1 3.33Å; T165-D348 VanDerWaalsContact CG2-OD1 3.28Å; T165-D348 WeakPolarHBondContact CG2-OD1 3.4Å; T165-D348 PolarHBondContact N-OD2 2.87Å; T165-D348 PolarHBondContact OG1-OD1 2.87Å; T168-D348 HydrophobicContact CG2-CB 4.41Å; T168-D348 PolarHBondContact OG1-N 3.36Å; T168-D348 VanDerWaalsContact OG1-N 3.08Å; T168-D348 PolarHBondContact OG1-OD1 3.35Å; D348-E350 PolarHBondContact O-N 2.88Å; D348-K351 PolarHBondContact O-N 2.83Å; D348-Y352 WeakPolarHBondContact O-CD2 3.43Å; D348-Y352 WeakPolarHBondContact O-CE2 3.4Å
349	W	82.9	Confident	61.4	Low	8 Å²	8	79.4 Å²	79.4	3%	0.03	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-69.3	-16.3	178	59.5	83.4	0	0	0	114.1	L155 M159 F164 T168 L172 L200 L347 K351 Y352	L155-W349 HydrophobicContact CB-CE3 4.33Å; L155-W349 HydrophobicContact CB-CZ3 4.5Å; L155-W349 HydrophobicContact CD1-CD2 4.31Å; L155-W349 HydrophobicContact CD1-CE3 4.13Å; L155-W349 HydrophobicContact CD1-CH2 3.99Å; L155-W349 HydrophobicContact CD1-CZ2 4.21Å; L155-W349 HydrophobicContact CD1-CZ3 3.96Å; L155-W349 HydrophobicContact CD2-CB 4.17Å; L155-W349 HydrophobicContact CD2-CD2 3.87Å; L155-W349 HydrophobicContact CD2-CE3 4.04Å; L155-W349 HydrophobicContact CD2-CG 3.94Å; L155-W349 HydrophobicContact CG-CE3 4.4Å; M159-W349 HydrophobicContact CE-CB 4.21Å; F164-W349 HydrophobicContact CD1-CZ3 4.42Å; F164-W349 HydrophobicContact CE1-CE3 4.03Å; F164-W349 AromaticContact CE1-CZ3 3.86Å; F164-W349 HydrophobicContact CE1-CZ3 3.86Å; F164-W349 HydrophobicContact CZ-CZ3 4.21Å; T168-W349 HydrophobicContact CG2-CH2 4.36Å; T168-W349 HydrophobicContact CG2-CZ3 3.8Å; L172-W349 HydrophobicContact CD1-CH2 4.02Å; L172-W349 HydrophobicContact CD1-CZ3 3.99Å; L172-W349 HydrophobicContact CD2-CH2 3.67Å; L172-W349 HydrophobicContact CD2-CZ3 4.48Å; L172-W349 HydrophobicContact CG-CH2 4.32Å; L200-W349 HydrophobicContact CD1-CZ2 3.66Å; L200-W349 HydrophobicContact CD2-CH2 4.46Å; L200-W349 HydrophobicContact CD2-CZ2 3.82Å; L200-W349 HydrophobicContact CG-CZ2 4.31Å; L347-W349 VanDerWaalsContact C-N 3.3Å; L347-W349 HydrophobicContact CB-CD2 4.21Å; L347-W349 HydrophobicContact CB-CE3 4.41Å; L347-W349 HydrophobicContact CB-CH2 4.04Å; L347-W349 HydrophobicContact CB-CZ2 3.77Å; L347-W349 HydrophobicContact CB-CZ3 4.33Å; L347-W349 HydrophobicContact CD1-CH2 3.79Å; L347-W349 HydrophobicContact CD1-CZ2 3.3Å; L347-W349 HydrophobicContact CG-CH2 4.41Å; L347-W349 HydrophobicContact CG-CZ2 4.13Å; L347-W349 PolarHBondContact O-N 2.83Å; L347-W349 VanDerWaalsContact O-N 3.16Å; W349-K351 PolarHBondContact O-N 3.01Å; W349-Y352 PolarHBondContact O-N 3.23Å; W349-Y352 VanDerWaalsContact O-N 3.16Å
350	E	79.7	Confident	61.1	Low	69 Å²	69	74.4 Å²	74.4	32%	0.322	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-72.3	-17.1	177.1	-57.8	-172.6	130.5	0	0	112.4	K207 G346 L347 D348	K207-E350 WeakPolarHBondContact CE-OE1 3.46Å; K207-E350 IonicContact NZ-OE1 2.87Å; K207-E350 PolarHBondContact NZ-OE1 3.47Å; G346-E350 WeakPolarHBondContact CA-OE2 3.38Å; L347-E350 HydrophobicContact CB-CG 4.07Å; L347-E350 PolarHBondContact N-OE2 3.08Å; L347-E350 VanDerWaalsContact O-CB 3.25Å; L347-E350 WeakPolarHBondContact O-CB 3.13Å; L347-E350 PolarHBondContact O-N 2.91Å; D348-E350 PolarHBondContact O-N 2.88Å
351	K	65.8	Low	61.1	Low	142 Å²	142	65.7 Å²	65.7	62%	0.617	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-81.9	-20	172.3	-59.4	178.2	-176.3	172.6	0	112.2	D348 W349	D348-K351 PolarHBondContact O-N 2.83Å; W349-K351 PolarHBondContact O-N 3.01Å
352	Y	57.1	Low	61	Low	118 Å²	118	62.6 Å²	62.6	46%	0.463	35%	0.346	S	S	.	.	S	Bend	trans	-95.5	160	-179.1	-63.7	-83.2	0	0	0	110.8	M159 D348 W349 T354	M159-Y352 HydrophobicContact CE-CD2 4.31Å; M159-Y352 HydrophobicContact CE-CE2 4.38Å; M159-Y352 HydrophobicContact SD-CE2 4.24Å; D348-Y352 WeakPolarHBondContact O-CD2 3.43Å; D348-Y352 WeakPolarHBondContact O-CE2 3.4Å; W349-Y352 PolarHBondContact O-N 3.23Å; W349-Y352 VanDerWaalsContact O-N 3.16Å; Y352-T354 PolarHBondContact O-N 3.09Å
353	D	53.7	Low	60.8	Low	103 Å²	103	59.8 Å²	59.8	55%	0.551	34%	0.336	S	S	*	.			trans	-50.1	127.7	177.8	179.7	10.8	0	0	0	111.4	T355 I356	D353-T355 PolarHBondContact O-N 3.35Å; D353-T355 PolarHBondContact OD1-N 2.86Å; D353-T355 WeakPolarHBondContact OD2-CG2 3.45Å; D353-T355 PolarHBondContact OD2-OG1 3.45Å; D353-I356 PolarHBondContact O-N 2.98Å
354	T	54.4	Low	61.4	Low	80 Å²	80	58.4 Å²	58.4	49%	0.491	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-8.7	-179.9	59.6	0	0	0	0	113.8	Y352 I356 L357 Q358	Y352-T354 PolarHBondContact O-N 3.09Å; T354-I356 PolarHBondContact O-N 3.43Å; T354-I356 VanDerWaalsContact O-N 3.14Å; T354-L357 CarbonylContact O-C 3.52Å; T354-L357 WeakPolarHBondContact O-CA 3.48Å; T354-L357 WeakPolarHBondContact O-CB 3.33Å; T354-L357 PolarHBondContact O-N 2.63Å; T354-Q358 PolarHBondContact O-N 3.37Å
355	T	56	Low	61.8	Low	56 Å²	56	55.3 Å²	55.3	34%	0.344	28%	0.281	S	S	.	.	H	α-helix	trans	-53.2	-28.7	172.1	49	0	0	0	0	113.6	D353 L357 Q358 K359	D353-T355 PolarHBondContact O-N 3.35Å; D353-T355 PolarHBondContact OD1-N 2.86Å; D353-T355 WeakPolarHBondContact OD2-CG2 3.45Å; D353-T355 PolarHBondContact OD2-OG1 3.45Å; T355-L357 VanDerWaalsContact C-N 3.32Å; T355-Q358 PolarHBondContact O-N 3.46Å; T355-K359 PolarHBondContact O-N 3.39Å
356	I	55.9	Low	61.6	Low	23 Å²	23	56.3 Å²	56.3	12%	0.118	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-39.1	172	-65.9	172.5	0	0	0	111.3	P150 L155 E158 D353 T354	P150-I356 HydrophobicContact CG-CG2 4.47Å; L155-I356 HydrophobicContact CD2-CG2 4.14Å; E158-I356 HydrophobicContact CB-CD1 4.06Å; E158-I356 HydrophobicContact CG-CD1 4.38Å; D353-I356 PolarHBondContact O-N 2.98Å; T354-I356 PolarHBondContact O-N 3.43Å; T354-I356 VanDerWaalsContact O-N 3.14Å
357	L	54.2	Low	60.5	Low	51 Å²	51	57.9 Å²	57.9	27%	0.267	28%	0.282	S	S	.	.	H	α-helix	trans	-77.6	-26.3	177.6	-59.7	174.7	0	0	0	112.4	P150 L200 T354 T355 K359	P150-L357 HydrophobicContact CG-CD2 4.23Å; L200-L357 HydrophobicContact CD1-CD2 4.01Å; T354-L357 CarbonylContact O-C 3.52Å; T354-L357 WeakPolarHBondContact O-CA 3.48Å; T354-L357 WeakPolarHBondContact O-CB 3.33Å; T354-L357 PolarHBondContact O-N 2.63Å; T355-L357 VanDerWaalsContact C-N 3.32Å; L357-K359 VanDerWaalsContact C-N 3.26Å; L357-K359 PolarHBondContact O-N 3.2Å
358	Q	48.9	Very low	58.8	Low	125 Å²	125	60.8 Å²	60.8	58%	0.584	30%	0.296	S	S	*	.	H	α-helix	trans	-70.8	-23.1	177.1	-69.7	179.5	-3.9	0	0	112.8	T354 T355 H360	T354-Q358 PolarHBondContact O-N 3.37Å; T355-Q358 PolarHBondContact O-N 3.46Å; Q358-H360 PolarHBondContact O-CE1 2.98Å; Q358-H360 PolarHBondContact O-N 2.77Å; Q358-H360 PolarHBondContact O-ND1 2.85Å
359	K	49.1	Very low	56.8	Low	101 Å²	101	64.1 Å²	64.1	44%	0.439	31%	0.312	S	S	.	.	S	Bend	trans	-76	119.3	167.8	-64.6	173.5	-173.8	170.4	0	106.7	T355 L357 Y361	T355-K359 PolarHBondContact O-N 3.39Å; L357-K359 VanDerWaalsContact C-N 3.26Å; L357-K359 PolarHBondContact O-N 3.2Å; K359-Y361 VanDerWaalsContact C-CD2 3.49Å; K359-Y361 HydrophobicContact CB-CD2 4.22Å; K359-Y361 HydrophobicContact CB-CE1 4.4Å; K359-Y361 HydrophobicContact CB-CE2 3.21Å; K359-Y361 WeakPolarHBondContact CB-OH 3.36Å; K359-Y361 WeakPolarHBondContact CD-OH 3.24Å; K359-Y361 WeakPolarHBondContact O-CD2 3.14Å; K359-Y361 WeakPolarHBondContact O-CE2 3.41Å
360	H	49.2	Very low	55	Low	41 Å²	41	68.1 Å²	68.1	19%	0.19	33%	0.332	C	S	.	.			trans	-95.3	136.9	-179.2	-67.4	48.1	0	0	0	108.7	P45 L48 L202 Q358	P45-H360 WeakPolarHBondContact CD-NE2 3.48Å; L48-H360 HydrophobicContact CD2-CB 3.29Å; L202-H360 WeakPolarHBondContact CD1-CD2 3.48Å; Q358-H360 PolarHBondContact O-CE1 2.98Å; Q358-H360 PolarHBondContact O-N 2.77Å; Q358-H360 PolarHBondContact O-ND1 2.85Å
361	Y	51.9	Low	53	Low	11 Å²	11	68.1 Å²	68.1	4%	0.043	33%	0.332	C	S	.	.			trans	-136.9	141.3	-169.3	-57.9	-97.7	0	0	0	110.1	F51 L148 P150 R154 K359	F51-Y361 HydrophobicContact CB-CD1 4.46Å; F51-Y361 HydrophobicContact CB-CE1 4.46Å; F51-Y361 AromaticContact CD2-CD1 3.39Å; F51-Y361 HydrophobicContact CD2-CD1 3.39Å; F51-Y361 AromaticContact CD2-CE1 3.02Å; F51-Y361 HydrophobicContact CD2-CE1 3.02Å; F51-Y361 AromaticContact CE2-CD1 3.87Å; F51-Y361 HydrophobicContact CE2-CD1 3.87Å; F51-Y361 AromaticContact CE2-CE1 3.11Å; F51-Y361 HydrophobicContact CE2-CE1 3.11Å; F51-Y361 AromaticContact CE2-CZ 3.81Å; F51-Y361 HydrophobicContact CG-CD1 4.18Å; F51-Y361 AromaticContact CG-CE1 3.79Å; F51-Y361 HydrophobicContact CG-CE1 3.79Å; F51-Y361 AromaticContact CZ-CE1 3.98Å; F51-Y361 HydrophobicContact CZ-CE1 3.98Å; L148-Y361 CarbonylContact C-O 3.52Å; L148-Y361 PolarHBondContact O-N 3.22Å; P150-Y361 VanDerWaalsContact CA-CD2 3.48Å; P150-Y361 HydrophobicContact CB-CD2 3.68Å; P150-Y361 HydrophobicContact CB-CE2 3.83Å; P150-Y361 HydrophobicContact CB-CG 4.49Å; P150-Y361 HydrophobicContact CG-CD2 4.48Å; R154-Y361 HydrophobicContact CG-CE1 4.39Å; K359-Y361 VanDerWaalsContact C-CD2 3.49Å; K359-Y361 HydrophobicContact CB-CD2 4.22Å; K359-Y361 HydrophobicContact CB-CE1 4.4Å; K359-Y361 HydrophobicContact CB-CE2 3.21Å; K359-Y361 WeakPolarHBondContact CB-OH 3.36Å; K359-Y361 WeakPolarHBondContact CD-OH 3.24Å; K359-Y361 WeakPolarHBondContact O-CD2 3.14Å; K359-Y361 WeakPolarHBondContact O-CE2 3.41Å
362	Y	48.4	Very low	52	Low	5 Å²	5	61.9 Å²	61.9	2%	0.02	31%	0.309	C	S	.	.			trans	-129.9	143.1	170.9	-166.5	-86	0	0	0	109.4	I50 F86 I99 E115 V145 L148	I50-Y362 WeakPolarHBondContact CG2-O 3.16Å; F86-Y362 AromaticContact CD1-CD1 3.66Å; F86-Y362 HydrophobicContact CD1-CD1 3.66Å; F86-Y362 HydrophobicContact CD1-CE1 4.14Å; F86-Y362 AromaticContact CE1-CD1 3.4Å; F86-Y362 HydrophobicContact CE1-CD1 3.4Å; F86-Y362 VanDerWaalsContact CE1-CD1 3.4Å; F86-Y362 AromaticContact CE1-CE1 3.62Å; F86-Y362 HydrophobicContact CE1-CE1 3.62Å; I99-Y362 HydrophobicContact CB-CD2 4.03Å; I99-Y362 HydrophobicContact CB-CE2 4.36Å; I99-Y362 HydrophobicContact CB-CG 4.35Å; I99-Y362 HydrophobicContact CG1-CD2 3.85Å; I99-Y362 HydrophobicContact CG1-CG 4.22Å; I99-Y362 HydrophobicContact CG2-CD1 4.04Å; I99-Y362 HydrophobicContact CG2-CD2 3.93Å; I99-Y362 HydrophobicContact CG2-CE1 4.43Å; I99-Y362 HydrophobicContact CG2-CE2 4.32Å; I99-Y362 HydrophobicContact CG2-CG 3.78Å; E115-Y362 PolarHBondContact OE1-OH 3.1Å; V145-Y362 HydrophobicContact CG2-CD2 4.38Å; V145-Y362 HydrophobicContact CG2-CE2 3.38Å; V145-Y362 WeakPolarHBondContact CG2-OH 3.36Å; L148-Y362 HydrophobicContact CD1-CD2 4.31Å; L148-Y362 HydrophobicContact CD1-CE2 4.14Å; L148-Y362 HydrophobicContact CG-CD2 4.41Å
363	C	45.1	Very low	51.5	Low	29 Å²	29	56.8 Å²	56.8	20%	0.196	30%	0.295	C	S	.	.			trans	-114.3	0	174.5	-80	0	0	0	0	111.8	D151 K196	D151-C363 PolarHBondContact OD2-SG 3.33Å; D151-C363 VanDerWaalsContact OD2-SG 3.41Å; K196-C363 VanDerWaalsContact O-CB 3.23Å; K196-C363 WeakPolarHBondContact O-CB 3.26Å; K196-C363 PolarHBondContact O-SG 2.77Å; K196-C363 VanDerWaalsContact O-SG 3.36Å

Retrieved 363 of 363 residues in 391.8 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).