A0A077ZB81_TRITR Loading...

Ribosomal protein mitochondrial putative mitocho ndrial ribosomal protein

AlphaFold DB , UniProt , Accession A0A077ZB81, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 463 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	29.7	Very low	252 Å²	252	178.3 Å²	178.3	100%	1.241	85%	0.848	S	S	*	*				0	66.7	0	-67.8	179	-149.1	0	0	109.7
2	R	27.3	Very low	29.8	Very low	227 Å²	227	178.8 Å²	178.8	86%	0.857	84%	0.844	S	S	*	*			trans	-148.6	147.5	-176.9	-91.7	-171.8	176.1	-176.3	-0.9	109
3	H	26.2	Very low	29.7	Very low	159 Å²	159	184.2 Å²	184.2	74%	0.736	85%	0.852	S	S	*	*			trans	73.1	125.8	159.2	-77.7	-74.2	0	0	0	120.9
4	L	33.9	Very low	29.9	Very low	145 Å²	145	186.8 Å²	186.8	76%	0.759	85%	0.85	S	S	*	*				162.5	113.8	107	-98.3	113.8	0	0	0	110.2
5	L	34	Very low	30.1	Very low	140 Å²	140	182.4 Å²	182.4	73%	0.733	85%	0.846	S	S	*	*				75.8	107.6	105	-80.9	160.8	0	0	0	114.5
6	W	24.9	Very low	30.5	Very low	228 Å²	228	177.3 Å²	177.3	86%	0.864	84%	0.837	S	S	*	*				54.3	87.5	82.9	-133.4	70.4	0	0	0	113.8
7	K	28.8	Very low	30.6	Very low	188 Å²	188	177.7 Å²	177.7	82%	0.817	84%	0.839	S	S	*	*			trans	157.5	112.9	143.5	-93.5	177.3	177.6	-179.2	0	110.1
8	Q	31.2	Very low	30.8	Very low	199 Å²	199	176.3 Å²	176.3	93%	0.93	84%	0.837	S	S	*	*			trans	-156.8	98	131.1	-112.9	175.3	5.5	0	0	109.4
9	C	26.2	Very low	30.8	Very low	112 Å²	112	177.6 Å²	177.6	76%	0.757	84%	0.839	S	S	*	*			trans	-66.8	152	160.6	-81.5	0	0	0	0	109.9
10	Q	27.6	Very low	30.9	Very low	183 Å²	183	172 Å²	172	86%	0.855	83%	0.831	S	S	*	*			trans	65.2	107	159.5	-67.8	178	-17.6	0	0	115.3
11	V	32.2	Very low	30.8	Very low	128 Å²	128	168.9 Å²	168.9	78%	0.776	83%	0.826	S	S	*	*			trans	-169	128.7	138.3	146.2	0	0	0	0	108
12	F	30.7	Very low	30.7	Very low	184 Å²	184	168.1 Å²	168.1	81%	0.807	81%	0.809	S	S	*	*			trans	69.6	80.2	173.8	-68.1	-66.9	0	0	0	120.4
13	R	29	Very low	30.9	Very low	250 Å²	250	166 Å²	166	94%	0.943	81%	0.807	S	S	*	*			trans	-75.8	111.2	139.4	-84.4	-173.6	177	-174.5	-0.7	108.5
14	R	32.9	Very low	31.2	Very low	220 Å²	220	168.3 Å²	168.3	83%	0.83	82%	0.815	S	S	*	*			trans	-88	128.8	154.1	-76.7	-176.7	177.3	-176.2	-0.8	107.5	S16	R14-S16 PolarHBondContact O-N 3.3Å
15	P	31.9	Very low	31.5	Very low	121 Å²	121	165.7 Å²	165.7	79%	0.786	81%	0.808	S	S	*	*			trans	-77.4	100.9	161.8	30.3	-24.2	0	0	0	106.6	E17	P15-E17 PolarHBondContact O-N 3Å
16	S	37.9	Very low	31.7	Very low	100 Å²	100	163.6 Å²	163.6	70%	0.699	81%	0.806	S	S	*	*			trans	-73.8	104.9	161.8	55.8	0	0	0	0	107.3	R14 N18	R14-S16 PolarHBondContact O-N 3.3Å; S16-N18 VanDerWaalsContact C-N 3.33Å; S16-N18 PolarHBondContact O-N 3.42Å
17	E	32	Very low	32.6	Very low	185 Å²	185	161.4 Å²	161.4	86%	0.864	80%	0.803	S	S	*	*			trans	-44.6	97.1	157	-66.4	170.2	153.6	0	0	109.1	P15	P15-E17 PolarHBondContact O-N 3Å
18	N	33.1	Very low	33.2	Very low	152 Å²	152	158.8 Å²	158.8	81%	0.813	80%	0.798	S	S	*	*			trans	-164.4	47.5	163.1	-93.1	-26.5	0	0	0	108.6	S16 G20	S16-N18 VanDerWaalsContact C-N 3.33Å; S16-N18 PolarHBondContact O-N 3.42Å; N18-G20 PolarHBondContact O-N 3.29Å; N18-G20 VanDerWaalsContact O-N 3.13Å
19	F	31.6	Very low	33.8	Very low	201 Å²	201	156.7 Å²	156.7	88%	0.882	79%	0.793	S	S	*	*			trans	-80.5	76.2	155.5	-97.5	-88.3	0	0	0	107.5	C21	F19-C21 PolarHBondContact O-N 3.14Å
20	G	32.4	Very low	34.9	Very low	65 Å²	65	155.3 Å²	155.3	67%	0.67	78%	0.78	S	S	*	*			trans	-69	81.4	160.8	0	0	0	0	0	108.4	N18 R22	N18-G20 PolarHBondContact O-N 3.29Å; N18-G20 VanDerWaalsContact O-N 3.13Å; G20-R22 PolarHBondContact O-N 3.41Å
21	C	29.9	Very low	35.9	Very low	107 Å²	107	153.6 Å²	153.6	72%	0.723	78%	0.782	S	S	*	*			trans	-61.5	83	160.7	-74	0	0	0	0	108.2	F19 F23	F19-C21 PolarHBondContact O-N 3.14Å; C21-F23 PolarHBondContact O-N 3.46Å
22	R	30.7	Very low	37.2	Very low	237 Å²	237	148.8 Å²	148.8	89%	0.894	76%	0.759	S	S	*	*			trans	-84	66.6	160	-74.3	-172.9	178.7	-178.6	0.3	108.5	G20	G20-R22 PolarHBondContact O-N 3.41Å
23	F	32.8	Very low	38.7	Very low	183 Å²	183	146.2 Å²	146.2	80%	0.803	76%	0.761	S	S	*	*			trans	-135.1	138.5	161.5	-92.7	-86	0	0	0	106.3	C21	C21-F23 PolarHBondContact O-N 3.46Å
24	F	32.3	Very low	40.1	Very low	207 Å²	207	142.8 Å²	142.8	91%	0.908	76%	0.755	S	S	*	*			trans	88.3	77.1	-161.3	-56.9	-70.7	0	0	0	114.7
25	S	39	Very low	41.5	Very low	89 Å²	89	139.9 Å²	139.9	62%	0.622	75%	0.745	S	S	*	*			trans	-57.6	128.6	148.1	56.9	0	0	0	0	109	F27	S25-F27 PolarHBondContact O-N 3.12Å
26	S	38.8	Very low	43.2	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	73%	0.727	S	S	*	*			trans	-51.7	118.9	164.6	51.8	0	0	0	0	109.9	D28	S26-D28 PolarHBondContact O-N 3.5Å
27	F	43	Very low	45	Very low	182 Å²	182	140.9 Å²	140.9	80%	0.798	74%	0.735	S	S	*	*			trans	-81.1	19.5	172.8	-94.1	-83.5	0	0	0	113.1	S25	S25-F27 PolarHBondContact O-N 3.12Å
28	D	41.9	Very low	47.2	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	73%	0.728	S	S	*	*	S	Bend	trans	-110.2	107.4	178.7	-63.2	-37.9	0	0	0	108.3	S26	S26-D28 PolarHBondContact O-N 3.5Å
29	N	44.3	Very low	49.3	Very low	155 Å²	155	136.8 Å²	136.8	83%	0.829	72%	0.715	S	S	*	*			trans	86.9	72.3	180	-53.1	-40.7	0	0	0	116.9
30	V	49.5	Very low	51.5	Low	82 Å²	82	134.4 Å²	134.4	50%	0.497	71%	0.71	S	S	.	*			trans	-105.3	71.1	158.7	-168.2	0	0	0	0	109.4	Y35	V30-Y35 VanDerWaalsContact O-CB 3.32Å; V30-Y35 WeakPolarHBondContact O-CB 3.48Å
31	V	48.7	Very low	53.7	Low	147 Å²	147	139.9 Å²	139.9	89%	0.891	71%	0.712	S	S	*	*			trans	-96.4	62.1	155.7	-168	0	0	0	0	106.9
32	G	58.6	Low	56	Low	28 Å²	28	139.9 Å²	139.9	29%	0.289	71%	0.71	S	S	.	*	S	Bend	trans	-97.7	160.8	168	0	0	0	0	0	109.7	H34 Y35	G32-H34 PolarHBondContact O-N 3.31Å; G32-Y35 PolarHBondContact O-N 3.38Å
33	P	63.2	Low	58.3	Low	130 Å²	130	134.2 Å²	134.2	84%	0.844	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-2	179.7	25.8	-35	0	0	0	114.9
34	H	57.3	Low	60.3	Low	178 Å²	178	131.4 Å²	131.4	82%	0.824	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-3.4	178.2	-57.8	-60.1	0	0	0	113.8	G32	G32-H34 PolarHBondContact O-N 3.31Å
35	Y	62.8	Low	61.9	Low	158 Å²	158	128.7 Å²	128.7	62%	0.62	69%	0.69	S	S	*	*			trans	-82.1	118.4	174.5	-174.5	-96.6	0	0	0	110	V30 G32	V30-Y35 VanDerWaalsContact O-CB 3.32Å; V30-Y35 WeakPolarHBondContact O-CB 3.48Å; G32-Y35 PolarHBondContact O-N 3.38Å
36	S	67.4	Low	63.5	Low	58 Å²	58	135.3 Å²	135.3	41%	0.406	70%	0.701	S	S	.	*			trans	-121.4	129.9	176	162.9	0	0	0	0	107.9	K38	S36-K38 WeakPolarHBondContact CB-O 3.45Å; S36-K38 CarbonylContact O-C 3.54Å; S36-K38 PolarHBondContact O-N 2.69Å; S36-K38 VanDerWaalsContact O-N 3.09Å; S36-K38 PolarHBondContact OG-N 2.86Å; S36-K38 PolarHBondContact OG-O 2.69Å
37	E	74.8	Confident	65.2	Low	185 Å²	185	133.1 Å²	133.1	86%	0.864	68%	0.683	S	S	*	*	S	Bend	trans	-54.9	-28.3	178.1	-82.9	-174.7	154.6	0	0	112.9
38	K	79.1	Confident	67	Low	168 Å²	168	127.5 Å²	127.5	73%	0.73	66%	0.664	S	S	*	*	S	Bend	trans	-104.1	116.8	169.7	-67.6	-176.8	-178.6	178.8	0	108.7	S36 I40	S36-K38 WeakPolarHBondContact CB-O 3.45Å; S36-K38 CarbonylContact O-C 3.54Å; S36-K38 PolarHBondContact O-N 2.69Å; S36-K38 VanDerWaalsContact O-N 3.09Å; S36-K38 PolarHBondContact OG-N 2.86Å; S36-K38 PolarHBondContact OG-O 2.69Å; K38-I40 PolarHBondContact O-N 2.83Å
39	P	76.5	Confident	68.8	Low	83 Å²	83	126.3 Å²	126.3	54%	0.539	66%	0.664	S	S	.	*			trans	-63.5	113.5	175.6	25.6	-32.3	0	0	0	109.2	Y41	P39-Y41 HydrophobicContact CB-CD2 4.22Å; P39-Y41 HydrophobicContact CB-CE1 4.49Å; P39-Y41 HydrophobicContact CB-CE2 3.62Å; P39-Y41 HydrophobicContact CG-CD2 4.48Å; P39-Y41 HydrophobicContact CG-CE2 3.65Å; P39-Y41 PolarHBondContact O-N 2.75Å
40	I	79.3	Confident	70.6	Confident	150 Å²	150	120.6 Å²	120.6	77%	0.769	63%	0.632	S	S	*	*			trans	-86.5	94.7	170.7	-57.9	174.8	0	0	0	106.1	K38	K38-I40 PolarHBondContact O-N 2.83Å
41	Y	78.2	Confident	72.2	Confident	181 Å²	181	119.5 Å²	119.5	71%	0.71	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-71.8	137.8	174.3	-65.5	-79.1	0	0	0	109.7	P39	P39-Y41 HydrophobicContact CB-CD2 4.22Å; P39-Y41 HydrophobicContact CB-CE1 4.49Å; P39-Y41 HydrophobicContact CB-CE2 3.62Å; P39-Y41 HydrophobicContact CG-CD2 4.48Å; P39-Y41 HydrophobicContact CG-CE2 3.65Å; P39-Y41 PolarHBondContact O-N 2.75Å
42	P	77.4	Confident	73.9	Confident	106 Å²	106	114.3 Å²	114.3	69%	0.688	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.5	170.1	26.8	-32.7	0	0	0	109.2	V44	P42-V44 PolarHBondContact O-N 3.38Å
43	P	78.7	Confident	75.1	Confident	118 Å²	118	116.8 Å²	116.8	77%	0.766	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-57.9	137	178.9	22.3	-31.9	0	0	0	110.6	K45	P43-K45 PolarHBondContact O-N 2.94Å; P43-K45 VanDerWaalsContact O-N 3.09Å
44	V	76.1	Confident	76.1	Confident	124 Å²	124	112.1 Å²	112.1	75%	0.752	56%	0.556	S	S	*	*			trans	-66.4	110.8	178.7	179.5	0	0	0	0	108.7	P42 R46	P42-V44 PolarHBondContact O-N 3.38Å; V44-R46 HydrophobicContact CG1-CG 4.36Å; V44-R46 PolarHBondContact O-N 3.42Å
45	K	65.8	Low	77.6	Confident	150 Å²	150	108.1 Å²	108.1	65%	0.652	54%	0.539	S	S	*	.			trans	-71.1	108.5	174.7	-70.5	-179.5	164.1	-122.3	0	109.7	P43 E52	P43-K45 PolarHBondContact O-N 2.94Å; P43-K45 VanDerWaalsContact O-N 3.09Å; K45-E52 WeakPolarHBondContact CD-OE1 3.37Å; K45-E52 WeakPolarHBondContact CE-OE1 3.22Å; K45-E52 VanDerWaalsContact NZ-CD 3.28Å; K45-E52 IonicContact NZ-OE1 2.68Å; K45-E52 PolarHBondContact NZ-OE1 3.11Å; K45-E52 IonicContact NZ-OE2 2.75Å; K45-E52 PolarHBondContact NZ-OE2 2.9Å
46	R	72.1	Confident	78.8	Confident	229 Å²	229	106.4 Å²	106.4	86%	0.864	54%	0.535	S	S	*	.			trans	-97.2	-11.8	172.3	-67.8	-173.5	178.5	-176.6	-0.2	113.1	V44	V44-R46 HydrophobicContact CG1-CG 4.36Å; V44-R46 PolarHBondContact O-N 3.42Å
47	T	74.2	Confident	79.8	Confident	50 Å²	50	106.7 Å²	106.7	31%	0.307	53%	0.528	S	S	.	.	S	Bend	trans	-92.2	141.4	-170.4	43.8	0	0	0	0	111.2	E51 E52 M55	T47-E51 VanDerWaalsContact CA-OE2 3.26Å; T47-E51 WeakPolarHBondContact CA-OE2 3.3Å; T47-E52 WeakPolarHBondContact OG1-CG 3.29Å; T47-E52 PolarHBondContact OG1-OE1 3.35Å; T47-M55 HydrophobicContact CG2-CE 3.38Å
48	T	82	Confident	80.5	Confident	64 Å²	64	98.6 Å²	98.6	39%	0.393	49%	0.493	S	S	.	.			trans	-66.3	154.2	172.7	63.5	0	0	0	0	110.2	K50 E51 E52	T48-K50 PolarHBondContact O-N 3.41Å; T48-K50 VanDerWaalsContact O-N 3.12Å; T48-E51 WeakPolarHBondContact CG2-OE1 3.49Å; T48-E51 PolarHBondContact N-OE2 3.48Å; T48-E51 WeakPolarHBondContact O-CB 3.45Å; T48-E51 PolarHBondContact O-N 3.18Å; T48-E51 VanDerWaalsContact OG1-CG 3.28Å; T48-E51 WeakPolarHBondContact OG1-CG 3.19Å; T48-E51 PolarHBondContact OG1-N 3.11Å; T48-E51 PolarHBondContact OG1-OE1 3.32Å; T48-E52 PolarHBondContact O-N 3.16Å
49	P	79.2	Confident	81.1	Confident	108 Å²	108	96.8 Å²	96.8	70%	0.701	49%	0.487	S	S	*	.	H	α-helix	trans	-53.2	-35.1	175.8	-27.1	34.7	0	0	0	112.8	E52 E53	P49-E52 PolarHBondContact O-N 3.36Å; P49-E53 PolarHBondContact O-N 2.94Å
50	K	80.9	Confident	81.9	Confident	36 Å²	36	97.1 Å²	97.1	16%	0.157	48%	0.483	C	S	.	.	H	α-helix	trans	-62.4	-49.2	174.9	-175	-179.2	-170.2	-166.9	0	112.2	T48 E53 R54 W236 E238	T48-K50 PolarHBondContact O-N 3.41Å; T48-K50 VanDerWaalsContact O-N 3.12Å; K50-E53 PolarHBondContact O-N 2.91Å; K50-R54 WeakPolarHBondContact O-CG 3.34Å; K50-R54 PolarHBondContact O-N 3.35Å; K50-W236 HydrophobicContact CB-CZ2 4.31Å; K50-W236 HydrophobicContact CD-CD2 4.02Å; K50-W236 HydrophobicContact CD-CE3 4.2Å; K50-W236 HydrophobicContact CD-CG 4.25Å; K50-W236 HydrophobicContact CG-CD2 3.88Å; K50-W236 HydrophobicContact CG-CE3 3.82Å; K50-W236 HydrophobicContact CG-CH2 4.04Å; K50-W236 HydrophobicContact CG-CZ2 4.1Å; K50-W236 HydrophobicContact CG-CZ3 3.89Å; K50-W236 PolarHBondContact NZ-O 3.13Å; K50-E238 WeakPolarHBondContact CE-OE1 3.45Å; K50-E238 IonicContact NZ-OE1 3.53Å; K50-E238 PolarHBondContact NZ-OE1 3.38Å; K50-E238 VanDerWaalsContact NZ-OE1 3.17Å
51	E	83.7	Confident	82.5	Confident	59 Å²	59	90 Å²	90	28%	0.276	45%	0.446	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.5	-75.3	153.2	-141.8	0	0	112.2	T47 T48 E53 R54 M55	T47-E51 VanDerWaalsContact CA-OE2 3.26Å; T47-E51 WeakPolarHBondContact CA-OE2 3.3Å; T48-E51 WeakPolarHBondContact CG2-OE1 3.49Å; T48-E51 PolarHBondContact N-OE2 3.48Å; T48-E51 WeakPolarHBondContact O-CB 3.45Å; T48-E51 PolarHBondContact O-N 3.18Å; T48-E51 VanDerWaalsContact OG1-CG 3.28Å; T48-E51 WeakPolarHBondContact OG1-CG 3.19Å; T48-E51 PolarHBondContact OG1-N 3.11Å; T48-E51 PolarHBondContact OG1-OE1 3.32Å; E51-E53 VanDerWaalsContact C-N 3.3Å; E51-E53 PolarHBondContact O-N 2.68Å; E51-R54 PolarHBondContact O-N 2.84Å; E51-M55 HydrophobicContact CB-CE 3.88Å; E51-M55 WeakPolarHBondContact O-CB 3.34Å; E51-M55 WeakPolarHBondContact O-CG 3.33Å; E51-M55 PolarHBondContact O-N 2.89Å
52	E	84.2	Confident	83.1	Confident	38 Å²	38	86.5 Å²	86.5	18%	0.178	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-41.6	176.4	-73.2	-170.3	-177.8	0	0	111.6	K45 T47 T48 P49 M55 K56	K45-E52 WeakPolarHBondContact CD-OE1 3.37Å; K45-E52 WeakPolarHBondContact CE-OE1 3.22Å; K45-E52 VanDerWaalsContact NZ-CD 3.28Å; K45-E52 IonicContact NZ-OE1 2.68Å; K45-E52 PolarHBondContact NZ-OE1 3.11Å; K45-E52 IonicContact NZ-OE2 2.75Å; K45-E52 PolarHBondContact NZ-OE2 2.9Å; T47-E52 WeakPolarHBondContact OG1-CG 3.29Å; T47-E52 PolarHBondContact OG1-OE1 3.35Å; T48-E52 PolarHBondContact O-N 3.16Å; P49-E52 PolarHBondContact O-N 3.36Å; E52-M55 PolarHBondContact O-N 3.42Å; E52-K56 VanDerWaalsContact O-CG 3.31Å; E52-K56 WeakPolarHBondContact O-CG 3.47Å; E52-K56 PolarHBondContact O-N 3.27Å; E52-K56 VanDerWaalsContact O-N 3.07Å
53	E	84	Confident	83.9	Confident	79 Å²	79	86.3 Å²	86.3	37%	0.369	43%	0.428	S	S	.	.	H	α-helix	trans	-66.8	-44.5	177.9	-167.3	172	167.3	0	0	111.6	P49 K50 E51 M55 K56 Y57 Y233 W236	P49-E53 PolarHBondContact O-N 2.94Å; K50-E53 PolarHBondContact O-N 2.91Å; E51-E53 VanDerWaalsContact C-N 3.3Å; E51-E53 PolarHBondContact O-N 2.68Å; E53-M55 PolarHBondContact O-N 2.89Å; E53-K56 PolarHBondContact O-N 3.33Å; E53-Y57 WeakPolarHBondContact O-CB 3.31Å; E53-Y57 PolarHBondContact O-N 3.06Å; E53-Y233 VanDerWaalsContact OE1-CZ 3.25Å; E53-Y233 PolarHBondContact OE1-OH 3.29Å; E53-W236 HydrophobicContact CB-CH2 4.25Å; E53-W236 HydrophobicContact CG-CH2 4.33Å; E53-W236 WeakPolarHBondContact OE2-CH2 3.41Å
54	R	85.7	Confident	84.5	Confident	32 Å²	32	82.7 Å²	82.7	12%	0.121	40%	0.402	C	S	.	.	H	α-helix	trans	-59.3	-43.8	174.2	-70.7	168.7	177.8	-177.3	-9.1	112	K50 E51 Y57 A58 E238 I391 D392	K50-R54 WeakPolarHBondContact O-CG 3.34Å; K50-R54 PolarHBondContact O-N 3.35Å; E51-R54 PolarHBondContact O-N 2.84Å; R54-Y57 PolarHBondContact O-N 3.11Å; R54-A58 WeakPolarHBondContact O-CB 3.32Å; R54-A58 PolarHBondContact O-N 3.15Å; R54-E238 IonicContact CZ-OE1 2.81Å; R54-E238 IonicContact NE-OE1 2.76Å; R54-E238 PolarHBondContact NE-OE1 2.86Å; R54-E238 IonicContact NH2-OE1 3.91Å; R54-E238 PolarHBondContact NH2-OE1 2.95Å; R54-I391 PolarHBondContact NH2-O 2.85Å; R54-D392 IonicContact NH1-OD2 2.89Å
55	M	86.8	Confident	85.2	Confident	95 Å²	95	78.3 Å²	78.3	47%	0.468	38%	0.376	S	S	.	.	H	α-helix	trans	-64.2	-45.9	179.1	-74.6	-176.5	-130	0	0	112.1	T47 E51 E52 E53 Y57 A58 E59	T47-M55 HydrophobicContact CG2-CE 3.38Å; E51-M55 HydrophobicContact CB-CE 3.88Å; E51-M55 WeakPolarHBondContact O-CB 3.34Å; E51-M55 WeakPolarHBondContact O-CG 3.33Å; E51-M55 PolarHBondContact O-N 2.89Å; E52-M55 PolarHBondContact O-N 3.42Å; E53-M55 PolarHBondContact O-N 2.89Å; M55-Y57 VanDerWaalsContact C-N 3.29Å; M55-Y57 PolarHBondContact O-N 3.41Å; M55-A58 WeakPolarHBondContact O-CB 3.13Å; M55-A58 PolarHBondContact O-N 3Å; M55-E59 WeakPolarHBondContact O-CG 3.46Å; M55-E59 PolarHBondContact O-N 3.43Å
56	K	88.7	Confident	86.5	Confident	122 Å²	122	71.6 Å²	71.6	53%	0.53	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-43.1	175.5	-71.9	170.3	-173.7	169.6	0	111.3	E52 E53 E59 I60	E52-K56 VanDerWaalsContact O-CG 3.31Å; E52-K56 WeakPolarHBondContact O-CG 3.47Å; E52-K56 PolarHBondContact O-N 3.27Å; E52-K56 VanDerWaalsContact O-N 3.07Å; E53-K56 PolarHBondContact O-N 3.33Å; K56-E59 PolarHBondContact O-N 2.79Å; K56-I60 VanDerWaalsContact O-CG1 3.3Å; K56-I60 WeakPolarHBondContact O-CG1 3.34Å; K56-I60 PolarHBondContact O-N 2.9Å; K56-I60 VanDerWaalsContact O-N 3.1Å
57	Y	88.3	Confident	87.4	Confident	64 Å²	64	60.7 Å²	60.7	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-65	-40.5	177.7	-165.8	-97.2	0	0	0	111.8	E53 R54 M55 E59 I60 V61 M73 V74 Y359	E53-Y57 WeakPolarHBondContact O-CB 3.31Å; E53-Y57 PolarHBondContact O-N 3.06Å; R54-Y57 PolarHBondContact O-N 3.11Å; M55-Y57 VanDerWaalsContact C-N 3.29Å; M55-Y57 PolarHBondContact O-N 3.41Å; Y57-E59 VanDerWaalsContact C-N 3.34Å; Y57-E59 PolarHBondContact O-N 3.38Å; Y57-I60 PolarHBondContact O-N 3.12Å; Y57-V61 HydrophobicContact CD1-CG2 3.89Å; Y57-V61 HydrophobicContact CE1-CG2 3.62Å; Y57-V61 VanDerWaalsContact O-CG2 3.31Å; Y57-V61 WeakPolarHBondContact O-CG2 3.46Å; Y57-V61 PolarHBondContact O-N 2.62Å; Y57-M73 HydrophobicContact CD2-CE 4.15Å; Y57-M73 HydrophobicContact CE2-CE 3.55Å; Y57-M73 HydrophobicContact CE2-CG 4.47Å; Y57-M73 WeakPolarHBondContact OH-CG 3.3Å; Y57-M73 PolarHBondContact OH-O 2.91Å; Y57-V74 HydrophobicContact CE1-CG1 4.29Å; Y57-Y359 HydrophobicContact CD1-CD1 4.17Å; Y57-Y359 AromaticContact CD1-CD2 3.73Å; Y57-Y359 HydrophobicContact CD1-CD2 3.73Å; Y57-Y359 AromaticContact CD1-CE1 3.89Å; Y57-Y359 HydrophobicContact CD1-CE1 3.89Å; Y57-Y359 AromaticContact CD1-CE2 3.43Å; Y57-Y359 HydrophobicContact CD1-CE2 3.43Å; Y57-Y359 VanDerWaalsContact CD1-CE2 3.43Å; Y57-Y359 HydrophobicContact CD1-CG 4.08Å; Y57-Y359 AromaticContact CD1-CZ 3.5Å; Y57-Y359 VanDerWaalsContact CD1-CZ 3.5Å; Y57-Y359 AromaticContact CE1-CD2 3.83Å; Y57-Y359 HydrophobicContact CE1-CD2 3.83Å; Y57-Y359 AromaticContact CE1-CE2 3.29Å; Y57-Y359 HydrophobicContact CE1-CE2 3.29Å; Y57-Y359 AromaticContact CE1-CZ 3.68Å
58	A	90	Very high	88.2	Confident	15 Å²	15	60.9 Å²	60.9	12%	0.124	31%	0.309	C	S	.	.	H	α-helix	trans	-58.6	-43.7	174.7	0	0	0	0	0	112.1	R54 M55 V61 K62 N360	R54-A58 WeakPolarHBondContact O-CB 3.32Å; R54-A58 PolarHBondContact O-N 3.15Å; M55-A58 WeakPolarHBondContact O-CB 3.13Å; M55-A58 PolarHBondContact O-N 3Å; A58-V61 PolarHBondContact O-N 2.97Å; A58-K62 WeakPolarHBondContact O-CB 3.44Å; A58-K62 PolarHBondContact O-N 3.29Å; A58-N360 PolarHBondContact O-ND2 3.49Å
59	E	92.2	Very high	88.6	Confident	130 Å²	130	61.8 Å²	61.8	61%	0.607	31%	0.309	S	S	*	.	H	α-helix	trans	-61.7	-45.9	175.8	-72.7	178	171.2	0	0	111.7	M55 K56 Y57 V61 K62 D63	M55-E59 WeakPolarHBondContact O-CG 3.46Å; M55-E59 PolarHBondContact O-N 3.43Å; K56-E59 PolarHBondContact O-N 2.79Å; Y57-E59 VanDerWaalsContact C-N 3.34Å; Y57-E59 PolarHBondContact O-N 3.38Å; E59-V61 PolarHBondContact O-N 2.93Å; E59-K62 WeakPolarHBondContact O-CB 3.1Å; E59-K62 PolarHBondContact O-N 3.25Å; E59-D63 PolarHBondContact O-N 3.21Å
60	I	92	Very high	89.3	Confident	90 Å²	90	56.7 Å²	56.7	46%	0.462	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-47.1	177.8	-61.5	162.5	0	0	0	110.7	K56 Y57 K62 D63 L64 M73	K56-I60 VanDerWaalsContact O-CG1 3.3Å; K56-I60 WeakPolarHBondContact O-CG1 3.34Å; K56-I60 PolarHBondContact O-N 2.9Å; K56-I60 VanDerWaalsContact O-N 3.1Å; Y57-I60 PolarHBondContact O-N 3.12Å; I60-K62 VanDerWaalsContact C-N 3.32Å; I60-K62 PolarHBondContact O-N 2.73Å; I60-D63 PolarHBondContact O-N 3.28Å; I60-D63 VanDerWaalsContact O-N 3.16Å; I60-L64 PolarHBondContact O-N 2.98Å; I60-M73 HydrophobicContact CB-CE 4.09Å; I60-M73 HydrophobicContact CG2-CE 3.37Å; I60-M73 HydrophobicContact CG2-SD 3.86Å
61	V	92.2	Very high	89.8	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-39.6	177.9	173.4	0	0	0	0	110.9	Y57 A58 E59 D63 L64 K70 M73 V74 T357	Y57-V61 HydrophobicContact CD1-CG2 3.89Å; Y57-V61 HydrophobicContact CE1-CG2 3.62Å; Y57-V61 VanDerWaalsContact O-CG2 3.31Å; Y57-V61 WeakPolarHBondContact O-CG2 3.46Å; Y57-V61 PolarHBondContact O-N 2.62Å; A58-V61 PolarHBondContact O-N 2.97Å; E59-V61 PolarHBondContact O-N 2.93Å; V61-D63 PolarHBondContact O-N 2.86Å; V61-L64 PolarHBondContact O-N 3.09Å; V61-K70 HydrophobicContact CG1-CB 4.29Å; V61-K70 HydrophobicContact CG1-CG 4.21Å; V61-K70 WeakPolarHBondContact O-CG 3.5Å; V61-K70 PolarHBondContact O-NZ 2.97Å; V61-M73 HydrophobicContact CG2-CE 4.38Å; V61-M73 HydrophobicContact CG2-CG 3.98Å; V61-M73 HydrophobicContact CG2-SD 3.79Å; V61-V74 HydrophobicContact CB-CG1 4.29Å; V61-V74 HydrophobicContact CG1-CG1 3.64Å; V61-V74 HydrophobicContact CG2-CG1 3.61Å; V61-T357 HydrophobicContact CG1-CG2 3.82Å
62	K	91.8	Very high	89.9	Confident	107 Å²	107	59.5 Å²	59.5	47%	0.465	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-34.8	176.6	-174.8	175.8	179.4	178.7	0	111	A58 E59 I60 L64 K70 Y450	A58-K62 WeakPolarHBondContact O-CB 3.44Å; A58-K62 PolarHBondContact O-N 3.29Å; E59-K62 WeakPolarHBondContact O-CB 3.1Å; E59-K62 PolarHBondContact O-N 3.25Å; I60-K62 VanDerWaalsContact C-N 3.32Å; I60-K62 PolarHBondContact O-N 2.73Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 2.9Å; K62-K70 PolarHBondContact O-NZ 3.38Å; K62-Y450 HydrophobicContact CD-CD1 4.4Å; K62-Y450 HydrophobicContact CG-CD1 4.19Å
63	D	92.6	Very high	90.1	Very high	103 Å²	103	60.1 Å²	60.1	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-74	-21.4	-178.4	-88.8	-28.8	0	0	0	115.4	E59 I60 V61 K452	E59-D63 PolarHBondContact O-N 3.21Å; I60-D63 PolarHBondContact O-N 3.28Å; I60-D63 VanDerWaalsContact O-N 3.16Å; V61-D63 PolarHBondContact O-N 2.86Å; D63-K452 VanDerWaalsContact CA-NZ 3.35Å; D63-K452 WeakPolarHBondContact O-CE 3.45Å; D63-K452 PolarHBondContact O-NZ 2.92Å; D63-K452 IonicContact OD1-NZ 3.62Å; D63-K452 PolarHBondContact OD1-NZ 3.41Å
64	L	91.8	Very high	90.2	Very high	41 Å²	41	56.6 Å²	56.6	22%	0.215	28%	0.277	C	S	.	.			trans	-60.8	136.9	173.8	-64.9	174.9	0	0	0	111.5	I60 V61 K62 E69 K70 M73	I60-L64 PolarHBondContact O-N 2.98Å; V61-L64 PolarHBondContact O-N 3.09Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 2.9Å; L64-E69 HydrophobicContact CB-CB 4.31Å; L64-E69 HydrophobicContact CD1-CB 4.25Å; L64-E69 HydrophobicContact CD2-CB 4.48Å; L64-K70 HydrophobicContact CB-CG 3.83Å; L64-K70 HydrophobicContact CD1-CG 4.31Å; L64-K70 WeakPolarHBondContact O-CE 3.45Å; L64-K70 PolarHBondContact O-NZ 2.86Å; L64-M73 HydrophobicContact CD1-CB 3.77Å; L64-M73 HydrophobicContact CD1-CG 4.28Å; L64-M73 HydrophobicContact CD1-SD 3.59Å; L64-M73 VanDerWaalsContact CD1-SD 3.59Å; L64-M73 HydrophobicContact CG-SD 4.4Å
65	P	91.3	Very high	90	Very high	32 Å²	32	55.3 Å²	55.3	21%	0.208	27%	0.272	C	S	.	.	S	Bend	trans	-78.2	-36.8	-170.6	25.2	-29.9	0	0	0	114.3	E69 K452 E453	P65-E69 WeakPolarHBondContact CD-OE2 3.4Å; P65-E69 WeakPolarHBondContact CG-OE2 3.49Å; P65-K452 HydrophobicContact CB-CB 4.25Å; P65-K452 PolarHBondContact O-N 3.13Å; P65-K452 VanDerWaalsContact O-N 3.08Å; P65-E453 HydrophobicContact CB-CB 4.49Å; P65-E453 HydrophobicContact CB-CG 3.99Å; P65-E453 PolarHBondContact O-N 2.82Å
66	T	92.1	Very high	89.1	Confident	9 Å²	9	52.7 Å²	52.7	6%	0.055	26%	0.263	C	S	.	.	S	Bend	trans	-113.3	157.4	-171.9	71.3	0	0	0	0	113.4	E69 K70 E453	T66-E69 PolarHBondContact N-OE2 3.22Å; T66-E69 VanDerWaalsContact N-OE2 3.12Å; T66-E69 VanDerWaalsContact OG1-CG 3.29Å; T66-E69 WeakPolarHBondContact OG1-CG 3.32Å; T66-E69 PolarHBondContact OG1-N 3.29Å; T66-E69 PolarHBondContact OG1-OE2 3.04Å; T66-K70 WeakPolarHBondContact O-CG 3.14Å; T66-K70 PolarHBondContact O-N 3.44Å; T66-E453 HydrophobicContact CG2-CB 4.39Å
67	A	92.6	Very high	87.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-42.8	176.9	0	0	0	0	0	113.2	E69 K70 I71 Y300 F353 L451	A67-E69 VanDerWaalsContact C-N 3.33Å; A67-E69 PolarHBondContact O-N 2.86Å; A67-K70 WeakPolarHBondContact O-CB 3.49Å; A67-K70 PolarHBondContact O-N 3.3Å; A67-K70 VanDerWaalsContact O-N 3.16Å; A67-I71 VanDerWaalsContact O-CG1 3.28Å; A67-I71 WeakPolarHBondContact O-CG1 3.24Å; A67-I71 PolarHBondContact O-N 3.23Å; A67-Y300 HydrophobicContact CB-CD2 3.85Å; A67-Y300 HydrophobicContact CB-CE2 3.43Å; A67-Y300 VanDerWaalsContact CB-CE2 3.43Å; A67-F353 VanDerWaalsContact CB-O 3.3Å; A67-F353 WeakPolarHBondContact CB-O 3.08Å; A67-L451 HydrophobicContact CB-CD1 4.33Å; A67-L451 HydrophobicContact CB-CD2 3.99Å; A67-L451 VanDerWaalsContact N-CD2 3.32Å
68	P	91.2	Very high	86.3	Confident	55 Å²	55	49.5 Å²	49.5	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-59	-39.9	177.6	-26.9	36.9	0	0	0	113.6	I71 H72 Y300	P68-I71 PolarHBondContact O-N 2.9Å; P68-H72 VanDerWaalsContact O-CB 3.31Å; P68-H72 WeakPolarHBondContact O-CB 3.2Å; P68-H72 PolarHBondContact O-N 3.38Å; P68-Y300 HydrophobicContact CG-CD1 3.63Å; P68-Y300 HydrophobicContact CG-CE1 4.18Å; P68-Y300 HydrophobicContact CG-CG 3.85Å
69	E	90.1	Very high	84.9	Confident	83 Å²	83	54.6 Å²	54.6	39%	0.388	27%	0.27	S	S	.	.	H	α-helix	trans	-65.8	-42.7	175.8	-68.7	164.7	141.7	0	0	111.5	L64 P65 T66 A67 H72 M73	L64-E69 HydrophobicContact CB-CB 4.31Å; L64-E69 HydrophobicContact CD1-CB 4.25Å; L64-E69 HydrophobicContact CD2-CB 4.48Å; P65-E69 WeakPolarHBondContact CD-OE2 3.4Å; P65-E69 WeakPolarHBondContact CG-OE2 3.49Å; T66-E69 PolarHBondContact N-OE2 3.22Å; T66-E69 VanDerWaalsContact N-OE2 3.12Å; T66-E69 VanDerWaalsContact OG1-CG 3.29Å; T66-E69 WeakPolarHBondContact OG1-CG 3.32Å; T66-E69 PolarHBondContact OG1-N 3.29Å; T66-E69 PolarHBondContact OG1-OE2 3.04Å; A67-E69 VanDerWaalsContact C-N 3.33Å; A67-E69 PolarHBondContact O-N 2.86Å; E69-H72 PolarHBondContact O-N 3.22Å; E69-M73 WeakPolarHBondContact O-CB 3.26Å; E69-M73 PolarHBondContact O-N 3.27Å
70	K	92.4	Very high	83.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-48.7	174.7	-70	175.3	-166.6	-76.5	0	111	V61 K62 L64 T66 A67 M73 V74 T357 Y450 L451	V61-K70 HydrophobicContact CG1-CB 4.29Å; V61-K70 HydrophobicContact CG1-CG 4.21Å; V61-K70 WeakPolarHBondContact O-CG 3.5Å; V61-K70 PolarHBondContact O-NZ 2.97Å; K62-K70 PolarHBondContact O-NZ 3.38Å; L64-K70 HydrophobicContact CB-CG 3.83Å; L64-K70 HydrophobicContact CD1-CG 4.31Å; L64-K70 WeakPolarHBondContact O-CE 3.45Å; L64-K70 PolarHBondContact O-NZ 2.86Å; T66-K70 WeakPolarHBondContact O-CG 3.14Å; T66-K70 PolarHBondContact O-N 3.44Å; A67-K70 WeakPolarHBondContact O-CB 3.49Å; A67-K70 PolarHBondContact O-N 3.3Å; A67-K70 VanDerWaalsContact O-N 3.16Å; K70-M73 PolarHBondContact O-N 2.72Å; K70-V74 WeakPolarHBondContact O-CG1 3.25Å; K70-V74 WeakPolarHBondContact O-CG2 3.27Å; K70-V74 PolarHBondContact O-N 3.37Å; K70-T357 HydrophobicContact CB-CG2 4.24Å; K70-Y450 WeakPolarHBondContact CE-O 3.47Å; K70-Y450 PolarHBondContact NZ-O 3.23Å; K70-L451 HydrophobicContact CD-CD2 4.09Å
71	I	91.4	Very high	82.2	Confident	23 Å²	23	52.5 Å²	52.5	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-49.5	178.1	-69	165.9	0	0	0	110.4	A67 P68 M73 V74 S75 M294 H352 F353	A67-I71 VanDerWaalsContact O-CG1 3.28Å; A67-I71 WeakPolarHBondContact O-CG1 3.24Å; A67-I71 PolarHBondContact O-N 3.23Å; P68-I71 PolarHBondContact O-N 2.9Å; I71-M73 PolarHBondContact O-N 2.85Å; I71-V74 PolarHBondContact O-N 3.24Å; I71-S75 WeakPolarHBondContact O-CA 3.33Å; I71-S75 VanDerWaalsContact O-CB 3.27Å; I71-S75 WeakPolarHBondContact O-CB 3.31Å; I71-S75 PolarHBondContact O-N 3.1Å; I71-M294 HydrophobicContact CD1-CB 4.43Å; I71-M294 HydrophobicContact CD1-CG 4.39Å; I71-M294 HydrophobicContact CG2-CB 3.83Å; I71-H352 HydrophobicContact CD1-CB 3.97Å; I71-H352 HydrophobicContact CG1-CB 3.88Å; I71-F353 HydrophobicContact CD1-CD2 3.64Å; I71-F353 HydrophobicContact CD1-CE2 3.7Å
72	H	87.1	Confident	81.3	Confident	132 Å²	132	55.3 Å²	55.3	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-59.8	-38.1	179.5	-177.2	63.9	0	0	0	111.9	P68 E69 P76	P68-H72 VanDerWaalsContact O-CB 3.31Å; P68-H72 WeakPolarHBondContact O-CB 3.2Å; P68-H72 PolarHBondContact O-N 3.38Å; E69-H72 PolarHBondContact O-N 3.22Å; H72-P76 WeakPolarHBondContact O-CA 3.41Å
73	M	86.8	Confident	80.7	Confident	50 Å²	50	54.8 Å²	54.8	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-48.7	177.2	-175.4	162.7	-167.7	0	0	112	Y57 I60 V61 L64 E69 K70 I71 P76	Y57-M73 HydrophobicContact CD2-CE 4.15Å; Y57-M73 HydrophobicContact CE2-CE 3.55Å; Y57-M73 HydrophobicContact CE2-CG 4.47Å; Y57-M73 WeakPolarHBondContact OH-CG 3.3Å; Y57-M73 PolarHBondContact OH-O 2.91Å; I60-M73 HydrophobicContact CB-CE 4.09Å; I60-M73 HydrophobicContact CG2-CE 3.37Å; I60-M73 HydrophobicContact CG2-SD 3.86Å; V61-M73 HydrophobicContact CG2-CE 4.38Å; V61-M73 HydrophobicContact CG2-CG 3.98Å; V61-M73 HydrophobicContact CG2-SD 3.79Å; L64-M73 HydrophobicContact CD1-CB 3.77Å; L64-M73 HydrophobicContact CD1-CG 4.28Å; L64-M73 HydrophobicContact CD1-SD 3.59Å; L64-M73 VanDerWaalsContact CD1-SD 3.59Å; L64-M73 HydrophobicContact CG-SD 4.4Å; E69-M73 WeakPolarHBondContact O-CB 3.26Å; E69-M73 PolarHBondContact O-N 3.27Å; K70-M73 PolarHBondContact O-N 2.72Å; I71-M73 PolarHBondContact O-N 2.85Å; M73-P76 WeakPolarHBondContact O-CD 3.4Å
74	V	87.6	Confident	80.1	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.03	29%	0.285	C	S	.	.	H	α-helix	trans	-82.9	-18	-173.1	-57	0	0	0	0	114.5	Y57 V61 K70 I71 P76 F208 T357 Q358 Y359	Y57-V74 HydrophobicContact CE1-CG1 4.29Å; V61-V74 HydrophobicContact CB-CG1 4.29Å; V61-V74 HydrophobicContact CG1-CG1 3.64Å; V61-V74 HydrophobicContact CG2-CG1 3.61Å; K70-V74 WeakPolarHBondContact O-CG1 3.25Å; K70-V74 WeakPolarHBondContact O-CG2 3.27Å; K70-V74 PolarHBondContact O-N 3.37Å; I71-V74 PolarHBondContact O-N 3.24Å; V74-P76 WeakPolarHBondContact O-CD 3.43Å; V74-F208 WeakPolarHBondContact O-CE1 3.12Å; V74-T357 HydrophobicContact CG1-CG2 3.97Å; V74-T357 HydrophobicContact CG2-CG2 4.12Å; V74-Q358 PolarHBondContact O-NE2 3.33Å; V74-Q358 VanDerWaalsContact O-NE2 3.17Å; V74-Y359 HydrophobicContact CB-CE2 4.36Å; V74-Y359 HydrophobicContact CG1-CD2 3.94Å; V74-Y359 HydrophobicContact CG1-CE2 4.1Å
75	S	82	Confident	79.6	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.035	29%	0.286	C	S	.	.	S	Bend	trans	-121.4	60.2	175.8	-53.2	0	0	0	0	109.2	I71 D77 F208	I71-S75 WeakPolarHBondContact O-CA 3.33Å; I71-S75 VanDerWaalsContact O-CB 3.27Å; I71-S75 WeakPolarHBondContact O-CB 3.31Å; I71-S75 PolarHBondContact O-N 3.1Å; S75-D77 PolarHBondContact O-N 3.44Å; S75-F208 WeakPolarHBondContact OG-CD1 3.39Å
76	P	66.6	Low	79	Confident	40 Å²	40	57.9 Å²	57.9	26%	0.26	31%	0.305	S	S	.	.			trans	-63.1	115.3	-172.3	26	-32.8	0	0	0	109.7	H72 M73 V74 E78	H72-P76 WeakPolarHBondContact O-CA 3.41Å; M73-P76 WeakPolarHBondContact O-CD 3.4Å; V74-P76 WeakPolarHBondContact O-CD 3.43Å; P76-E78 HydrophobicContact CB-CG 4.48Å; P76-E78 PolarHBondContact O-N 2.91Å
77	D	61	Low	78.7	Confident	62 Å²	62	65.5 Å²	65.5	33%	0.332	33%	0.333	S	S	.	.			trans	-85.1	98.8	171.8	179.6	33.5	0	0	0	108.7	S75 L291	S75-D77 PolarHBondContact O-N 3.44Å; D77-L291 WeakPolarHBondContact OD1-CD2 3.32Å; D77-L291 VanDerWaalsContact OD2-CD2 3.24Å; D77-L291 WeakPolarHBondContact OD2-CD2 3.3Å
78	E	57.5	Low	78.2	Confident	58 Å²	58	73.2 Å²	73.2	27%	0.271	36%	0.362	S	S	.	.			trans	-107	94.8	179.2	-70.1	-178	165.5	0	0	109.6	P76 I97 P99	P76-E78 HydrophobicContact CB-CG 4.48Å; P76-E78 PolarHBondContact O-N 2.91Å; E78-I97 WeakPolarHBondContact OE1-CB 3.05Å; E78-I97 WeakPolarHBondContact OE2-CB 3.28Å; E78-I97 WeakPolarHBondContact OE2-CG2 3.46Å; E78-P99 HydrophobicContact CB-CB 4.01Å; E78-P99 WeakPolarHBondContact O-CB 3.41Å; E78-P99 WeakPolarHBondContact O-CG 3.41Å
79	R	60.3	Low	77.7	Confident	121 Å²	121	72.6 Å²	72.6	46%	0.457	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-52.3	152.8	178	63	165.6	-179.7	71.5	1.5	112.2	W81 E85	R79-W81 PolarHBondContact O-N 3.15Å; R79-E85 IonicContact CZ-OE1 3.75Å; R79-E85 IonicContact CZ-OE2 3.11Å; R79-E85 IonicContact NH1-OE1 3.36Å; R79-E85 IonicContact NH1-OE2 3.47Å; R79-E85 PolarHBondContact NH1-OE2 3.45Å; R79-E85 IonicContact NH2-OE1 3.56Å; R79-E85 PolarHBondContact NH2-OE1 3.16Å; R79-E85 IonicContact NH2-OE2 2.69Å; R79-E85 PolarHBondContact NH2-OE2 3.21Å
80	P	60.3	Low	77.3	Confident	105 Å²	105	72.6 Å²	72.6	68%	0.682	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-51.3	140.5	171.6	-23.2	32.4	0	0	0	110.9	T82	P80-T82 PolarHBondContact O-N 3Å
81	W	67.4	Low	76.5	Confident	72 Å²	72	78.7 Å²	78.7	27%	0.273	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-62	131.5	177.6	-58.6	9.3	0	0	0	109.3	R79 E85 K86 H89 L96	R79-W81 PolarHBondContact O-N 3.15Å; W81-E85 HydrophobicContact CB-CB 4.23Å; W81-K86 HydrophobicContact CB-CD 4.39Å; W81-K86 HydrophobicContact CB-CG 3.71Å; W81-K86 HydrophobicContact CD2-CG 4.43Å; W81-K86 HydrophobicContact CE3-CG 3.82Å; W81-K86 HydrophobicContact CG-CG 4.5Å; W81-K86 WeakPolarHBondContact O-CE 3.22Å; W81-H89 HydrophobicContact CZ3-CB 4.2Å; W81-L96 HydrophobicContact CD2-CB 3.88Å; W81-L96 HydrophobicContact CD2-CD1 3.56Å; W81-L96 HydrophobicContact CD2-CG 4.38Å; W81-L96 HydrophobicContact CE3-CB 4.44Å; W81-L96 HydrophobicContact CE3-CD1 3.64Å; W81-L96 HydrophobicContact CG-CB 4.47Å; W81-L96 HydrophobicContact CG-CD1 4.03Å; W81-L96 HydrophobicContact CH2-CB 3.96Å; W81-L96 HydrophobicContact CH2-CD1 4.35Å; W81-L96 HydrophobicContact CZ2-CB 3.35Å; W81-L96 HydrophobicContact CZ2-CD1 4.32Å; W81-L96 HydrophobicContact CZ2-CG 4.43Å; W81-L96 WeakPolarHBondContact CZ2-O 3.3Å; W81-L96 HydrophobicContact CZ3-CB 4.46Å; W81-L96 HydrophobicContact CZ3-CD1 4.02Å; W81-L96 VanDerWaalsContact NE1-CB 3.34Å
82	T	73	Confident	75.9	Confident	59 Å²	59	87 Å²	87	36%	0.362	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-61.9	156.2	171.8	62.7	0	0	0	0	110.3	P80 A84 E85 K86	P80-T82 PolarHBondContact O-N 3Å; T82-A84 PolarHBondContact O-N 3.3Å; T82-A84 VanDerWaalsContact O-N 3.14Å; T82-E85 WeakPolarHBondContact CB-OE2 3.33Å; T82-E85 WeakPolarHBondContact CG2-OE2 3.48Å; T82-E85 PolarHBondContact N-OE2 3.42Å; T82-E85 PolarHBondContact O-N 3.25Å; T82-E85 VanDerWaalsContact O-N 3.09Å; T82-E85 WeakPolarHBondContact OG1-CB 3.32Å; T82-E85 VanDerWaalsContact OG1-CD 3.23Å; T82-E85 VanDerWaalsContact OG1-CG 3.28Å; T82-E85 WeakPolarHBondContact OG1-CG 3.4Å; T82-E85 PolarHBondContact OG1-N 3.39Å; T82-E85 VanDerWaalsContact OG1-N 3.12Å; T82-E85 PolarHBondContact OG1-OE2 3.41Å; T82-K86 PolarHBondContact O-N 2.95Å
83	S	79	Confident	75.2	Confident	96 Å²	96	84.9 Å²	84.9	67%	0.671	41%	0.412	S	S	*	.	H	α-helix	trans	-55.6	-31.1	174	-53.7	0	0	0	0	112.6	R87	S83-R87 VanDerWaalsContact O-CB 3.28Å; S83-R87 WeakPolarHBondContact O-CB 3.42Å; S83-R87 PolarHBondContact O-N 3.03Å
84	A	80.7	Confident	74	Confident	50 Å²	50	90 Å²	90	41%	0.413	44%	0.439	S	S	.	.	H	α-helix	trans	-70.3	-47.7	175.4	0	0	0	0	0	111.5	T82 K86 R87 W88	T82-A84 PolarHBondContact O-N 3.3Å; T82-A84 VanDerWaalsContact O-N 3.14Å; A84-K86 PolarHBondContact O-N 3.01Å; A84-R87 WeakPolarHBondContact O-CB 3.24Å; A84-R87 PolarHBondContact O-N 3.34Å; A84-R87 VanDerWaalsContact O-N 3.09Å; A84-W88 WeakPolarHBondContact O-CB 3.43Å; A84-W88 PolarHBondContact O-N 3.25Å
85	E	80.7	Confident	72.7	Confident	53 Å²	53	94.3 Å²	94.3	25%	0.248	47%	0.467	C	S	.	.	H	α-helix	trans	-60.3	-46.5	177.2	-75.3	158.4	158.2	0	0	111.5	R79 W81 T82 R87 W88 H89 L96	R79-E85 IonicContact CZ-OE1 3.75Å; R79-E85 IonicContact CZ-OE2 3.11Å; R79-E85 IonicContact NH1-OE1 3.36Å; R79-E85 IonicContact NH1-OE2 3.47Å; R79-E85 PolarHBondContact NH1-OE2 3.45Å; R79-E85 IonicContact NH2-OE1 3.56Å; R79-E85 PolarHBondContact NH2-OE1 3.16Å; R79-E85 IonicContact NH2-OE2 2.69Å; R79-E85 PolarHBondContact NH2-OE2 3.21Å; W81-E85 HydrophobicContact CB-CB 4.23Å; T82-E85 WeakPolarHBondContact CB-OE2 3.33Å; T82-E85 WeakPolarHBondContact CG2-OE2 3.48Å; T82-E85 PolarHBondContact N-OE2 3.42Å; T82-E85 PolarHBondContact O-N 3.25Å; T82-E85 VanDerWaalsContact O-N 3.09Å; T82-E85 WeakPolarHBondContact OG1-CB 3.32Å; T82-E85 VanDerWaalsContact OG1-CD 3.23Å; T82-E85 VanDerWaalsContact OG1-CG 3.28Å; T82-E85 WeakPolarHBondContact OG1-CG 3.4Å; T82-E85 PolarHBondContact OG1-N 3.39Å; T82-E85 VanDerWaalsContact OG1-N 3.12Å; T82-E85 PolarHBondContact OG1-OE2 3.41Å; E85-R87 PolarHBondContact O-N 2.96Å; E85-W88 PolarHBondContact O-N 2.91Å; E85-H89 WeakPolarHBondContact O-CB 3.3Å; E85-H89 PolarHBondContact O-N 2.78Å; E85-L96 HydrophobicContact CB-CD1 3.89Å; E85-L96 HydrophobicContact CG-CD1 4.35Å
86	K	79.9	Confident	71.7	Confident	138 Å²	138	97 Å²	97	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-57.6	-36.1	174.6	-68.3	-178.7	-178.4	-179.4	0	112.6	W81 T82 A84	W81-K86 HydrophobicContact CB-CD 4.39Å; W81-K86 HydrophobicContact CB-CG 3.71Å; W81-K86 HydrophobicContact CD2-CG 4.43Å; W81-K86 HydrophobicContact CE3-CG 3.82Å; W81-K86 HydrophobicContact CG-CG 4.5Å; W81-K86 WeakPolarHBondContact O-CE 3.22Å; T82-K86 PolarHBondContact O-N 2.95Å; A84-K86 PolarHBondContact O-N 3.01Å
87	R	84.8	Confident	71.3	Confident	169 Å²	169	100.5 Å²	100.5	64%	0.638	50%	0.496	S	S	*	.	H	α-helix	trans	-75.7	-36.7	-179.5	-175.5	180	-63.9	164.5	0.8	112.7	S83 A84 E85 R90	S83-R87 VanDerWaalsContact O-CB 3.28Å; S83-R87 WeakPolarHBondContact O-CB 3.42Å; S83-R87 PolarHBondContact O-N 3.03Å; A84-R87 WeakPolarHBondContact O-CB 3.24Å; A84-R87 PolarHBondContact O-N 3.34Å; A84-R87 VanDerWaalsContact O-N 3.09Å; E85-R87 PolarHBondContact O-N 2.96Å; R87-R90 PolarHBondContact O-NH1 3.16Å
88	W	82.9	Confident	71	Confident	162 Å²	162	103.5 Å²	103.5	61%	0.614	51%	0.508	S	S	*	.	H	α-helix	trans	-104.4	-13.5	-170.2	-62.9	117.7	0	0	0	114.2	A84 E85 R90	A84-W88 WeakPolarHBondContact O-CB 3.43Å; A84-W88 PolarHBondContact O-N 3.25Å; E85-W88 PolarHBondContact O-N 2.91Å; W88-R90 PolarHBondContact O-NH1 3.3Å
89	H	79.8	Confident	71.2	Confident	42 Å²	42	102.7 Å²	102.7	19%	0.194	51%	0.508	C	S	.	.			trans	-61.2	140.8	171.6	-168.9	-90.2	0	0	0	110	W81 E85 L94 L96	W81-H89 HydrophobicContact CZ3-CB 4.2Å; E85-H89 WeakPolarHBondContact O-CB 3.3Å; E85-H89 PolarHBondContact O-N 2.78Å; H89-L94 PolarHBondContact NE2-O 3.49Å; H89-L96 HydrophobicContact CB-CD1 4.39Å
90	R	81.6	Confident	71.8	Confident	83 Å²	83	99.3 Å²	99.3	31%	0.313	50%	0.495	S	S	.	.			trans	-130.9	150.8	-177	-63.7	-70.2	179.3	-92.5	0.5	108.9	R87 W88 W92 M93	R87-R90 PolarHBondContact O-NH1 3.16Å; W88-R90 PolarHBondContact O-NH1 3.3Å; R90-W92 HydrophobicContact CB-CD2 3.64Å; R90-W92 VanDerWaalsContact CB-CE2 3.45Å; R90-W92 HydrophobicContact CB-CE3 3.77Å; R90-W92 HydrophobicContact CB-CG 4.4Å; R90-W92 HydrophobicContact CB-CH2 3.65Å; R90-W92 HydrophobicContact CB-CZ2 3.48Å; R90-W92 VanDerWaalsContact CB-CZ2 3.48Å; R90-W92 HydrophobicContact CB-CZ3 3.78Å; R90-W92 HydrophobicContact CG-CH2 3.54Å; R90-W92 HydrophobicContact CG-CZ2 3.41Å; R90-W92 VanDerWaalsContact CG-CZ2 3.41Å; R90-W92 HydrophobicContact CG-CZ3 4.13Å; R90-W92 PolarHBondContact O-N 2.87Å; R90-M93 HydrophobicContact CB-CE 4.25Å; R90-M93 HydrophobicContact CB-CG 4.14Å; R90-M93 HydrophobicContact CB-SD 4.11Å; R90-M93 HydrophobicContact CG-CE 4.02Å; R90-M93 HydrophobicContact CG-SD 4.32Å; R90-M93 WeakPolarHBondContact O-CB 3.34Å; R90-M93 PolarHBondContact O-N 3.37Å
91	P	75.7	Confident	72.7	Confident	127 Å²	127	100.6 Å²	100.6	83%	0.825	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.4	-176.4	-26.2	34.8	0	0	0	115.5
92	W	78.3	Confident	73.7	Confident	198 Å²	198	97.2 Å²	97.2	75%	0.75	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-12	176.5	63.8	81.6	0	0	0	113.8	R90	R90-W92 HydrophobicContact CB-CD2 3.64Å; R90-W92 VanDerWaalsContact CB-CE2 3.45Å; R90-W92 HydrophobicContact CB-CE3 3.77Å; R90-W92 HydrophobicContact CB-CG 4.4Å; R90-W92 HydrophobicContact CB-CH2 3.65Å; R90-W92 HydrophobicContact CB-CZ2 3.48Å; R90-W92 VanDerWaalsContact CB-CZ2 3.48Å; R90-W92 HydrophobicContact CB-CZ3 3.78Å; R90-W92 HydrophobicContact CG-CH2 3.54Å; R90-W92 HydrophobicContact CG-CZ2 3.41Å; R90-W92 VanDerWaalsContact CG-CZ2 3.41Å; R90-W92 HydrophobicContact CG-CZ3 4.13Å; R90-W92 PolarHBondContact O-N 2.87Å
93	M	74.1	Confident	74.6	Confident	87 Å²	87	94.4 Å²	94.4	43%	0.429	46%	0.457	S	S	.	.	S	Bend	trans	-75.9	146.7	171	-64.4	175	178.3	0	0	107.9	R90	R90-M93 HydrophobicContact CB-CE 4.25Å; R90-M93 HydrophobicContact CB-CG 4.14Å; R90-M93 HydrophobicContact CB-SD 4.11Å; R90-M93 HydrophobicContact CG-CE 4.02Å; R90-M93 HydrophobicContact CG-SD 4.32Å; R90-M93 WeakPolarHBondContact O-CB 3.34Å; R90-M93 PolarHBondContact O-N 3.37Å
94	L	60.9	Low	75.3	Confident	157 Å²	157	93.6 Å²	93.6	82%	0.822	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-46.2	128.2	170.7	-86.1	158	0	0	0	108.5	H89 L96	H89-L94 PolarHBondContact NE2-O 3.49Å; L94-L96 PolarHBondContact O-N 2.89Å; L94-L96 VanDerWaalsContact O-N 3.12Å
95	P	60.7	Low	75.8	Confident	97 Å²	97	91.3 Å²	91.3	63%	0.63	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-53.5	125.2	175.8	-21.6	31.9	0	0	0	107.6	I97	P95-I97 PolarHBondContact O-N 2.85Å; P95-I97 VanDerWaalsContact O-N 3.16Å
96	L	60.8	Low	76.2	Confident	61 Å²	61	89.4 Å²	89.4	32%	0.319	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-60.8	121.1	162.4	-71.7	163.3	0	0	0	104.5	W81 E85 H89 L94 E98	W81-L96 HydrophobicContact CD2-CB 3.88Å; W81-L96 HydrophobicContact CD2-CD1 3.56Å; W81-L96 HydrophobicContact CD2-CG 4.38Å; W81-L96 HydrophobicContact CE3-CB 4.44Å; W81-L96 HydrophobicContact CE3-CD1 3.64Å; W81-L96 HydrophobicContact CG-CB 4.47Å; W81-L96 HydrophobicContact CG-CD1 4.03Å; W81-L96 HydrophobicContact CH2-CB 3.96Å; W81-L96 HydrophobicContact CH2-CD1 4.35Å; W81-L96 HydrophobicContact CZ2-CB 3.35Å; W81-L96 HydrophobicContact CZ2-CD1 4.32Å; W81-L96 HydrophobicContact CZ2-CG 4.43Å; W81-L96 WeakPolarHBondContact CZ2-O 3.3Å; W81-L96 HydrophobicContact CZ3-CB 4.46Å; W81-L96 HydrophobicContact CZ3-CD1 4.02Å; W81-L96 VanDerWaalsContact NE1-CB 3.34Å; E85-L96 HydrophobicContact CB-CD1 3.89Å; E85-L96 HydrophobicContact CG-CD1 4.35Å; H89-L96 HydrophobicContact CB-CD1 4.39Å; L94-L96 PolarHBondContact O-N 2.89Å; L94-L96 VanDerWaalsContact O-N 3.12Å; L96-E98 PolarHBondContact O-N 2.84Å
97	I	57.1	Low	76.6	Confident	113 Å²	113	83.8 Å²	83.8	58%	0.579	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-66.2	137.1	-175.5	-61.1	167	0	0	0	106.8	E78 P95	E78-I97 WeakPolarHBondContact OE1-CB 3.05Å; E78-I97 WeakPolarHBondContact OE2-CB 3.28Å; E78-I97 WeakPolarHBondContact OE2-CG2 3.46Å; P95-I97 PolarHBondContact O-N 2.85Å; P95-I97 VanDerWaalsContact O-N 3.16Å
98	E	56.1	Low	76.6	Confident	126 Å²	126	76.6 Å²	76.6	59%	0.589	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-74.6	126.4	172.9	-84.4	-170.6	167.4	0	0	108	L96 R100 R227	L96-E98 PolarHBondContact O-N 2.84Å; E98-R100 PolarHBondContact O-N 3.1Å; E98-R227 IonicContact OE2-CZ 3.17Å; E98-R227 IonicContact OE2-NH2 3.92Å; E98-R227 PolarHBondContact OE2-NH2 3.5Å
99	P	60.6	Low	76.9	Confident	40 Å²	40	68.9 Å²	68.9	26%	0.26	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-50.3	133.3	-177	8.8	-23	0	0	0	112	E78 R101	E78-P99 HydrophobicContact CB-CB 4.01Å; E78-P99 WeakPolarHBondContact O-CB 3.41Å; E78-P99 WeakPolarHBondContact O-CG 3.41Å; P99-R101 PolarHBondContact O-N 2.7Å
100	R	72.8	Confident	77.3	Confident	50 Å²	50	69.1 Å²	69.1	19%	0.189	34%	0.341	C	S	.	.			trans	-68.7	104.4	166.7	-168.3	-177.4	-57.5	-168.8	8.4	107.6	E98 A240	E98-R100 PolarHBondContact O-N 3.1Å; R100-A240 HydrophobicContact CG-CB 4.02Å
101	R	80.2	Confident	77.6	Confident	133 Å²	133	66.4 Å²	66.4	50%	0.502	34%	0.337	S	S	.	.			trans	-66.3	147.7	169.9	-66	177.4	171.9	-150.3	-4.7	109.2	P99 T229 G230 I287	P99-R101 PolarHBondContact O-N 2.7Å; R101-T229 HydrophobicContact CB-CG2 3.82Å; R101-G230 WeakPolarHBondContact O-CA 3.42Å; R101-I287 HydrophobicContact CB-CG2 3.79Å; R101-I287 HydrophobicContact CG-CG2 4.15Å
102	S	89	Confident	78.2	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.007	32%	0.316	C	S	.	.			trans	-115.1	151.6	173.1	63.6	0	0	0	0	109.9	A240 S242 R288 L292	S102-A240 CarbonylContact C-O 3.59Å; S102-A240 WeakPolarHBondContact CA-O 3.21Å; S102-S242 VanDerWaalsContact OG-CB 3.3Å; S102-S242 WeakPolarHBondContact OG-CB 3.33Å; S102-S242 PolarHBondContact OG-OG 3.4Å; S102-R288 WeakPolarHBondContact O-CB 3.33Å; S102-R288 PolarHBondContact O-N 3.17Å; S102-R288 WeakPolarHBondContact OG-CB 3.36Å; S102-L292 VanDerWaalsContact OG-CD2 3.23Å; S102-L292 WeakPolarHBondContact OG-CD2 3.35Å
103	Y	91.4	Very high	78.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.6	166.7	-69.9	-72.8	0	0	0	109.3	V105 T229 L239 A240 F241 S242 P280 E281 L285 I287	Y103-V105 PolarHBondContact O-N 3.26Å; Y103-T229 WeakPolarHBondContact CE2-O 3.35Å; Y103-T229 WeakPolarHBondContact OH-CB 3.41Å; Y103-T229 PolarHBondContact OH-O 3.44Å; Y103-L239 HydrophobicContact CE2-CD1 4.23Å; Y103-A240 PolarHBondContact N-O 3.47Å; Y103-F241 HydrophobicContact CD2-CE1 4.38Å; Y103-F241 CarbonylContact O-C 3.56Å; Y103-F241 WeakPolarHBondContact O-CA 3.35Å; Y103-S242 PolarHBondContact O-N 2.65Å; Y103-P280 HydrophobicContact CD1-CB 3.76Å; Y103-P280 HydrophobicContact CD2-CB 3.79Å; Y103-P280 HydrophobicContact CD2-CG 3.73Å; Y103-P280 HydrophobicContact CE1-CB 3.86Å; Y103-P280 HydrophobicContact CE2-CB 3.85Å; Y103-P280 HydrophobicContact CE2-CG 3.64Å; Y103-P280 HydrophobicContact CG-CB 3.72Å; Y103-P280 HydrophobicContact CG-CG 4.18Å; Y103-E281 HydrophobicContact CE1-CG 3.77Å; Y103-E281 PolarHBondContact OH-OE1 3.41Å; Y103-L285 HydrophobicContact CD1-CB 4.31Å; Y103-I287 HydrophobicContact CD1-CG1 4.35Å; Y103-I287 HydrophobicContact CE1-CG1 4.09Å
104	K	92.3	Very high	79.5	Confident	78 Å²	78	56 Å²	56	34%	0.339	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	115	175.6	-174.9	178.4	179.9	176.6	0	108.9	S106 K286 R288	K104-S106 PolarHBondContact O-N 2.61Å; K104-K286 PolarHBondContact N-O 3.41Å; K104-R288 HydrophobicContact CB-CB 4.48Å
105	V	93.2	Very high	81.1	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.018	25%	0.249	C	C	.	.			trans	-78.8	101.1	167	-179.3	0	0	0	0	107	Y103 Y118 W209 F241 S242 L285 A341	Y103-V105 PolarHBondContact O-N 3.26Å; V105-Y118 HydrophobicContact CG1-CD1 4.13Å; V105-Y118 HydrophobicContact CG1-CE1 3.4Å; V105-Y118 HydrophobicContact CG1-CE2 4.27Å; V105-Y118 VanDerWaalsContact CG1-CZ 3.48Å; V105-Y118 WeakPolarHBondContact CG1-OH 3.45Å; V105-W209 HydrophobicContact CB-CH2 4.11Å; V105-W209 HydrophobicContact CG2-CH2 3.67Å; V105-W209 HydrophobicContact CG2-CZ2 3.86Å; V105-F241 HydrophobicContact CG2-CB 4.13Å; V105-F241 HydrophobicContact CG2-CD1 3.87Å; V105-F241 HydrophobicContact CG2-CG 4.39Å; V105-S242 PolarHBondContact N-O 2.92Å; V105-L285 HydrophobicContact CG2-CD2 4.25Å; V105-A341 HydrophobicContact CG1-CB 4.35Å
106	S	88.7	Confident	82.6	Confident	12 Å²	12	47.5 Å²	47.5	8%	0.084	24%	0.237	C	C	.	.			trans	-73.5	134	-175.2	-62.2	0	0	0	0	111.9	K104 P108 P109 D110 Y118	K104-S106 PolarHBondContact O-N 2.61Å; S106-P108 CarbonylContact C-O 3.59Å; S106-P108 VanDerWaalsContact CB-O 3.31Å; S106-P108 WeakPolarHBondContact CB-O 3.41Å; S106-P108 CarbonylContact O-C 3.5Å; S106-P108 VanDerWaalsContact O-O 3.08Å; S106-P109 WeakPolarHBondContact O-CA 3.44Å; S106-D110 VanDerWaalsContact CB-OD2 3.23Å; S106-D110 WeakPolarHBondContact CB-OD2 3.43Å; S106-D110 PolarHBondContact OG-OD2 3.14Å; S106-Y118 PolarHBondContact O-OH 3.27Å
107	C	87.1	Confident	84.2	Confident	21 Å²	21	44.9 Å²	44.9	14%	0.142	22%	0.223	C	C	.	.	S	Bend	trans	-125.5	108.5	172.2	-149.2	0	0	0	0	107.2	Y243 R312 A338	C107-Y243 HydrophobicContact CB-CE2 3.48Å; C107-Y243 VanDerWaalsContact CB-CE2 3.48Å; C107-Y243 WeakPolarHBondContact CB-OH 3.38Å; C107-Y243 PolarHBondContact SG-OH 3Å; C107-R312 VanDerWaalsContact C-NH2 3.3Å; C107-R312 PolarHBondContact SG-NE 2.89Å; C107-R312 VanDerWaalsContact SG-NE 3.39Å; C107-R312 PolarHBondContact SG-NH2 3.35Å; C107-A338 VanDerWaalsContact SG-CA 3.56Å; C107-A338 VanDerWaalsContact SG-CB 3.59Å
108	P	85.2	Confident	86	Confident	18 Å²	18	39.5 Å²	39.5	12%	0.117	20%	0.195	C	C	.	.	S	Bend	cis	-67	160.5	2.9	26.3	-34	0	0	0	113.6	S106 R312 D316 L317	S106-P108 CarbonylContact C-O 3.59Å; S106-P108 VanDerWaalsContact CB-O 3.31Å; S106-P108 WeakPolarHBondContact CB-O 3.41Å; S106-P108 CarbonylContact O-C 3.5Å; S106-P108 VanDerWaalsContact O-O 3.08Å; P108-R312 VanDerWaalsContact N-NH2 3.2Å; P108-D316 WeakPolarHBondContact CD-OD2 3.3Å; P108-L317 HydrophobicContact CB-CB 4.15Å; P108-L317 HydrophobicContact CB-CD1 3.38Å; P108-L317 HydrophobicContact CB-CG 4.33Å; P108-L317 HydrophobicContact CG-CD1 4.36Å
109	P	89.8	Confident	87.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.			trans	-54.1	149.5	175.5	-24.4	33.4	0	0	0	112.6	S106 A111 L114 W324	S106-P109 WeakPolarHBondContact O-CA 3.44Å; P109-A111 VanDerWaalsContact C-N 3.33Å; P109-A111 WeakPolarHBondContact CB-O 3.41Å; P109-L114 HydrophobicContact CB-CD1 4.04Å; P109-W324 WeakPolarHBondContact O-CH2 3.29Å
110	D	87.2	Confident	89.4	Confident	46 Å²	46	34.6 Å²	34.6	25%	0.246	17%	0.167	C	C	.	.	S	Bend	trans	-84.4	-5.9	178.5	-81	-47.8	0	0	0	113.5	S106 W324	S106-D110 VanDerWaalsContact CB-OD2 3.23Å; S106-D110 WeakPolarHBondContact CB-OD2 3.43Å; S106-D110 PolarHBondContact OG-OD2 3.14Å; D110-W324 WeakPolarHBondContact O-CZ2 3.45Å
111	A	88.7	Confident	90.4	Very high	27 Å²	27	32.2 Å²	32.2	22%	0.223	16%	0.158	C	C	.	.	S	Bend	trans	-151.9	163.5	175.4	0	0	0	0	0	110.4	P109 L114	P109-A111 VanDerWaalsContact C-N 3.33Å; P109-A111 WeakPolarHBondContact CB-O 3.41Å; A111-L114 HydrophobicContact CB-CD1 3.89Å; A111-L114 HydrophobicContact CB-CD2 4.45Å; A111-L114 HydrophobicContact CB-CG 4.14Å; A111-L114 WeakPolarHBondContact O-CD1 3.27Å; A111-L114 WeakPolarHBondContact O-CG 3.29Å
112	Y	87.6	Confident	91.1	Very high	100 Å²	100	26 Å²	26	39%	0.392	14%	0.135	S	C	.	.	S	Bend	trans	-79.7	169.3	168.5	62.8	-87.3	0	0	0	111.2	L114 W324 E330	Y112-L114 VanDerWaalsContact C-N 3.27Å; Y112-L114 PolarHBondContact O-N 2.85Å; Y112-W324 HydrophobicContact CD1-CB 3.94Å; Y112-W324 HydrophobicContact CD1-CD2 4.15Å; Y112-W324 HydrophobicContact CD1-CE3 4.19Å; Y112-W324 HydrophobicContact CD1-CG 4.05Å; Y112-W324 HydrophobicContact CE1-CB 4.23Å; Y112-E330 HydrophobicContact CD2-CG 4.22Å; Y112-E330 WeakPolarHBondContact CD2-OE1 2.99Å; Y112-E330 VanDerWaalsContact CE2-OE1 3.24Å; Y112-E330 WeakPolarHBondContact CE2-OE1 3.5Å
113	N	88.6	Confident	91.3	Very high	85 Å²	85	27 Å²	27	46%	0.455	14%	0.141	S	C	.	.	S	Bend	trans	60	27	-178.3	-61.7	-20.7	0	0	0	115.4
114	L	91.7	Very high	91.5	Very high	9 Å²	9	27 Å²	27	5%	0.047	14%	0.141	C	C	.	.			trans	-91.8	-6.3	178.9	-63.2	-175.2	0	0	0	114	P109 A111 Y112 P116 F117 Y118 I283	P109-L114 HydrophobicContact CB-CD1 4.04Å; A111-L114 HydrophobicContact CB-CD1 3.89Å; A111-L114 HydrophobicContact CB-CD2 4.45Å; A111-L114 HydrophobicContact CB-CG 4.14Å; A111-L114 WeakPolarHBondContact O-CD1 3.27Å; A111-L114 WeakPolarHBondContact O-CG 3.29Å; Y112-L114 VanDerWaalsContact C-N 3.27Å; Y112-L114 PolarHBondContact O-N 2.85Å; L114-P116 VanDerWaalsContact C-CD 3.48Å; L114-F117 WeakPolarHBondContact O-CB 3.37Å; L114-F117 PolarHBondContact O-N 3.23Å; L114-Y118 HydrophobicContact CB-CD2 3.96Å; L114-Y118 HydrophobicContact CB-CE2 3.86Å; L114-Y118 HydrophobicContact CD1-CE2 4.29Å; L114-Y118 VanDerWaalsContact O-CD2 3.26Å; L114-Y118 WeakPolarHBondContact O-CD2 3.48Å; L114-Y118 PolarHBondContact O-N 3.29Å; L114-I283 HydrophobicContact CD2-CB 3.8Å; L114-I283 HydrophobicContact CD2-CD1 4.35Å; L114-I283 HydrophobicContact CD2-CG2 4.23Å
115	L	94	Very high	91.6	Very high	19 Å²	19	25 Å²	25	10%	0.099	13%	0.132	C	C	.	.	H	α-helix	trans	-53	-45.4	-178.7	175.8	63.3	0	0	0	113.3	F117 Y118 K119 E333 L336 S337 I340	L115-F117 VanDerWaalsContact C-N 3.29Å; L115-F117 PolarHBondContact O-N 3.26Å; L115-Y118 PolarHBondContact O-N 3.28Å; L115-K119 HydrophobicContact CD1-CD 4.15Å; L115-K119 HydrophobicContact CD1-CG 4.16Å; L115-K119 HydrophobicContact CG-CD 4.11Å; L115-K119 WeakPolarHBondContact O-CG 3.31Å; L115-K119 PolarHBondContact O-N 3.34Å; L115-E333 HydrophobicContact CB-CB 4.09Å; L115-E333 HydrophobicContact CB-CG 4.31Å; L115-E333 HydrophobicContact CD2-CB 4.33Å; L115-E333 HydrophobicContact CD2-CG 3.94Å; L115-L336 HydrophobicContact CD1-CB 3.94Å; L115-L336 HydrophobicContact CD2-CB 4.35Å; L115-L336 HydrophobicContact CD2-CD1 3.92Å; L115-S337 WeakPolarHBondContact CA-OG 3.2Å; L115-S337 PolarHBondContact N-OG 3.37Å; L115-I340 HydrophobicContact CD1-CD1 3.56Å
116	P	93.6	Very high	91.8	Very high	56 Å²	56	26 Å²	26	36%	0.364	14%	0.139	S	C	.	.	H	α-helix	trans	-60.7	-38.8	177.7	-23.3	35.2	0	0	0	112.7	L114 K119 Y120 V276	L114-P116 VanDerWaalsContact C-CD 3.48Å; P116-K119 PolarHBondContact O-N 3.39Å; P116-Y120 PolarHBondContact O-N 2.9Å; P116-V276 HydrophobicContact CB-CB 4.34Å; P116-V276 HydrophobicContact CB-CG1 3.39Å
117	F	93.5	Very high	92.1	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-66.2	-43.7	176.6	-177	-99.3	0	0	0	111.8	L114 L115 K119 Y120 V121 F214 F241 P280 I283 L285	L114-F117 WeakPolarHBondContact O-CB 3.37Å; L114-F117 PolarHBondContact O-N 3.23Å; L115-F117 VanDerWaalsContact C-N 3.29Å; L115-F117 PolarHBondContact O-N 3.26Å; F117-K119 VanDerWaalsContact C-N 3.33Å; F117-K119 PolarHBondContact O-N 3.12Å; F117-Y120 PolarHBondContact O-N 3.09Å; F117-Y120 VanDerWaalsContact O-N 3.09Å; F117-V121 HydrophobicContact CD1-CG1 4.05Å; F117-V121 HydrophobicContact CD2-CG1 4.3Å; F117-V121 HydrophobicContact CE1-CG1 3.53Å; F117-V121 HydrophobicContact CE1-CG2 4.37Å; F117-V121 HydrophobicContact CE2-CG1 3.81Å; F117-V121 HydrophobicContact CG-CG1 4.41Å; F117-V121 HydrophobicContact CZ-CG1 3.4Å; F117-V121 VanDerWaalsContact CZ-CG1 3.4Å; F117-V121 WeakPolarHBondContact O-CG2 3.35Å; F117-V121 PolarHBondContact O-N 2.74Å; F117-F214 HydrophobicContact CE2-CE1 4.46Å; F117-F214 HydrophobicContact CE2-CZ 4.49Å; F117-F241 HydrophobicContact CE1-CE1 4.22Å; F117-F241 AromaticContact CZ-CE1 3.8Å; F117-F241 HydrophobicContact CZ-CE1 3.8Å; F117-F241 HydrophobicContact CZ-CZ 4.09Å; F117-P280 HydrophobicContact CZ-CG 4.38Å; F117-I283 HydrophobicContact CB-CD1 4.18Å; F117-I283 HydrophobicContact CD1-CD1 3.39Å; F117-I283 HydrophobicContact CD2-CD1 3.46Å; F117-I283 VanDerWaalsContact CD2-CD1 3.46Å; F117-I283 HydrophobicContact CE1-CD1 3.47Å; F117-I283 VanDerWaalsContact CE1-CD1 3.47Å; F117-I283 HydrophobicContact CE2-CD1 3.53Å; F117-I283 HydrophobicContact CG-CD1 3.38Å; F117-I283 HydrophobicContact CZ-CD1 3.53Å; F117-L285 HydrophobicContact CE1-CD1 4.18Å; F117-L285 HydrophobicContact CE1-CD2 3.83Å; F117-L285 HydrophobicContact CZ-CD2 4.36Å
118	Y	94.7	Very high	92.6	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-42.8	178	-84.7	-122.6	0	0	0	111.3	V105 S106 L114 L115 Y120 T122 S337 A341	V105-Y118 HydrophobicContact CG1-CD1 4.13Å; V105-Y118 HydrophobicContact CG1-CE1 3.4Å; V105-Y118 HydrophobicContact CG1-CE2 4.27Å; V105-Y118 VanDerWaalsContact CG1-CZ 3.48Å; V105-Y118 WeakPolarHBondContact CG1-OH 3.45Å; S106-Y118 PolarHBondContact O-OH 3.27Å; L114-Y118 HydrophobicContact CB-CD2 3.96Å; L114-Y118 HydrophobicContact CB-CE2 3.86Å; L114-Y118 HydrophobicContact CD1-CE2 4.29Å; L114-Y118 VanDerWaalsContact O-CD2 3.26Å; L114-Y118 WeakPolarHBondContact O-CD2 3.48Å; L114-Y118 PolarHBondContact O-N 3.29Å; L115-Y118 PolarHBondContact O-N 3.28Å; Y118-Y120 VanDerWaalsContact C-N 3.32Å; Y118-Y120 PolarHBondContact O-N 3.49Å; Y118-T122 WeakPolarHBondContact O-CB 3.33Å; Y118-T122 WeakPolarHBondContact O-CG2 3.45Å; Y118-T122 PolarHBondContact O-N 3.32Å; Y118-T122 PolarHBondContact O-OG1 3.47Å; Y118-S337 WeakPolarHBondContact CD1-O 3.42Å; Y118-A341 HydrophobicContact CD1-CB 3.9Å; Y118-A341 HydrophobicContact CE1-CB 3.76Å
119	K	94.6	Very high	93.1	Very high	56 Å²	56	33.2 Å²	33.2	24%	0.243	18%	0.18	C	C	.	.	H	α-helix	trans	-58.2	-44.3	172.5	-69.8	173.5	70.2	171.3	0	111.2	L115 P116 F117 T122 N123 T124 V126 V272 I340	L115-K119 HydrophobicContact CD1-CD 4.15Å; L115-K119 HydrophobicContact CD1-CG 4.16Å; L115-K119 HydrophobicContact CG-CD 4.11Å; L115-K119 WeakPolarHBondContact O-CG 3.31Å; L115-K119 PolarHBondContact O-N 3.34Å; P116-K119 PolarHBondContact O-N 3.39Å; F117-K119 VanDerWaalsContact C-N 3.33Å; F117-K119 PolarHBondContact O-N 3.12Å; K119-T122 PolarHBondContact O-OG1 3.15Å; K119-N123 CarbonylContact O-C 3.55Å; K119-N123 VanDerWaalsContact O-CA 3.28Å; K119-N123 WeakPolarHBondContact O-CA 3.34Å; K119-N123 PolarHBondContact O-N 3.36Å; K119-T124 WeakPolarHBondContact CB-O 3.41Å; K119-T124 PolarHBondContact O-N 2.94Å; K119-V126 HydrophobicContact CD-CB 4.46Å; K119-V126 HydrophobicContact CD-CG2 3.76Å; K119-V126 HydrophobicContact CG-CG2 3.8Å; K119-V272 HydrophobicContact CB-CG1 4Å; K119-I340 HydrophobicContact CG-CD1 4.11Å
120	Y	93.6	Very high	93.5	Very high	6 Å²	6	34.4 Å²	34.4	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-47	-178.8	177.9	-96.6	0	0	0	113.6	P116 F117 Y118 T122 N123 R211 G212 G213 F214 S273 V276 I277	P116-Y120 PolarHBondContact O-N 2.9Å; F117-Y120 PolarHBondContact O-N 3.09Å; F117-Y120 VanDerWaalsContact O-N 3.09Å; Y118-Y120 VanDerWaalsContact C-N 3.32Å; Y118-Y120 PolarHBondContact O-N 3.49Å; Y120-T122 VanDerWaalsContact C-N 3.26Å; Y120-T122 PolarHBondContact O-N 3.3Å; Y120-N123 PolarHBondContact O-N 3.35Å; Y120-R211 HydrophobicContact CE1-CG 4.23Å; Y120-R211 PolarHBondContact O-NE 2.66Å; Y120-G212 PolarHBondContact OH-O 2.85Å; Y120-G213 WeakPolarHBondContact OH-CA 3.47Å; Y120-F214 HydrophobicContact CD1-CZ 4.18Å; Y120-F214 HydrophobicContact CE1-CE1 4.17Å; Y120-F214 AromaticContact CE1-CE2 3.97Å; Y120-F214 HydrophobicContact CE1-CE2 3.97Å; Y120-F214 AromaticContact CE1-CZ 3.63Å; Y120-F214 HydrophobicContact CE1-CZ 3.63Å; Y120-S273 WeakPolarHBondContact CD2-O 3.3Å; Y120-V276 VanDerWaalsContact CB-CG2 3.44Å; Y120-V276 HydrophobicContact CD2-CG2 4.21Å; Y120-V276 HydrophobicContact CG-CG2 3.82Å; Y120-I277 HydrophobicContact CE1-CG1 3.92Å; Y120-I277 HydrophobicContact CE2-CD1 4.16Å; Y120-I277 HydrophobicContact CE2-CG1 3.97Å; Y120-I277 WeakPolarHBondContact OH-CD1 3.47Å
121	V	93.4	Very high	93.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.9	-23.9	-176.9	-61.8	0	0	0	0	113.4	F117 W209 F214 F241	F117-V121 HydrophobicContact CD1-CG1 4.05Å; F117-V121 HydrophobicContact CD2-CG1 4.3Å; F117-V121 HydrophobicContact CE1-CG1 3.53Å; F117-V121 HydrophobicContact CE1-CG2 4.37Å; F117-V121 HydrophobicContact CE2-CG1 3.81Å; F117-V121 HydrophobicContact CG-CG1 4.41Å; F117-V121 HydrophobicContact CZ-CG1 3.4Å; F117-V121 VanDerWaalsContact CZ-CG1 3.4Å; F117-V121 WeakPolarHBondContact O-CG2 3.35Å; F117-V121 PolarHBondContact O-N 2.74Å; V121-W209 HydrophobicContact CG2-CZ2 4.31Å; V121-W209 PolarHBondContact O-NE1 2.9Å; V121-F214 HydrophobicContact CG1-CZ 4.44Å; V121-F241 HydrophobicContact CG1-CE1 4.03Å; V121-F241 HydrophobicContact CG1-CE2 4.14Å; V121-F241 HydrophobicContact CG1-CZ 3.81Å
122	T	94.4	Very high	94.1	Very high	2 Å²	2	35 Å²	35	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-100.3	-3.5	176.3	61.6	0	0	0	0	113.4	Y118 K119 Y120 T124 I340 F344 N400	Y118-T122 WeakPolarHBondContact O-CB 3.33Å; Y118-T122 WeakPolarHBondContact O-CG2 3.45Å; Y118-T122 PolarHBondContact O-N 3.32Å; Y118-T122 PolarHBondContact O-OG1 3.47Å; K119-T122 PolarHBondContact O-OG1 3.15Å; Y120-T122 VanDerWaalsContact C-N 3.26Å; Y120-T122 PolarHBondContact O-N 3.3Å; T122-T124 VanDerWaalsContact C-N 3.28Å; T122-T124 WeakPolarHBondContact CB-OG1 3.43Å; T122-T124 PolarHBondContact O-N 3.27Å; T122-T124 WeakPolarHBondContact OG1-CB 3.39Å; T122-T124 PolarHBondContact OG1-OG1 2.85Å; T122-I340 HydrophobicContact CG2-CG2 4.25Å; T122-F344 HydrophobicContact CG2-CB 4.14Å; T122-F344 HydrophobicContact CG2-CD1 3.47Å; T122-F344 VanDerWaalsContact CG2-CD1 3.47Å; T122-F344 HydrophobicContact CG2-CD2 4.13Å; T122-F344 HydrophobicContact CG2-CE1 3.73Å; T122-F344 HydrophobicContact CG2-CE2 4.35Å; T122-F344 HydrophobicContact CG2-CG 3.64Å; T122-F344 HydrophobicContact CG2-CZ 4.14Å; T122-N400 PolarHBondContact O-ND2 2.85Å
123	N	94.2	Very high	94.3	Very high	23 Å²	23	31.9 Å²	31.9	12%	0.123	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	46.8	-171.1	-167.2	39.1	0	0	0	113	K119 Y120 L390 N400	K119-N123 CarbonylContact O-C 3.55Å; K119-N123 VanDerWaalsContact O-CA 3.28Å; K119-N123 WeakPolarHBondContact O-CA 3.34Å; K119-N123 PolarHBondContact O-N 3.36Å; Y120-N123 PolarHBondContact O-N 3.35Å; N123-L390 HydrophobicContact CB-CD2 3.61Å; N123-N400 PolarHBondContact O-N 2.8Å
124	T	95.4	Very high	94.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.8	-174.4	-56.8	0	0	0	0	112.4	K119 T122 V126 V272 I340 Y383 N400 C402	K119-T124 WeakPolarHBondContact CB-O 3.41Å; K119-T124 PolarHBondContact O-N 2.94Å; T122-T124 VanDerWaalsContact C-N 3.28Å; T122-T124 WeakPolarHBondContact CB-OG1 3.43Å; T122-T124 PolarHBondContact O-N 3.27Å; T122-T124 WeakPolarHBondContact OG1-CB 3.39Å; T122-T124 PolarHBondContact OG1-OG1 2.85Å; T124-V126 HydrophobicContact CG2-CG2 4.25Å; T124-V272 WeakPolarHBondContact O-CG2 3.49Å; T124-I340 HydrophobicContact CG2-CG2 4.33Å; T124-Y383 HydrophobicContact CG2-CE2 3.71Å; T124-Y383 PolarHBondContact OG1-OH 2.99Å; T124-N400 CarbonylContact C-O 3.56Å; T124-N400 WeakPolarHBondContact CA-O 3.01Å; T124-C402 HydrophobicContact CG2-CB 3.47Å; T124-C402 VanDerWaalsContact CG2-CB 3.47Å
125	H	95	Very high	94.6	Very high	36 Å²	36	33.2 Å²	33.2	17%	0.167	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.7	163	-168.9	75.6	0	0	0	110	N269 P399 N400 I401 C402	H125-N269 HydrophobicContact CB-CB 4.42Å; H125-N269 PolarHBondContact CD2-OD1 3.16Å; H125-P399 HydrophobicContact CB-CB 4.46Å; H125-N400 PolarHBondContact N-O 3.06Å; H125-I401 CarbonylContact O-C 3.53Å; H125-I401 WeakPolarHBondContact O-CA 3.38Å; H125-C402 PolarHBondContact O-N 2.84Å
126	V	95.9	Very high	94.4	Very high	24 Å²	24	41.4 Å²	41.4	15%	0.145	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.4	-174.6	178.9	0	0	0	0	109.1	K119 T124 I340 C402 F404	K119-V126 HydrophobicContact CD-CB 4.46Å; K119-V126 HydrophobicContact CD-CG2 3.76Å; K119-V126 HydrophobicContact CG-CG2 3.8Å; T124-V126 HydrophobicContact CG2-CG2 4.25Å; V126-I340 HydrophobicContact CG2-CD1 3.57Å; V126-I340 HydrophobicContact CG2-CG1 4.37Å; V126-C402 CarbonylContact C-O 3.32Å; V126-C402 VanDerWaalsContact CA-O 3.29Å; V126-C402 WeakPolarHBondContact CA-O 3.45Å; V126-C402 HydrophobicContact CG2-CB 4.4Å; V126-F404 HydrophobicContact CG1-CD1 3.58Å; V126-F404 HydrophobicContact CG1-CE1 3.62Å
127	I	96.3	Very high	94.4	Very high	48 Å²	48	39.9 Å²	39.9	25%	0.246	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129	-177.4	-57.8	177.5	0	0	0	108.7	I401 C402 W403 F404	I127-I401 HydrophobicContact CD1-CG2 3.68Å; I127-I401 HydrophobicContact CG1-CG2 4.21Å; I127-C402 PolarHBondContact N-O 2.95Å; I127-W403 HydrophobicContact CB-CG 4.38Å; I127-W403 HydrophobicContact CD1-CZ2 4.33Å; I127-W403 WeakPolarHBondContact O-CA 3.45Å; I127-F404 VanDerWaalsContact O-CD1 3.27Å; I127-F404 WeakPolarHBondContact O-CD1 3.47Å; I127-F404 PolarHBondContact O-N 3.47Å
128	D	96.3	Very high	94.4	Very high	129 Å²	129	46.1 Å²	46.1	69%	0.69	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.3	172	-176.2	25	0	0	0	110.5	F404	D128-F404 HydrophobicContact CB-CE1 4Å; D128-F404 HydrophobicContact CB-CZ 3.92Å
129	G	97	Very high	94.5	Very high	26 Å²	26	46.1 Å²	46.1	27%	0.268	24%	0.239	S	C	.	.	S	Bend	trans	95.5	155.9	-170.6	0	0	0	0	0	113.4	W403 F404	G129-W403 WeakPolarHBondContact O-CB 3.28Å; G129-F404 CarbonylContact C-O 3.52Å; G129-F404 VanDerWaalsContact CA-O 3.3Å; G129-F404 WeakPolarHBondContact CA-O 3.39Å; G129-F404 PolarHBondContact N-O 2.92Å
130	L	97.3	Very high	94.5	Very high	24 Å²	24	44.9 Å²	44.9	13%	0.126	24%	0.243	C	C	.	.			trans	-84	158	175.6	-64.6	179.4	0	0	0	111.2	Y134 F380 K405 F434	L130-Y134 HydrophobicContact CB-CD2 3.85Å; L130-Y134 HydrophobicContact CD1-CD2 4.43Å; L130-F380 HydrophobicContact CD2-CB 4.26Å; L130-K405 HydrophobicContact CD1-CB 4.31Å; L130-K405 HydrophobicContact CD1-CD 4.33Å; L130-K405 HydrophobicContact CD2-CB 4.06Å; L130-K405 HydrophobicContact CG-CB 3.78Å; L130-K405 HydrophobicContact CG-CD 4.38Å; L130-F434 HydrophobicContact CD1-CE1 4.33Å; L130-F434 HydrophobicContact CD1-CZ 4.15Å; L130-F434 HydrophobicContact CD2-CZ 3.94Å
131	P	96.2	Very high	94.6	Very high	7 Å²	7	48.4 Å²	48.4	5%	0.045	27%	0.273	C	S	.	.			trans	-52.2	141.7	172.1	-27.3	33.2	0	0	0	112.8	F133 Y134 F260 A382 W403	P131-F133 HydrophobicContact CB-CB 4.46Å; P131-F133 PolarHBondContact O-N 2.97Å; P131-Y134 HydrophobicContact CB-CD2 4.07Å; P131-Y134 HydrophobicContact CB-CE2 4.21Å; P131-Y134 HydrophobicContact CG-CD2 4.16Å; P131-Y134 HydrophobicContact CG-CE2 3.91Å; P131-Y134 WeakPolarHBondContact O-CD2 3.49Å; P131-Y134 PolarHBondContact O-N 3.39Å; P131-F260 HydrophobicContact CB-CB 4.11Å; P131-F260 HydrophobicContact CB-CD1 3.99Å; P131-F260 HydrophobicContact CB-CG 4.2Å; P131-F260 HydrophobicContact CG-CB 4Å; P131-F260 HydrophobicContact CG-CD1 3.8Å; P131-F260 HydrophobicContact CG-CD2 4.33Å; P131-F260 HydrophobicContact CG-CE1 4.38Å; P131-F260 HydrophobicContact CG-CG 3.78Å; P131-A382 HydrophobicContact CG-CB 3.94Å; P131-W403 HydrophobicContact CG-CB 4.19Å; P131-W403 HydrophobicContact CG-CD2 3.71Å; P131-W403 HydrophobicContact CG-CE3 4Å; P131-W403 HydrophobicContact CG-CG 3.78Å
132	S	92.5	Very high	94.8	Very high	80 Å²	80	50.5 Å²	50.5	56%	0.559	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.9	179.7	61.8	0	0	0	0	114.2	Y134 D135	S132-Y134 VanDerWaalsContact C-N 3.28Å; S132-Y134 PolarHBondContact O-N 3.18Å; S132-D135 PolarHBondContact O-N 2.96Å
133	F	92.4	Very high	94.9	Very high	33 Å²	33	50.6 Å²	50.6	15%	0.145	28%	0.283	C	S	.	.	H	α-helix	trans	-51.4	-45.4	167.2	168.3	-105.1	0	0	0	112.5	P131 D135 R136 L137 A437 D438	P131-F133 HydrophobicContact CB-CB 4.46Å; P131-F133 PolarHBondContact O-N 2.97Å; F133-D135 VanDerWaalsContact C-N 3.29Å; F133-D135 PolarHBondContact O-N 3.44Å; F133-R136 PolarHBondContact O-N 3.45Å; F133-L137 HydrophobicContact CD1-CD1 4.34Å; F133-L137 HydrophobicContact CE1-CD1 3.51Å; F133-L137 HydrophobicContact CE1-CG 4.36Å; F133-L137 HydrophobicContact CE2-CD1 4.38Å; F133-L137 HydrophobicContact CE2-CG 4.46Å; F133-L137 HydrophobicContact CZ-CD1 3.53Å; F133-L137 HydrophobicContact CZ-CD2 4.36Å; F133-L137 HydrophobicContact CZ-CG 4.05Å; F133-A437 HydrophobicContact CE1-CB 3.93Å; F133-A437 HydrophobicContact CZ-CB 4.4Å; F133-D438 HydrophobicContact CE2-CB 4.13Å; F133-D438 WeakPolarHBondContact CE2-OD2 3.32Å; F133-D438 HydrophobicContact CZ-CB 4.05Å
134	Y	94.8	Very high	95	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-70.4	-25	-175	-66.7	-70	0	0	0	113.5	L130 P131 S132 R136 L137 F260 Q369 A382 R433 F434 A437	L130-Y134 HydrophobicContact CB-CD2 3.85Å; L130-Y134 HydrophobicContact CD1-CD2 4.43Å; P131-Y134 HydrophobicContact CB-CD2 4.07Å; P131-Y134 HydrophobicContact CB-CE2 4.21Å; P131-Y134 HydrophobicContact CG-CD2 4.16Å; P131-Y134 HydrophobicContact CG-CE2 3.91Å; P131-Y134 WeakPolarHBondContact O-CD2 3.49Å; P131-Y134 PolarHBondContact O-N 3.39Å; S132-Y134 VanDerWaalsContact C-N 3.28Å; S132-Y134 PolarHBondContact O-N 3.18Å; Y134-R136 PolarHBondContact O-N 3.23Å; Y134-L137 HydrophobicContact CD1-CD1 4.28Å; Y134-L137 PolarHBondContact O-N 3.47Å; Y134-F260 HydrophobicContact CE2-CD1 4.48Å; Y134-F260 AromaticContact CE2-CE1 3.94Å; Y134-F260 HydrophobicContact CE2-CE1 3.94Å; Y134-F260 AromaticContact CZ-CE1 3.95Å; Y134-F260 WeakPolarHBondContact OH-CE1 3.45Å; Y134-Q369 PolarHBondContact OH-NE2 3.44Å; Y134-A382 HydrophobicContact CE2-CB 4Å; Y134-R433 HydrophobicContact CD1-CB 3.97Å; Y134-R433 PolarHBondContact O-NE 2.84Å; Y134-R433 VanDerWaalsContact O-NE 3.16Å; Y134-F434 AromaticContact CE1-CD2 3.93Å; Y134-F434 HydrophobicContact CE1-CD2 3.93Å; Y134-F434 HydrophobicContact CE1-CE2 4.17Å; Y134-F434 HydrophobicContact CE2-CE2 4.26Å; Y134-F434 AromaticContact CZ-CD2 3.78Å; Y134-F434 AromaticContact CZ-CE2 3.67Å; Y134-F434 WeakPolarHBondContact OH-CD2 3.19Å; Y134-F434 WeakPolarHBondContact OH-CE2 3.27Å; Y134-A437 HydrophobicContact CE1-CB 4.45Å
135	D	91.3	Very high	95.1	Very high	120 Å²	120	58.6 Å²	58.6	64%	0.642	34%	0.335	S	S	*	.	H	α-helix	trans	-69.2	-25.8	176.2	-61.3	-36.2	0	0	0	112	S132 F133	S132-D135 PolarHBondContact O-N 2.96Å; F133-D135 VanDerWaalsContact C-N 3.29Å; F133-D135 PolarHBondContact O-N 3.44Å
136	R	91	Very high	95.2	Very high	191 Å²	191	57 Å²	57	72%	0.721	33%	0.328	S	S	*	.	H	α-helix	trans	-82.3	-16.8	179	-64.1	-177.7	-75.7	-164.3	-2.4	113.2	F133 Y134 D138	F133-R136 PolarHBondContact O-N 3.45Å; Y134-R136 PolarHBondContact O-N 3.23Å; R136-D138 PolarHBondContact O-N 3.12Å
137	L	92.8	Very high	95.3	Very high	24 Å²	24	58.6 Å²	58.6	13%	0.126	33%	0.333	C	S	.	.			trans	-82.8	99.5	175.7	-72.6	174.9	0	0	0	110	F133 Y134 R433	F133-L137 HydrophobicContact CD1-CD1 4.34Å; F133-L137 HydrophobicContact CE1-CD1 3.51Å; F133-L137 HydrophobicContact CE1-CG 4.36Å; F133-L137 HydrophobicContact CE2-CD1 4.38Å; F133-L137 HydrophobicContact CE2-CG 4.46Å; F133-L137 HydrophobicContact CZ-CD1 3.53Å; F133-L137 HydrophobicContact CZ-CD2 4.36Å; F133-L137 HydrophobicContact CZ-CG 4.05Å; Y134-L137 HydrophobicContact CD1-CD1 4.28Å; Y134-L137 PolarHBondContact O-N 3.47Å; L137-R433 HydrophobicContact CB-CG 4.06Å; L137-R433 PolarHBondContact O-NE 2.98Å; L137-R433 VanDerWaalsContact O-NE 3.11Å
138	D	93.8	Very high	95.3	Very high	136 Å²	136	60.2 Å²	60.2	73%	0.727	35%	0.347	S	S	*	.			trans	-78.7	119.2	166	-172.9	10.3	0	0	0	109.7	R136 G140	R136-D138 PolarHBondContact O-N 3.12Å; D138-G140 PolarHBondContact OD1-N 3.46Å
139	V	95.6	Very high	95.4	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	33%	0.328	C	S	.	.			trans	-124.4	19	179.9	-62.3	0	0	0	0	111.1	A141 E142 T143 K429 L432 R433 F436	V139-A141 PolarHBondContact O-N 2.93Å; V139-E142 WeakPolarHBondContact CA-OE2 3.32Å; V139-E142 PolarHBondContact O-N 3.42Å; V139-T143 VanDerWaalsContact O-CB 3.3Å; V139-T143 WeakPolarHBondContact O-CB 3.41Å; V139-T143 PolarHBondContact O-N 3.45Å; V139-T143 PolarHBondContact O-OG1 3.12Å; V139-K429 HydrophobicContact CG2-CB 3.91Å; V139-K429 HydrophobicContact CG2-CG 4.11Å; V139-L432 HydrophobicContact CB-CB 4.28Å; V139-L432 HydrophobicContact CG1-CB 4.4Å; V139-L432 HydrophobicContact CG2-CB 4.34Å; V139-R433 HydrophobicContact CG1-CG 4.06Å; V139-R433 HydrophobicContact CG2-CG 3.98Å; V139-F436 HydrophobicContact CG1-CD2 3.75Å; V139-F436 HydrophobicContact CG1-CE2 4.21Å
140	G	95.5	Very high	95.4	Very high	31 Å²	31	56.5 Å²	56.5	32%	0.32	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-42.4	-173.8	0	0	0	0	0	113.2	D138 T143 A144	D138-G140 PolarHBondContact OD1-N 3.46Å; G140-T143 PolarHBondContact O-N 2.82Å; G140-A144 PolarHBondContact O-N 3.04Å; G140-A144 VanDerWaalsContact O-N 3.14Å
141	A	95.7	Very high	95.3	Very high	79 Å²	79	57.9 Å²	57.9	65%	0.653	32%	0.322	S	S	*	.	H	α-helix	trans	-67.7	-45.5	179	0	0	0	0	0	111.7	V139 T143 A144 L145	V139-A141 PolarHBondContact O-N 2.93Å; A141-T143 VanDerWaalsContact C-N 3.31Å; A141-T143 PolarHBondContact O-N 2.91Å; A141-A144 PolarHBondContact O-N 2.82Å; A141-L145 PolarHBondContact O-N 2.79Å; A141-L145 VanDerWaalsContact O-N 3.12Å
142	E	96.8	Very high	95.3	Very high	44 Å²	44	63.6 Å²	63.6	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-35.9	177.7	-65.1	93.6	151.6	0	0	111.7	V139 L145 F146 F187 R191 L432 F436	V139-E142 WeakPolarHBondContact CA-OE2 3.32Å; V139-E142 PolarHBondContact O-N 3.42Å; E142-L145 PolarHBondContact O-N 2.91Å; E142-F146 VanDerWaalsContact O-CB 3.29Å; E142-F146 WeakPolarHBondContact O-CB 3.44Å; E142-F146 PolarHBondContact O-N 3.46Å; E142-F187 HydrophobicContact CB-CE1 3.63Å; E142-F187 HydrophobicContact CB-CZ 3.65Å; E142-F187 HydrophobicContact CG-CD1 4.13Å; E142-F187 HydrophobicContact CG-CE1 3.55Å; E142-F187 HydrophobicContact CG-CZ 4.13Å; E142-R191 IonicContact OE1-NH2 2.69Å; E142-L432 HydrophobicContact CB-CD1 4.05Å; E142-F436 HydrophobicContact CB-CE2 3.93Å; E142-F436 HydrophobicContact CB-CZ 4.33Å; E142-F436 HydrophobicContact CG-CE2 3.77Å; E142-F436 HydrophobicContact CG-CZ 4.2Å
143	T	97.4	Very high	95.5	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-46.8	174.2	-59.2	0	0	0	0	110.8	V139 G140 A141 L145 F146 K147 I428 K429	V139-T143 VanDerWaalsContact O-CB 3.3Å; V139-T143 WeakPolarHBondContact O-CB 3.41Å; V139-T143 PolarHBondContact O-N 3.45Å; V139-T143 PolarHBondContact O-OG1 3.12Å; G140-T143 PolarHBondContact O-N 2.82Å; A141-T143 VanDerWaalsContact C-N 3.31Å; A141-T143 PolarHBondContact O-N 2.91Å; T143-L145 VanDerWaalsContact C-N 3.27Å; T143-L145 PolarHBondContact O-N 2.86Å; T143-F146 PolarHBondContact O-N 2.82Å; T143-K147 WeakPolarHBondContact O-CB 3.34Å; T143-K147 PolarHBondContact O-N 2.88Å; T143-I428 HydrophobicContact CG2-CB 4.07Å; T143-I428 HydrophobicContact CG2-CG2 3.9Å; T143-K429 HydrophobicContact CG2-CG 3.93Å; T143-K429 WeakPolarHBondContact OG1-CG 3.48Å
144	A	96.9	Very high	95.7	Very high	71 Å²	71	59.2 Å²	59.2	59%	0.587	32%	0.319	S	S	*	.	H	α-helix	trans	-62.4	-36.7	178.4	0	0	0	0	0	112.1	G140 A141	G140-A144 PolarHBondContact O-N 3.04Å; G140-A144 VanDerWaalsContact O-N 3.14Å; A141-A144 PolarHBondContact O-N 2.82Å
145	L	96.7	Very high	95.7	Very high	120 Å²	120	60.1 Å²	60.1	63%	0.628	33%	0.326	S	S	*	.	H	α-helix	trans	-69.9	-42.4	176.8	-176	68.2	0	0	0	112.5	A141 E142 T143 P148 F187	A141-L145 PolarHBondContact O-N 2.79Å; A141-L145 VanDerWaalsContact O-N 3.12Å; E142-L145 PolarHBondContact O-N 2.91Å; T143-L145 VanDerWaalsContact C-N 3.27Å; T143-L145 PolarHBondContact O-N 2.86Å; L145-P148 WeakPolarHBondContact O-CD 3.49Å; L145-F187 HydrophobicContact CD2-CE1 4.04Å; L145-F187 HydrophobicContact CD2-CZ 4.45Å
146	F	97.6	Very high	95.9	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-86	-23.3	-172.6	-170.6	-116	0	0	0	113.7	E142 T143 P148 Y149 F150 L179 G182 I183 F187 I428 L432	E142-F146 VanDerWaalsContact O-CB 3.29Å; E142-F146 WeakPolarHBondContact O-CB 3.44Å; E142-F146 PolarHBondContact O-N 3.46Å; T143-F146 PolarHBondContact O-N 2.82Å; F146-P148 VanDerWaalsContact C-CD 3.5Å; F146-Y149 HydrophobicContact CD2-CD1 4.2Å; F146-Y149 AromaticContact CE2-CD1 3.36Å; F146-Y149 HydrophobicContact CE2-CD1 3.36Å; F146-Y149 AromaticContact CE2-CE1 3.99Å; F146-Y149 HydrophobicContact CE2-CE1 3.99Å; F146-Y149 HydrophobicContact CE2-CG 4.13Å; F146-Y149 AromaticContact CZ-CD1 3.65Å; F146-Y149 HydrophobicContact CZ-CD1 3.65Å; F146-Y149 HydrophobicContact CZ-CE1 4.1Å; F146-Y149 PolarHBondContact O-N 3.43Å; F146-Y149 VanDerWaalsContact O-N 3.15Å; F146-F150 HydrophobicContact CD1-CB 4.27Å; F146-F150 HydrophobicContact CE1-CB 4.14Å; F146-F150 AromaticContact CE1-CD2 4Å; F146-F150 HydrophobicContact CE1-CD2 4Å; F146-F150 PolarHBondContact O-N 3.17Å; F146-L179 HydrophobicContact CE1-CD1 3.82Å; F146-L179 HydrophobicContact CZ-CD1 4.19Å; F146-G182 VanDerWaalsContact CE2-C 3.41Å; F146-I183 HydrophobicContact CD1-CG1 4.26Å; F146-I183 HydrophobicContact CE1-CD1 4.2Å; F146-I183 HydrophobicContact CE1-CG1 3.56Å; F146-I183 HydrophobicContact CE2-CG1 4.1Å; F146-I183 HydrophobicContact CZ-CB 4.47Å; F146-I183 HydrophobicContact CZ-CD1 4.47Å; F146-I183 HydrophobicContact CZ-CG1 3.48Å; F146-I183 VanDerWaalsContact CZ-CG1 3.48Å; F146-F187 HydrophobicContact CB-CE2 4.09Å; F146-F187 HydrophobicContact CB-CZ 4.03Å; F146-F187 HydrophobicContact CD2-CE2 4.2Å; F146-F187 HydrophobicContact CG-CE2 4.2Å; F146-I428 HydrophobicContact CD1-CG2 4.08Å; F146-L432 HydrophobicContact CD1-CD2 4.19Å; F146-L432 HydrophobicContact CG-CD2 4.49Å
147	K	97.4	Very high	96	Very high	58 Å²	58	49.9 Å²	49.9	25%	0.252	28%	0.282	S	S	.	.	H	α-helix	trans	-52.1	-45.1	-177.3	175.2	174.5	179.9	172.3	0	114.5	T143 Y149 F150 M151 D425 I428	T143-K147 WeakPolarHBondContact O-CB 3.34Å; T143-K147 PolarHBondContact O-N 2.88Å; K147-Y149 VanDerWaalsContact C-N 3.35Å; K147-Y149 PolarHBondContact O-N 3.46Å; K147-F150 PolarHBondContact O-N 3.32Å; K147-M151 HydrophobicContact CD-SD 4.33Å; K147-M151 VanDerWaalsContact CE-SD 3.58Å; K147-M151 HydrophobicContact CG-CG 4.22Å; K147-M151 HydrophobicContact CG-SD 3.78Å; K147-M151 WeakPolarHBondContact O-CG 3.47Å; K147-M151 PolarHBondContact O-N 3.04Å; K147-D425 WeakPolarHBondContact CD-OD1 3.26Å; K147-D425 WeakPolarHBondContact CE-OD1 3.33Å; K147-D425 IonicContact NZ-OD1 2.86Å; K147-D425 PolarHBondContact NZ-OD1 3.42Å; K147-D425 IonicContact NZ-OD2 3.11Å; K147-D425 PolarHBondContact NZ-OD2 3.1Å; K147-I428 HydrophobicContact CB-CD1 3.94Å; K147-I428 HydrophobicContact CG-CD1 3.93Å
148	P	96.7	Very high	96.1	Very high	82 Å²	82	50.3 Å²	50.3	53%	0.532	28%	0.284	S	S	.	.	H	α-helix	trans	-58.4	-45.6	178.3	-24.5	34.9	0	0	0	112.6	L145 F146 M151 E152	L145-P148 WeakPolarHBondContact O-CD 3.49Å; F146-P148 VanDerWaalsContact C-CD 3.5Å; P148-M151 PolarHBondContact O-N 3.45Å; P148-E152 WeakPolarHBondContact O-CB 3.46Å; P148-E152 PolarHBondContact O-N 2.81Å
149	Y	97.5	Very high	96	Very high	74 Å²	74	46.5 Å²	46.5	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-45.5	177.4	178	-90.7	0	0	0	111.7	F146 K147 M151 E152 M153 H178	F146-Y149 HydrophobicContact CD2-CD1 4.2Å; F146-Y149 AromaticContact CE2-CD1 3.36Å; F146-Y149 HydrophobicContact CE2-CD1 3.36Å; F146-Y149 AromaticContact CE2-CE1 3.99Å; F146-Y149 HydrophobicContact CE2-CE1 3.99Å; F146-Y149 HydrophobicContact CE2-CG 4.13Å; F146-Y149 AromaticContact CZ-CD1 3.65Å; F146-Y149 HydrophobicContact CZ-CD1 3.65Å; F146-Y149 HydrophobicContact CZ-CE1 4.1Å; F146-Y149 PolarHBondContact O-N 3.43Å; F146-Y149 VanDerWaalsContact O-N 3.15Å; K147-Y149 VanDerWaalsContact C-N 3.35Å; K147-Y149 PolarHBondContact O-N 3.46Å; Y149-M151 VanDerWaalsContact C-N 3.33Å; Y149-M151 PolarHBondContact O-N 3.03Å; Y149-E152 PolarHBondContact O-N 3.48Å; Y149-M153 HydrophobicContact CD1-CG 4.2Å; Y149-M153 HydrophobicContact CD2-CG 4.37Å; Y149-M153 HydrophobicContact CE1-CG 3.73Å; Y149-M153 HydrophobicContact CE2-CG 3.93Å; Y149-M153 HydrophobicContact CE2-SD 4.23Å; Y149-M153 HydrophobicContact CG-CG 4.5Å; Y149-M153 WeakPolarHBondContact O-CG 3.47Å; Y149-M153 PolarHBondContact O-N 2.98Å; Y149-H178 PolarHBondContact OH-O 2.92Å
150	F	97.4	Very high	95.8	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-47.2	177.9	-175.5	-79.1	0	0	0	111.4	F146 K147 L154 F175 L179 W378 L410 F423 I428	F146-F150 HydrophobicContact CD1-CB 4.27Å; F146-F150 HydrophobicContact CE1-CB 4.14Å; F146-F150 AromaticContact CE1-CD2 4Å; F146-F150 HydrophobicContact CE1-CD2 4Å; F146-F150 PolarHBondContact O-N 3.17Å; K147-F150 PolarHBondContact O-N 3.32Å; F150-L154 HydrophobicContact CE1-CD2 4.09Å; F150-L154 VanDerWaalsContact O-CB 3.25Å; F150-L154 WeakPolarHBondContact O-CB 3.47Å; F150-L154 PolarHBondContact O-N 2.89Å; F150-F175 HydrophobicContact CD1-CZ 4.26Å; F150-F175 AromaticContact CD2-CZ 3.93Å; F150-F175 HydrophobicContact CD2-CZ 3.93Å; F150-F175 AromaticContact CE1-CZ 3.9Å; F150-F175 HydrophobicContact CE1-CZ 3.9Å; F150-F175 AromaticContact CE2-CE1 3.89Å; F150-F175 HydrophobicContact CE2-CE1 3.89Å; F150-F175 AromaticContact CE2-CZ 3.56Å; F150-F175 HydrophobicContact CE2-CZ 3.56Å; F150-F175 HydrophobicContact CG-CZ 4.27Å; F150-F175 AromaticContact CZ-CE1 3.85Å; F150-F175 HydrophobicContact CZ-CE1 3.85Å; F150-F175 AromaticContact CZ-CZ 3.54Å; F150-F175 HydrophobicContact CZ-CZ 3.54Å; F150-L179 HydrophobicContact CD2-CD1 3.6Å; F150-L179 HydrophobicContact CE2-CD1 3.61Å; F150-W378 HydrophobicContact CZ-CH2 4.43Å; F150-W378 HydrophobicContact CZ-CZ2 4.24Å; F150-L410 HydrophobicContact CE1-CD1 4.29Å; F150-L410 HydrophobicContact CE1-CD2 4.08Å; F150-L410 HydrophobicContact CZ-CD2 4.36Å; F150-F423 AromaticContact CD1-CZ 3.89Å; F150-F423 HydrophobicContact CD1-CZ 3.89Å; F150-F423 HydrophobicContact CE1-CE2 4.42Å; F150-F423 AromaticContact CE1-CZ 3.87Å; F150-F423 HydrophobicContact CE1-CZ 3.87Å; F150-I428 HydrophobicContact CB-CD1 4.05Å; F150-I428 HydrophobicContact CD1-CD1 3.83Å; F150-I428 HydrophobicContact CD1-CG1 3.96Å; F150-I428 HydrophobicContact CD2-CD1 4.48Å; F150-I428 HydrophobicContact CD2-CG1 4.08Å; F150-I428 HydrophobicContact CE1-CD1 4.41Å; F150-I428 HydrophobicContact CE1-CG1 4.11Å; F150-I428 HydrophobicContact CE2-CG1 4.22Å; F150-I428 HydrophobicContact CG-CD1 3.87Å; F150-I428 HydrophobicContact CG-CG1 3.94Å; F150-I428 HydrophobicContact CZ-CG1 4.24Å
151	M	96.2	Very high	95.5	Very high	53 Å²	53	48.8 Å²	48.8	26%	0.261	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-42	-180	-69.8	179.7	72.7	0	0	111.9	K147 P148 Y149 L154 S155 F420 F423	K147-M151 HydrophobicContact CD-SD 4.33Å; K147-M151 VanDerWaalsContact CE-SD 3.58Å; K147-M151 HydrophobicContact CG-CG 4.22Å; K147-M151 HydrophobicContact CG-SD 3.78Å; K147-M151 WeakPolarHBondContact O-CG 3.47Å; K147-M151 PolarHBondContact O-N 3.04Å; P148-M151 PolarHBondContact O-N 3.45Å; Y149-M151 VanDerWaalsContact C-N 3.33Å; Y149-M151 PolarHBondContact O-N 3.03Å; M151-L154 PolarHBondContact O-N 3.41Å; M151-S155 WeakPolarHBondContact O-CB 3.4Å; M151-S155 PolarHBondContact O-N 2.96Å; M151-S155 PolarHBondContact O-OG 2.64Å; M151-F420 HydrophobicContact CB-CE2 4.34Å; M151-F420 HydrophobicContact CE-CD2 3.63Å; M151-F420 HydrophobicContact CE-CE2 4.21Å; M151-F423 HydrophobicContact CG-CE1 4.32Å; M151-F423 HydrophobicContact CG-CE2 4.08Å; M151-F423 HydrophobicContact CG-CZ 3.89Å
152	E	95.8	Very high	95.1	Very high	127 Å²	127	49.4 Å²	49.4	59%	0.593	28%	0.282	S	S	*	.	H	α-helix	trans	-60.6	-50	178.5	-174.2	179.4	-175.1	0	0	111.7	P148 Y149 L154 S155 Q156	P148-E152 WeakPolarHBondContact O-CB 3.46Å; P148-E152 PolarHBondContact O-N 2.81Å; Y149-E152 PolarHBondContact O-N 3.48Å; E152-L154 VanDerWaalsContact C-N 3.33Å; E152-L154 PolarHBondContact O-N 3.44Å; E152-S155 PolarHBondContact O-N 2.88Å; E152-Q156 WeakPolarHBondContact O-CB 3.39Å; E152-Q156 PolarHBondContact O-N 3.15Å
153	M	96.5	Very high	94.6	Very high	22 Å²	22	51.7 Å²	51.7	11%	0.108	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-36.5	178.6	-63	-62.6	92.3	0	0	112	Y149 Q156 E157 F175 H178	Y149-M153 HydrophobicContact CD1-CG 4.2Å; Y149-M153 HydrophobicContact CD2-CG 4.37Å; Y149-M153 HydrophobicContact CE1-CG 3.73Å; Y149-M153 HydrophobicContact CE2-CG 3.93Å; Y149-M153 HydrophobicContact CE2-SD 4.23Å; Y149-M153 HydrophobicContact CG-CG 4.5Å; Y149-M153 WeakPolarHBondContact O-CG 3.47Å; Y149-M153 PolarHBondContact O-N 2.98Å; M153-Q156 PolarHBondContact O-N 3.42Å; M153-E157 PolarHBondContact O-N 3.44Å; M153-F175 HydrophobicContact CB-CD2 4.49Å; M153-F175 HydrophobicContact CB-CE2 4.23Å; M153-H178 HydrophobicContact CB-CB 4.22Å; M153-H178 HydrophobicContact CG-CB 4.22Å
154	L	96.5	Very high	93.8	Very high	0 Å²	0	54 Å²	54	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-46.8	176.5	-178.3	63.8	0	0	0	111.5	F150 M151 E152 Q156 E157 L158 F175 L375 L410 F411 F420 F423	F150-L154 HydrophobicContact CE1-CD2 4.09Å; F150-L154 VanDerWaalsContact O-CB 3.25Å; F150-L154 WeakPolarHBondContact O-CB 3.47Å; F150-L154 PolarHBondContact O-N 2.89Å; M151-L154 PolarHBondContact O-N 3.41Å; E152-L154 VanDerWaalsContact C-N 3.33Å; E152-L154 PolarHBondContact O-N 3.44Å; L154-Q156 VanDerWaalsContact C-N 3.29Å; L154-Q156 PolarHBondContact O-N 3.15Å; L154-E157 PolarHBondContact O-N 3.47Å; L154-L158 HydrophobicContact CD1-CD1 4.02Å; L154-L158 HydrophobicContact CD1-CG 4.14Å; L154-L158 HydrophobicContact CG-CD1 3.91Å; L154-L158 HydrophobicContact CG-CG 4.4Å; L154-L158 WeakPolarHBondContact O-CB 3.46Å; L154-L158 WeakPolarHBondContact O-CG 3.31Å; L154-L158 PolarHBondContact O-N 2.7Å; L154-F175 HydrophobicContact CB-CD2 4.26Å; L154-F175 HydrophobicContact CB-CE2 3.61Å; L154-F175 HydrophobicContact CB-CZ 4.14Å; L154-F175 HydrophobicContact CD1-CD2 4.16Å; L154-F175 HydrophobicContact CD1-CE2 4.04Å; L154-F175 HydrophobicContact CD1-CG 4.49Å; L154-F175 HydrophobicContact CD1-CZ 4.25Å; L154-F175 HydrophobicContact CG-CE2 4.41Å; L154-L375 HydrophobicContact CD1-CB 4.2Å; L154-L375 HydrophobicContact CD1-CD1 4.35Å; L154-L375 HydrophobicContact CD1-CD2 4.23Å; L154-L375 HydrophobicContact CD1-CG 4.5Å; L154-L410 HydrophobicContact CD2-CD2 3.52Å; L154-F411 HydrophobicContact CD2-CD1 4.47Å; L154-F411 HydrophobicContact CD2-CE1 4.33Å; L154-F420 HydrophobicContact CB-CZ 4.14Å; L154-F420 HydrophobicContact CD2-CE1 3.64Å; L154-F420 HydrophobicContact CD2-CZ 3.65Å; L154-F420 HydrophobicContact CG-CE1 4.02Å; L154-F420 HydrophobicContact CG-CZ 3.78Å; L154-F423 HydrophobicContact CD2-CE2 4.18Å
155	S	95.3	Very high	93.1	Very high	20 Å²	20	58.6 Å²	58.6	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-58.5	-44.3	176.3	-70.7	0	0	0	0	110.7	M151 E152 L158 S159 G418 F420	M151-S155 WeakPolarHBondContact O-CB 3.4Å; M151-S155 PolarHBondContact O-N 2.96Å; M151-S155 PolarHBondContact O-OG 2.64Å; E152-S155 PolarHBondContact O-N 2.88Å; S155-L158 PolarHBondContact O-N 2.92Å; S155-S159 VanDerWaalsContact O-CB 3.31Å; S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-N 3.24Å; S155-S159 PolarHBondContact O-OG 2.98Å; S155-G418 PolarHBondContact OG-O 3.23Å; S155-F420 WeakPolarHBondContact OG-CE2 3.41Å; S155-F420 VanDerWaalsContact OG-CZ 3.28Å; S155-F420 WeakPolarHBondContact OG-CZ 3.49Å
156	Q	94	Very high	92.6	Very high	90 Å²	90	56.7 Å²	56.7	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-58.5	-51	177.3	180	179.9	-25.4	0	0	111.7	E152 M153 L154 S159 L160	E152-Q156 WeakPolarHBondContact O-CB 3.39Å; E152-Q156 PolarHBondContact O-N 3.15Å; M153-Q156 PolarHBondContact O-N 3.42Å; L154-Q156 VanDerWaalsContact C-N 3.29Å; L154-Q156 PolarHBondContact O-N 3.15Å; Q156-S159 PolarHBondContact O-N 3.12Å; Q156-L160 HydrophobicContact CG-CD1 3.97Å; Q156-L160 HydrophobicContact CG-CG 4.49Å; Q156-L160 WeakPolarHBondContact O-CB 3.41Å; Q156-L160 VanDerWaalsContact O-CG 3.25Å; Q156-L160 WeakPolarHBondContact O-CG 3.2Å; Q156-L160 PolarHBondContact O-N 2.97Å
157	E	94.6	Very high	92.2	Very high	7 Å²	7	59.6 Å²	59.6	3%	0.033	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-41.1	-178.8	-74.5	-56	136.9	0	0	112.2	M153 L154 L160 A161 R166 T171 F175 H178	M153-E157 PolarHBondContact O-N 3.44Å; L154-E157 PolarHBondContact O-N 3.47Å; E157-L160 PolarHBondContact O-N 2.77Å; E157-A161 WeakPolarHBondContact O-CB 3.4Å; E157-A161 PolarHBondContact O-N 2.99Å; E157-R166 IonicContact OE2-NH1 2.8Å; E157-T171 HydrophobicContact CB-CG2 3.85Å; E157-T171 WeakPolarHBondContact O-CG2 3.29Å; E157-F175 HydrophobicContact CG-CB 4.19Å; E157-H178 IonicContact OE1-CD2 2.64Å; E157-H178 IonicContact OE1-NE2 3.23Å
158	L	93.8	Very high	91.9	Very high	32 Å²	32	60 Å²	60	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-41.1	177.2	-68.3	175	0	0	0	112.5	L154 S155 A161 A162 L375 F411 F414 F420	L154-L158 HydrophobicContact CD1-CD1 4.02Å; L154-L158 HydrophobicContact CD1-CG 4.14Å; L154-L158 HydrophobicContact CG-CD1 3.91Å; L154-L158 HydrophobicContact CG-CG 4.4Å; L154-L158 WeakPolarHBondContact O-CB 3.46Å; L154-L158 WeakPolarHBondContact O-CG 3.31Å; L154-L158 PolarHBondContact O-N 2.7Å; S155-L158 PolarHBondContact O-N 2.92Å; L158-A161 PolarHBondContact O-N 2.81Å; L158-A162 PolarHBondContact O-N 3.39Å; L158-L375 HydrophobicContact CD2-CB 4.44Å; L158-L375 HydrophobicContact CD2-CD1 4.07Å; L158-F411 HydrophobicContact CD1-CE1 4.03Å; L158-F411 HydrophobicContact CD1-CZ 3.79Å; L158-F414 HydrophobicContact CB-CD1 3.8Å; L158-F414 HydrophobicContact CB-CE1 3.53Å; L158-F414 HydrophobicContact CB-CZ 4.05Å; L158-F414 HydrophobicContact CD1-CB 4.35Å; L158-F414 HydrophobicContact CD1-CD1 4.03Å; L158-F414 HydrophobicContact CD1-CD2 4.24Å; L158-F414 HydrophobicContact CD1-CE1 4.36Å; L158-F414 HydrophobicContact CD1-CG 3.95Å; L158-F420 HydrophobicContact CD1-CE1 3.86Å; L158-F420 HydrophobicContact CD1-CZ 4.39Å
159	S	92.2	Very high	91.7	Very high	56 Å²	56	58.8 Å²	58.8	39%	0.392	34%	0.335	S	S	.	.	H	α-helix	trans	-65.1	-40.4	174.9	-66.2	0	0	0	0	111.7	S155 Q156 A162 S163	S155-S159 VanDerWaalsContact O-CB 3.31Å; S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-N 3.24Å; S155-S159 PolarHBondContact O-OG 2.98Å; Q156-S159 PolarHBondContact O-N 3.12Å; S159-A162 PolarHBondContact O-N 2.91Å; S159-S163 PolarHBondContact O-N 2.78Å; S159-S163 VanDerWaalsContact O-N 3.14Å; S159-S163 PolarHBondContact O-OG 2.88Å
160	L	90.9	Very high	91.5	Very high	56 Å²	56	59.5 Å²	59.5	29%	0.293	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-45.3	175	-75	173.9	0	0	0	111	Q156 E157 A162 S163 S164	Q156-L160 HydrophobicContact CG-CD1 3.97Å; Q156-L160 HydrophobicContact CG-CG 4.49Å; Q156-L160 WeakPolarHBondContact O-CB 3.41Å; Q156-L160 VanDerWaalsContact O-CG 3.25Å; Q156-L160 WeakPolarHBondContact O-CG 3.2Å; Q156-L160 PolarHBondContact O-N 2.97Å; E157-L160 PolarHBondContact O-N 2.77Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-A162 PolarHBondContact O-N 3.38Å; L160-S163 PolarHBondContact O-N 2.9Å; L160-S163 PolarHBondContact O-OG 2.81Å; L160-S164 WeakPolarHBondContact O-CB 3.42Å; L160-S164 PolarHBondContact O-N 2.69Å; L160-S164 PolarHBondContact O-OG 2.92Å
161	A	90.3	Very high	91.4	Very high	25 Å²	25	59.6 Å²	59.6	21%	0.207	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-44.1	176.8	0	0	0	0	0	112.2	E157 L158 S163 T171	E157-A161 WeakPolarHBondContact O-CB 3.4Å; E157-A161 PolarHBondContact O-N 2.99Å; L158-A161 PolarHBondContact O-N 2.81Å; A161-S163 PolarHBondContact O-N 2.81Å; A161-T171 HydrophobicContact CB-CG2 3.81Å
162	A	87	Confident	91.4	Very high	92 Å²	92	57 Å²	57	76%	0.76	33%	0.329	S	S	*	.	H	α-helix	trans	-63.1	-30.1	176.3	0	0	0	0	0	113.1	L158 S159 L160	L158-A162 PolarHBondContact O-N 3.39Å; S159-A162 PolarHBondContact O-N 2.91Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-A162 PolarHBondContact O-N 3.38Å
163	S	86.6	Confident	91.4	Very high	91 Å²	91	52.2 Å²	52.2	64%	0.636	31%	0.309	S	S	*	.	H	α-helix	trans	-90.2	-24.7	-177.5	72.9	0	0	0	0	115.2	S159 L160 A161	S159-S163 PolarHBondContact O-N 2.78Å; S159-S163 VanDerWaalsContact O-N 3.14Å; S159-S163 PolarHBondContact O-OG 2.88Å; L160-S163 PolarHBondContact O-N 2.9Å; L160-S163 PolarHBondContact O-OG 2.81Å; A161-S163 PolarHBondContact O-N 2.81Å
164	S	80.6	Confident	91.4	Very high	55 Å²	55	53.7 Å²	53.7	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-122.9	13.2	-164.2	58.8	0	0	0	0	115.7	L160 R166	L160-S164 WeakPolarHBondContact O-CB 3.42Å; L160-S164 PolarHBondContact O-N 2.69Å; L160-S164 PolarHBondContact O-OG 2.92Å; S164-R166 PolarHBondContact O-N 3.46Å; S164-R166 WeakPolarHBondContact OG-CD 3.47Å; S164-R166 WeakPolarHBondContact OG-CG 3.3Å; S164-R166 PolarHBondContact OG-NE 2.67Å
165	D	80.8	Confident	91.5	Very high	166 Å²	166	53.8 Å²	53.8	89%	0.888	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	30.5	-178.9	-156.1	25.4	0	0	0	113.1
166	R	86.2	Confident	91.6	Very high	81 Å²	81	52.8 Å²	52.8	31%	0.306	31%	0.311	S	S	.	.			trans	-68.5	141.5	177.1	-76.5	175.8	-177.4	-176.1	-1.5	109.4	E157 S164 E170	E157-R166 IonicContact OE2-NH1 2.8Å; S164-R166 PolarHBondContact O-N 3.46Å; S164-R166 WeakPolarHBondContact OG-CD 3.47Å; S164-R166 WeakPolarHBondContact OG-CG 3.3Å; S164-R166 PolarHBondContact OG-NE 2.67Å; R166-E170 IonicContact NE-OE1 2.66Å
167	S	90	Very high	91.7	Very high	62 Å²	62	49.3 Å²	49.3	43%	0.434	30%	0.296	S	S	.	.			trans	-62.7	150.3	172.5	72.5	0	0	0	0	110.8	N169 E170 T171	S167-N169 PolarHBondContact O-N 3.07Å; S167-E170 PolarHBondContact O-N 3.04Å; S167-E170 WeakPolarHBondContact OG-CB 3.48Å; S167-E170 PolarHBondContact OG-N 3.47Å; S167-E170 VanDerWaalsContact OG-N 3.09Å; S167-T171 PolarHBondContact O-N 2.98Å; S167-T171 VanDerWaalsContact O-N 3.11Å; S167-T171 PolarHBondContact O-OG1 2.78Å
168	V	91.4	Very high	91.8	Very high	66 Å²	66	51.7 Å²	51.7	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-54.2	-37.1	171.5	176.4	0	0	0	0	110.2	T172 D374	V168-T172 WeakPolarHBondContact O-CB 3.22Å; V168-T172 PolarHBondContact O-N 2.9Å; V168-T172 PolarHBondContact O-OG1 2.88Å; V168-D374 HydrophobicContact CG1-CB 4.01Å
169	N	92.4	Very high	92	Very high	57 Å²	57	50.3 Å²	50.3	31%	0.305	30%	0.299	S	S	.	.	H	α-helix	trans	-63.2	-51.3	-179.2	-163.2	59.7	0	0	0	112.7	S167 T172 C173 S313	S167-N169 PolarHBondContact O-N 3.07Å; N169-T172 PolarHBondContact O-N 2.82Å; N169-C173 PolarHBondContact O-N 2.82Å; N169-C173 PolarHBondContact O-SG 2.85Å; N169-C173 VanDerWaalsContact O-SG 3.39Å; N169-S313 WeakPolarHBondContact CA-OG 3.31Å; N169-S313 WeakPolarHBondContact OD1-CB 3.16Å; N169-S313 PolarHBondContact OD1-OG 2.98Å
170	E	92.8	Very high	92.2	Very high	89 Å²	89	47.6 Å²	47.6	42%	0.416	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-48.4	178.7	-175.6	-174.8	166	0	0	111.3	R166 S167 T172 C173 N174	R166-E170 IonicContact NE-OE1 2.66Å; S167-E170 PolarHBondContact O-N 3.04Å; S167-E170 WeakPolarHBondContact OG-CB 3.48Å; S167-E170 PolarHBondContact OG-N 3.47Å; S167-E170 VanDerWaalsContact OG-N 3.09Å; E170-T172 VanDerWaalsContact C-N 3.3Å; E170-T172 PolarHBondContact O-N 3.17Å; E170-C173 PolarHBondContact O-N 3.42Å; E170-N174 VanDerWaalsContact O-CG 3.26Å; E170-N174 PolarHBondContact O-N 3.08Å; E170-N174 PolarHBondContact O-ND2 2.83Å
171	T	95.5	Very high	92.5	Very high	4 Å²	4	48.3 Å²	48.3	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-43.8	178.5	-51.1	0	0	0	0	111.2	E157 A161 S167 N174 F175 L375	E157-T171 HydrophobicContact CB-CG2 3.85Å; E157-T171 WeakPolarHBondContact O-CG2 3.29Å; A161-T171 HydrophobicContact CB-CG2 3.81Å; S167-T171 PolarHBondContact O-N 2.98Å; S167-T171 VanDerWaalsContact O-N 3.11Å; S167-T171 PolarHBondContact O-OG1 2.78Å; T171-N174 PolarHBondContact O-N 3.34Å; T171-F175 PolarHBondContact O-N 3.12Å; T171-L375 HydrophobicContact CG2-CD1 3.76Å
172	T	96.8	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-42.3	179.3	-57	0	0	0	0	111.6	V168 N169 E170 F175 F176 S373 L375	V168-T172 WeakPolarHBondContact O-CB 3.22Å; V168-T172 PolarHBondContact O-N 2.9Å; V168-T172 PolarHBondContact O-OG1 2.88Å; N169-T172 PolarHBondContact O-N 2.82Å; E170-T172 VanDerWaalsContact C-N 3.3Å; E170-T172 PolarHBondContact O-N 3.17Å; T172-F175 PolarHBondContact O-N 3.37Å; T172-F176 HydrophobicContact CG2-CD2 3.73Å; T172-F176 HydrophobicContact CG2-CE2 3.38Å; T172-F176 HydrophobicContact CG2-CZ 4.15Å; T172-F176 VanDerWaalsContact O-CD2 3.28Å; T172-F176 WeakPolarHBondContact O-CD2 3.28Å; T172-F176 PolarHBondContact O-N 2.91Å; T172-S373 WeakPolarHBondContact CG2-O 3.46Å; T172-L375 HydrophobicContact CG2-CD2 4.01Å; T172-L375 HydrophobicContact CG2-CG 4.21Å
173	C	96.2	Very high	93.3	Very high	25 Å²	25	42.8 Å²	42.8	17%	0.169	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-37.9	178.2	-69.4	0	0	0	0	112.8	N169 E170 F176 T177 C248	N169-C173 PolarHBondContact O-N 2.82Å; N169-C173 PolarHBondContact O-SG 2.85Å; N169-C173 VanDerWaalsContact O-SG 3.39Å; E170-C173 PolarHBondContact O-N 3.42Å; C173-F176 PolarHBondContact O-N 3.4Å; C173-T177 PolarHBondContact O-N 3.14Å; C173-T177 VanDerWaalsContact O-N 3.08Å; C173-T177 PolarHBondContact O-OG1 3.08Å; C173-T177 VanDerWaalsContact O-OG1 3.13Å; C173-C248 WeakPolarHBondContact CA-SG 3.12Å; C173-C248 HydrophobicContact CB-CB 3.5Å; C173-C248 VanDerWaalsContact CB-CB 3.5Å; C173-C248 WeakPolarHBondContact CB-SG 3.47Å; C173-C248 VanDerWaalsContact SG-CA 3.58Å; C173-C248 WeakPolarHBondContact SG-CB 3.27Å; C173-C248 CovalentContact SG-SG 2.05Å; C173-C248 PolarHBondContact SG-SG 3.04Å
174	N	95.8	Very high	93.8	Very high	53 Å²	53	39.5 Å²	39.5	28%	0.283	21%	0.214	S	C	.	.	H	α-helix	trans	-62.4	-46.4	172.8	-67.4	-19.4	0	0	0	110.9	E170 T171 F176 T177 H178	E170-N174 VanDerWaalsContact O-CG 3.26Å; E170-N174 PolarHBondContact O-N 3.08Å; E170-N174 PolarHBondContact O-ND2 2.83Å; T171-N174 PolarHBondContact O-N 3.34Å; N174-F176 VanDerWaalsContact C-N 3.33Å; N174-F176 PolarHBondContact O-N 3.18Å; N174-T177 VanDerWaalsContact O-CB 3.31Å; N174-T177 WeakPolarHBondContact O-CB 3.49Å; N174-T177 PolarHBondContact O-N 3.06Å; N174-T177 VanDerWaalsContact O-N 3.12Å; N174-H178 PolarHBondContact O-CD2 3.37Å; N174-H178 PolarHBondContact O-N 2.84Å
175	F	97.6	Very high	94.5	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-42.4	176.2	-178.6	-102.7	0	0	0	112.4	F150 M153 L154 E157 T171 T172 T177 H178 L179 L375 W378	F150-F175 HydrophobicContact CD1-CZ 4.26Å; F150-F175 AromaticContact CD2-CZ 3.93Å; F150-F175 HydrophobicContact CD2-CZ 3.93Å; F150-F175 AromaticContact CE1-CZ 3.9Å; F150-F175 HydrophobicContact CE1-CZ 3.9Å; F150-F175 AromaticContact CE2-CE1 3.89Å; F150-F175 HydrophobicContact CE2-CE1 3.89Å; F150-F175 AromaticContact CE2-CZ 3.56Å; F150-F175 HydrophobicContact CE2-CZ 3.56Å; F150-F175 HydrophobicContact CG-CZ 4.27Å; F150-F175 AromaticContact CZ-CE1 3.85Å; F150-F175 HydrophobicContact CZ-CE1 3.85Å; F150-F175 AromaticContact CZ-CZ 3.54Å; F150-F175 HydrophobicContact CZ-CZ 3.54Å; M153-F175 HydrophobicContact CB-CD2 4.49Å; M153-F175 HydrophobicContact CB-CE2 4.23Å; L154-F175 HydrophobicContact CB-CD2 4.26Å; L154-F175 HydrophobicContact CB-CE2 3.61Å; L154-F175 HydrophobicContact CB-CZ 4.14Å; L154-F175 HydrophobicContact CD1-CD2 4.16Å; L154-F175 HydrophobicContact CD1-CE2 4.04Å; L154-F175 HydrophobicContact CD1-CG 4.49Å; L154-F175 HydrophobicContact CD1-CZ 4.25Å; L154-F175 HydrophobicContact CG-CE2 4.41Å; E157-F175 HydrophobicContact CG-CB 4.19Å; T171-F175 PolarHBondContact O-N 3.12Å; T172-F175 PolarHBondContact O-N 3.37Å; F175-T177 PolarHBondContact O-N 3Å; F175-H178 CarbonylContact O-C 3.6Å; F175-H178 PolarHBondContact O-N 3.18Å; F175-H178 VanDerWaalsContact O-N 3.14Å; F175-L179 HydrophobicContact CE1-CB 4.47Å; F175-L179 WeakPolarHBondContact O-CB 3.22Å; F175-L179 PolarHBondContact O-N 3.33Å; F175-L375 HydrophobicContact CB-CD1 4.44Å; F175-L375 HydrophobicContact CB-CD2 3.7Å; F175-L375 HydrophobicContact CD1-CD2 3.39Å; F175-L375 HydrophobicContact CE1-CD2 4.23Å; F175-L375 HydrophobicContact CG-CD2 3.66Å; F175-W378 HydrophobicContact CD1-CH2 4.26Å; F175-W378 HydrophobicContact CD1-CZ2 4.36Å; F175-W378 AromaticContact CE1-CH2 3.76Å; F175-W378 HydrophobicContact CE1-CH2 3.76Å; F175-W378 AromaticContact CE1-CZ2 3.86Å; F175-W378 HydrophobicContact CE1-CZ2 3.86Å
176	F	97.9	Very high	95.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.3	-33.6	176.5	-79.1	-48.3	0	0	0	113	T172 C173 N174 L179 S180 C248 T311 R312 I371 W378	T172-F176 HydrophobicContact CG2-CD2 3.73Å; T172-F176 HydrophobicContact CG2-CE2 3.38Å; T172-F176 HydrophobicContact CG2-CZ 4.15Å; T172-F176 VanDerWaalsContact O-CD2 3.28Å; T172-F176 WeakPolarHBondContact O-CD2 3.28Å; T172-F176 PolarHBondContact O-N 2.91Å; C173-F176 PolarHBondContact O-N 3.4Å; N174-F176 VanDerWaalsContact C-N 3.33Å; N174-F176 PolarHBondContact O-N 3.18Å; F176-L179 HydrophobicContact CD1-CD2 4.03Å; F176-L179 HydrophobicContact CE1-CD2 4.43Å; F176-L179 PolarHBondContact O-N 2.91Å; F176-S180 WeakPolarHBondContact O-CB 3.25Å; F176-S180 PolarHBondContact O-N 2.91Å; F176-S180 PolarHBondContact O-OG 3.39Å; F176-S180 VanDerWaalsContact O-OG 3.04Å; F176-C248 HydrophobicContact CB-CB 4.32Å; F176-C248 HydrophobicContact CD2-CB 3.94Å; F176-T311 HydrophobicContact CB-CG2 4.17Å; F176-T311 WeakPolarHBondContact CB-OG1 3.46Å; F176-T311 HydrophobicContact CD1-CG2 3.63Å; F176-T311 HydrophobicContact CE1-CG2 4.06Å; F176-T311 VanDerWaalsContact CG-CB 3.43Å; F176-T311 HydrophobicContact CG-CG2 3.9Å; F176-R312 WeakPolarHBondContact CE2-O 3.26Å; F176-I371 HydrophobicContact CE1-CB 4.4Å; F176-I371 HydrophobicContact CE1-CG2 3.93Å; F176-I371 HydrophobicContact CZ-CG2 4.24Å; F176-W378 HydrophobicContact CD1-CH2 4.43Å; F176-W378 AromaticContact CE1-CH2 3.72Å; F176-W378 HydrophobicContact CE1-CH2 3.72Å; F176-W378 AromaticContact CE1-CZ3 3.68Å; F176-W378 HydrophobicContact CE1-CZ3 3.68Å; F176-W378 HydrophobicContact CZ-CH2 4.44Å; F176-W378 HydrophobicContact CZ-CZ3 4.37Å
177	T	96.1	Very high	95.7	Very high	17 Å²	17	32.3 Å²	32.3	10%	0.104	19%	0.185	C	C	.	.	H	α-helix	trans	-63.5	-47.6	172.5	-62.7	0	0	0	0	110.9	C173 N174 F175 L179 S180 L181 Q201	C173-T177 PolarHBondContact O-N 3.14Å; C173-T177 VanDerWaalsContact O-N 3.08Å; C173-T177 PolarHBondContact O-OG1 3.08Å; C173-T177 VanDerWaalsContact O-OG1 3.13Å; N174-T177 VanDerWaalsContact O-CB 3.31Å; N174-T177 WeakPolarHBondContact O-CB 3.49Å; N174-T177 PolarHBondContact O-N 3.06Å; N174-T177 VanDerWaalsContact O-N 3.12Å; F175-T177 PolarHBondContact O-N 3Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 3.32Å; T177-S180 PolarHBondContact O-N 3.43Å; T177-L181 HydrophobicContact CG2-CD1 3.84Å; T177-L181 WeakPolarHBondContact O-CB 3.38Å; T177-L181 WeakPolarHBondContact O-CG 3.49Å; T177-L181 PolarHBondContact O-N 3.42Å; T177-Q201 HydrophobicContact CG2-CG 3.89Å
178	H	96.8	Very high	96	Very high	56 Å²	56	32.7 Å²	32.7	26%	0.259	18%	0.182	S	C	.	.	H	α-helix	trans	-61.6	-40.9	175.1	-68.8	-56.2	0	0	0	112.4	Y149 M153 E157 N174 F175 G182	Y149-H178 PolarHBondContact OH-O 2.92Å; M153-H178 HydrophobicContact CB-CB 4.22Å; M153-H178 HydrophobicContact CG-CB 4.22Å; E157-H178 IonicContact OE1-CD2 2.64Å; E157-H178 IonicContact OE1-NE2 3.23Å; N174-H178 PolarHBondContact O-CD2 3.37Å; N174-H178 PolarHBondContact O-N 2.84Å; F175-H178 CarbonylContact O-C 3.6Å; F175-H178 PolarHBondContact O-N 3.18Å; F175-H178 VanDerWaalsContact O-N 3.14Å; H178-G182 WeakPolarHBondContact O-CA 3.41Å; H178-G182 PolarHBondContact O-N 2.94Å
179	L	97.9	Very high	96	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-54	176.5	-179.9	65.3	0	0	0	111.1	F146 F150 F175 F176 T177 G182 I183 W378 C431	F146-L179 HydrophobicContact CE1-CD1 3.82Å; F146-L179 HydrophobicContact CZ-CD1 4.19Å; F150-L179 HydrophobicContact CD2-CD1 3.6Å; F150-L179 HydrophobicContact CE2-CD1 3.61Å; F175-L179 HydrophobicContact CE1-CB 4.47Å; F175-L179 WeakPolarHBondContact O-CB 3.22Å; F175-L179 PolarHBondContact O-N 3.33Å; F176-L179 HydrophobicContact CD1-CD2 4.03Å; F176-L179 HydrophobicContact CE1-CD2 4.43Å; F176-L179 PolarHBondContact O-N 2.91Å; T177-L179 VanDerWaalsContact C-N 3.34Å; T177-L179 PolarHBondContact O-N 3.32Å; L179-G182 PolarHBondContact O-N 3.42Å; L179-I183 HydrophobicContact CD1-CD1 3.79Å; L179-I183 HydrophobicContact CD1-CG1 4.31Å; L179-I183 HydrophobicContact CG-CD1 4.01Å; L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.4Å; L179-I183 PolarHBondContact O-N 3.28Å; L179-W378 HydrophobicContact CD2-CH2 4.25Å; L179-W378 HydrophobicContact CD2-CZ3 4.35Å; L179-C431 HydrophobicContact CD2-CB 4.46Å
180	S	97.2	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-48.9	-176.9	-63.5	0	0	0	0	111.8	F176 T177 I184 S249	F176-S180 WeakPolarHBondContact O-CB 3.25Å; F176-S180 PolarHBondContact O-N 2.91Å; F176-S180 PolarHBondContact O-OG 3.39Å; F176-S180 VanDerWaalsContact O-OG 3.04Å; T177-S180 PolarHBondContact O-N 3.43Å; S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 3.04Å; S180-I184 VanDerWaalsContact O-N 3.09Å; S180-S249 PolarHBondContact OG-OG 2.88Å
181	L	96.3	Very high	95.9	Very high	70 Å²	70	35.8 Å²	35.8	37%	0.366	20%	0.201	S	C	.	.	H	α-helix	trans	-67	-38.7	179.4	-66.3	171.9	0	0	0	111.9	T177 I184 T185 V199	T177-L181 HydrophobicContact CG2-CD1 3.84Å; T177-L181 WeakPolarHBondContact O-CB 3.38Å; T177-L181 WeakPolarHBondContact O-CG 3.49Å; T177-L181 PolarHBondContact O-N 3.42Å; L181-I184 PolarHBondContact O-N 3.39Å; L181-T185 VanDerWaalsContact O-CB 3.3Å; L181-T185 WeakPolarHBondContact O-CB 3.47Å; L181-T185 PolarHBondContact O-N 2.89Å; L181-T185 PolarHBondContact O-OG1 3.39Å; L181-V199 HydrophobicContact CD2-CB 4.36Å; L181-V199 HydrophobicContact CD2-CG2 4.26Å
182	G	97	Very high	95.6	Very high	2 Å²	2	39.3 Å²	39.3	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-47.1	177.2	0	0	0	0	0	112.5	F146 H178 L179 S186	F146-G182 VanDerWaalsContact CE2-C 3.41Å; H178-G182 WeakPolarHBondContact O-CA 3.41Å; H178-G182 PolarHBondContact O-N 2.94Å; L179-G182 PolarHBondContact O-N 3.42Å; G182-S186 VanDerWaalsContact O-CB 3.27Å; G182-S186 WeakPolarHBondContact O-CB 3.39Å; G182-S186 PolarHBondContact O-N 2.84Å; G182-S186 PolarHBondContact O-OG 3.42Å
183	I	97.7	Very high	95.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-49	177.1	-68.3	172.9	0	0	0	109.9	F146 L179 T185 S186 F187 L194 C431 L432 F435 F436	F146-I183 HydrophobicContact CD1-CG1 4.26Å; F146-I183 HydrophobicContact CE1-CD1 4.2Å; F146-I183 HydrophobicContact CE1-CG1 3.56Å; F146-I183 HydrophobicContact CE2-CG1 4.1Å; F146-I183 HydrophobicContact CZ-CB 4.47Å; F146-I183 HydrophobicContact CZ-CD1 4.47Å; F146-I183 HydrophobicContact CZ-CG1 3.48Å; F146-I183 VanDerWaalsContact CZ-CG1 3.48Å; L179-I183 HydrophobicContact CD1-CD1 3.79Å; L179-I183 HydrophobicContact CD1-CG1 4.31Å; L179-I183 HydrophobicContact CG-CD1 4.01Å; L179-I183 VanDerWaalsContact O-CG1 3.3Å; L179-I183 WeakPolarHBondContact O-CG1 3.4Å; L179-I183 PolarHBondContact O-N 3.28Å; I183-T185 PolarHBondContact O-N 3.15Å; I183-S186 PolarHBondContact O-N 2.65Å; I183-F187 HydrophobicContact CG2-CD2 3.99Å; I183-F187 WeakPolarHBondContact O-CB 3.43Å; I183-F187 WeakPolarHBondContact O-CD2 3.48Å; I183-F187 PolarHBondContact O-N 3.04Å; I183-L194 HydrophobicContact CG2-CD1 4.4Å; I183-C431 HydrophobicContact CD1-CB 4.47Å; I183-L432 HydrophobicContact CD1-CD2 4.12Å; I183-L432 HydrophobicContact CG1-CD2 3.96Å; I183-L432 HydrophobicContact CG2-CD2 4.18Å; I183-F435 HydrophobicContact CB-CD1 4.11Å; I183-F435 HydrophobicContact CB-CE1 4.34Å; I183-F435 HydrophobicContact CB-CG 4.42Å; I183-F435 HydrophobicContact CD1-CD1 4.26Å; I183-F435 HydrophobicContact CD1-CD2 3.66Å; I183-F435 HydrophobicContact CD1-CE1 4.34Å; I183-F435 HydrophobicContact CD1-CE2 3.76Å; I183-F435 HydrophobicContact CD1-CG 3.92Å; I183-F435 HydrophobicContact CD1-CZ 4.1Å; I183-F435 HydrophobicContact CG2-CB 3.74Å; I183-F435 HydrophobicContact CG2-CD1 3.63Å; I183-F435 HydrophobicContact CG2-CE1 4.35Å; I183-F435 HydrophobicContact CG2-CG 3.73Å; I183-F436 HydrophobicContact CG2-CE1 4.34Å
184	I	96.3	Very high	95.2	Very high	21 Å²	21	39.2 Å²	39.2	11%	0.108	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-49.1	-179.9	-70.7	166.5	0	0	0	110.6	S180 L181 S186 F187 L188 L194 V199 V251	S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 3.04Å; S180-I184 VanDerWaalsContact O-N 3.09Å; L181-I184 PolarHBondContact O-N 3.39Å; I184-S186 VanDerWaalsContact C-N 3.3Å; I184-S186 PolarHBondContact O-N 3.41Å; I184-F187 PolarHBondContact O-N 3.4Å; I184-L188 WeakPolarHBondContact O-CB 3.44Å; I184-L188 PolarHBondContact O-N 3.14Å; I184-L194 HydrophobicContact CG1-CD2 4.38Å; I184-V199 HydrophobicContact CD1-CG2 3.19Å; I184-V251 HydrophobicContact CD1-CG1 4.35Å
185	T	95.7	Very high	95.1	Very high	101 Å²	101	40.2 Å²	40.2	62%	0.62	23%	0.234	S	C	*	.	H	α-helix	trans	-62.7	-38	-178.6	-54	0	0	0	0	112.1	L181 I183	L181-T185 VanDerWaalsContact O-CB 3.3Å; L181-T185 WeakPolarHBondContact O-CB 3.47Å; L181-T185 PolarHBondContact O-N 2.89Å; L181-T185 PolarHBondContact O-OG1 3.39Å; I183-T185 PolarHBondContact O-N 3.15Å
186	S	96.3	Very high	94.8	Very high	47 Å²	47	44 Å²	44	33%	0.329	26%	0.258	S	S	.	.	H	α-helix	trans	-71.9	-31.6	-179.2	-58.6	0	0	0	0	112.8	G182 I183 I184	G182-S186 VanDerWaalsContact O-CB 3.27Å; G182-S186 WeakPolarHBondContact O-CB 3.39Å; G182-S186 PolarHBondContact O-N 2.84Å; G182-S186 PolarHBondContact O-OG 3.42Å; I183-S186 PolarHBondContact O-N 2.65Å; I184-S186 VanDerWaalsContact C-N 3.3Å; I184-S186 PolarHBondContact O-N 3.41Å
187	F	96.7	Very high	94.7	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-123.2	0.3	-166	-58.5	-65.2	0	0	0	115.5	E142 L145 F146 I183 I184 T189 T190 R191 L194 L432 F436	E142-F187 HydrophobicContact CB-CE1 3.63Å; E142-F187 HydrophobicContact CB-CZ 3.65Å; E142-F187 HydrophobicContact CG-CD1 4.13Å; E142-F187 HydrophobicContact CG-CE1 3.55Å; E142-F187 HydrophobicContact CG-CZ 4.13Å; L145-F187 HydrophobicContact CD2-CE1 4.04Å; L145-F187 HydrophobicContact CD2-CZ 4.45Å; F146-F187 HydrophobicContact CB-CE2 4.09Å; F146-F187 HydrophobicContact CB-CZ 4.03Å; F146-F187 HydrophobicContact CD2-CE2 4.2Å; F146-F187 HydrophobicContact CG-CE2 4.2Å; I183-F187 HydrophobicContact CG2-CD2 3.99Å; I183-F187 WeakPolarHBondContact O-CB 3.43Å; I183-F187 WeakPolarHBondContact O-CD2 3.48Å; I183-F187 PolarHBondContact O-N 3.04Å; I184-F187 PolarHBondContact O-N 3.4Å; F187-T189 PolarHBondContact O-N 3.31Å; F187-T189 VanDerWaalsContact O-N 3.09Å; F187-T190 PolarHBondContact O-N 2.65Å; F187-T190 PolarHBondContact O-OG1 2.94Å; F187-R191 HydrophobicContact CB-CG 4.46Å; F187-R191 PolarHBondContact O-N 3.44Å; F187-L194 HydrophobicContact CB-CD1 4.02Å; F187-L432 HydrophobicContact CD2-CD2 4.19Å; F187-L432 HydrophobicContact CE2-CD2 3.6Å; F187-L432 HydrophobicContact CZ-CD2 4.34Å; F187-F436 HydrophobicContact CB-CE1 3.82Å; F187-F436 HydrophobicContact CB-CZ 3.98Å; F187-F436 AromaticContact CD1-CZ 3.9Å; F187-F436 HydrophobicContact CD1-CZ 3.9Å; F187-F436 AromaticContact CD2-CE1 3.86Å; F187-F436 HydrophobicContact CD2-CE1 3.86Å; F187-F436 AromaticContact CD2-CZ 3.57Å; F187-F436 HydrophobicContact CD2-CZ 3.57Å; F187-F436 HydrophobicContact CE1-CZ 4.28Å; F187-F436 AromaticContact CE2-CZ 4Å; F187-F436 HydrophobicContact CE2-CZ 4Å; F187-F436 AromaticContact CG-CE1 3.84Å; F187-F436 HydrophobicContact CG-CE1 3.84Å; F187-F436 AromaticContact CG-CZ 3.52Å; F187-F436 HydrophobicContact CG-CZ 3.52Å; F187-F436 HydrophobicContact CZ-CZ 4.33Å
188	L	94.7	Very high	94.6	Very high	70 Å²	70	47 Å²	47	37%	0.366	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27	178.8	62.7	88.5	0	0	0	114.4	I184	I184-L188 WeakPolarHBondContact O-CB 3.44Å; I184-L188 PolarHBondContact O-N 3.14Å
189	T	92.4	Very high	94.6	Very high	122 Å²	122	46 Å²	46	75%	0.748	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-27.9	178.5	55.3	0	0	0	0	112.3	F187	F187-T189 PolarHBondContact O-N 3.31Å; F187-T189 VanDerWaalsContact O-N 3.09Å
190	T	92	Very high	94.5	Very high	88 Å²	88	47.6 Å²	47.6	54%	0.54	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-26.6	-179.9	57.8	0	0	0	0	112.8	F187	F187-T190 PolarHBondContact O-N 2.65Å; F187-T190 PolarHBondContact O-OG1 2.94Å
191	R	91	Very high	94.3	Very high	66 Å²	66	53.2 Å²	53.2	25%	0.249	31%	0.306	C	S	.	.			trans	-126.5	102.3	-175.3	-58.6	-63.8	-179.6	166.4	-3.8	109	E142 F187 H193 L194 F436	E142-R191 IonicContact OE1-NH2 2.69Å; F187-R191 HydrophobicContact CB-CG 4.46Å; F187-R191 PolarHBondContact O-N 3.44Å; R191-H193 VanDerWaalsContact C-N 3.28Å; R191-H193 PolarHBondContact O-N 2.98Å; R191-L194 HydrophobicContact CB-CB 4.42Å; R191-L194 HydrophobicContact CB-CD1 3.9Å; R191-L194 HydrophobicContact CB-CG 3.98Å; R191-L194 HydrophobicContact CG-CD1 4.34Å; R191-L194 PolarHBondContact O-N 3.46Å; R191-F436 HydrophobicContact CG-CD1 3.96Å; R191-F436 HydrophobicContact CG-CE1 3.99Å
192	S	88.9	Confident	94.3	Very high	78 Å²	78	54.8 Å²	54.8	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-38.2	-174.2	48.2	0	0	0	0	113	L194 S195	S192-L194 VanDerWaalsContact C-N 3.3Å; S192-L194 PolarHBondContact O-N 3.38Å; S192-S195 WeakPolarHBondContact O-CB 3.36Å; S192-S195 PolarHBondContact O-N 3.24Å; S192-S195 VanDerWaalsContact O-N 3.14Å; S192-S195 PolarHBondContact O-OG 2.96Å
193	H	91.7	Very high	94.1	Very high	23 Å²	23	54.9 Å²	54.9	11%	0.106	32%	0.315	C	S	.	.	H	α-helix	trans	-63.7	-35.2	-178.4	65.3	-76.3	0	0	0	113	R191 S195 T196 A197 F435 L439	R191-H193 VanDerWaalsContact C-N 3.28Å; R191-H193 PolarHBondContact O-N 2.98Å; H193-S195 VanDerWaalsContact C-N 3.26Å; H193-S195 PolarHBondContact O-N 2.52Å; H193-T196 PolarHBondContact O-N 3.32Å; H193-T196 PolarHBondContact O-OG1 2.96Å; H193-T196 VanDerWaalsContact O-OG1 3.12Å; H193-A197 PolarHBondContact O-N 3.05Å; H193-F435 PolarHBondContact NE2-O 2.68Å; H193-L439 HydrophobicContact CB-CD1 3.45Å; H193-L439 VanDerWaalsContact CB-CD1 3.45Å; H193-L439 HydrophobicContact CB-CG 4.34Å
194	L	94.3	Very high	93.9	Very high	1 Å²	1	57 Å²	57	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-66.4	-28.2	177.3	-62.4	-175.3	0	0	0	112.4	I183 I184 F187 R191 S192 T196 A197 L308 F435 F436	I183-L194 HydrophobicContact CG2-CD1 4.4Å; I184-L194 HydrophobicContact CG1-CD2 4.38Å; F187-L194 HydrophobicContact CB-CD1 4.02Å; R191-L194 HydrophobicContact CB-CB 4.42Å; R191-L194 HydrophobicContact CB-CD1 3.9Å; R191-L194 HydrophobicContact CB-CG 3.98Å; R191-L194 HydrophobicContact CG-CD1 4.34Å; R191-L194 PolarHBondContact O-N 3.46Å; S192-L194 VanDerWaalsContact C-N 3.3Å; S192-L194 PolarHBondContact O-N 3.38Å; L194-T196 PolarHBondContact O-N 3.05Å; L194-A197 PolarHBondContact O-N 3.22Å; L194-L308 HydrophobicContact CD2-CD2 4Å; L194-F435 HydrophobicContact CD2-CD1 4.48Å; L194-F436 HydrophobicContact CD1-CD1 4.22Å; L194-F436 HydrophobicContact CD1-CE1 3.99Å
195	S	92.3	Very high	93.8	Very high	73 Å²	73	56 Å²	56	51%	0.51	32%	0.324	S	S	.	.	H	α-helix	trans	-65.6	-24.8	178.6	75.3	0	0	0	0	113.7	S192 H193	S192-S195 WeakPolarHBondContact O-CB 3.36Å; S192-S195 PolarHBondContact O-N 3.24Å; S192-S195 VanDerWaalsContact O-N 3.14Å; S192-S195 PolarHBondContact O-OG 2.96Å; H193-S195 VanDerWaalsContact C-N 3.26Å; H193-S195 PolarHBondContact O-N 2.52Å
196	T	91.8	Very high	93.8	Very high	81 Å²	81	51.6 Å²	51.6	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-103.6	-9.5	177.7	63.1	0	0	0	0	112.8	H193 L194 Q304	H193-T196 PolarHBondContact O-N 3.32Å; H193-T196 PolarHBondContact O-OG1 2.96Å; H193-T196 VanDerWaalsContact O-OG1 3.12Å; L194-T196 PolarHBondContact O-N 3.05Å; T196-Q304 PolarHBondContact O-NE2 3.13Å
197	A	94.9	Very high	93.7	Very high	18 Å²	18	49.3 Å²	49.3	15%	0.149	28%	0.281	C	S	.	.			trans	-63.6	141.6	-173.6	0	0	0	0	0	111.4	H193 L194 V251 R252 T253	H193-A197 PolarHBondContact O-N 3.05Å; L194-A197 PolarHBondContact O-N 3.22Å; A197-V251 HydrophobicContact CB-CG1 4.1Å; A197-R252 CarbonylContact C-O 3.6Å; A197-R252 WeakPolarHBondContact CA-O 3.4Å; A197-R252 WeakPolarHBondContact CB-O 3.39Å; A197-T253 HydrophobicContact CB-CG2 4.17Å
198	Q	95.2	Very high	93.5	Very high	63 Å²	63	49.2 Å²	49.2	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.4	172.3	-77.7	177.5	-4.1	0	0	109.5	V251 R252 D302 Q304	Q198-V251 CarbonylContact O-C 3.59Å; Q198-V251 WeakPolarHBondContact O-CA 3.35Å; Q198-R252 PolarHBondContact N-O 2.93Å; Q198-R252 PolarHBondContact O-N 3.39Å; Q198-R252 VanDerWaalsContact OE1-CZ 3.24Å; Q198-D302 PolarHBondContact OE1-OD1 2.88Å; Q198-D302 PolarHBondContact OE1-OD2 3.37Å; Q198-Q304 HydrophobicContact CB-CB 4.46Å; Q198-Q304 HydrophobicContact CB-CG 4.26Å; Q198-Q304 HydrophobicContact CG-CB 4.4Å; Q198-Q304 HydrophobicContact CG-CG 3.8Å
199	V	95.9	Very high	93.5	Very high	36 Å²	36	46.1 Å²	46.1	22%	0.218	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.3	175.1	-175	0	0	0	0	108.2	L181 I184 Q250 V251	L181-V199 HydrophobicContact CD2-CB 4.36Å; L181-V199 HydrophobicContact CD2-CG2 4.26Å; I184-V199 HydrophobicContact CD1-CG2 3.19Å; V199-Q250 WeakPolarHBondContact CA-O 3.5Å; V199-V251 HydrophobicContact CG2-CG2 4.4Å
200	D	95.7	Very high	93.5	Very high	36 Å²	36	40.3 Å²	40.3	19%	0.193	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.8	173.6	-47.5	-60.6	0	0	0	109.1	S249 Q250 R252	D200-S249 CarbonylContact O-C 3.17Å; D200-S249 WeakPolarHBondContact O-CA 3.28Å; D200-S249 WeakPolarHBondContact O-CB 3Å; D200-Q250 PolarHBondContact N-O 3.36Å; D200-Q250 PolarHBondContact O-N 3.39Å; D200-R252 VanDerWaalsContact CG-NH2 3.33Å; D200-R252 IonicContact OD1-CZ 3.79Å; D200-R252 IonicContact OD1-NH2 3.3Å; D200-R252 PolarHBondContact OD1-NH2 3.11Å; D200-R252 IonicContact OD2-CZ 3.93Å; D200-R252 IonicContact OD2-NE 3.83Å; D200-R252 PolarHBondContact OD2-NE 3.24Å; D200-R252 IonicContact OD2-NH2 2.71Å; D200-R252 PolarHBondContact OD2-NH2 2.74Å
201	Q	94.5	Very high	93.5	Very high	118 Å²	118	36.9 Å²	36.9	55%	0.551	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.9	176.9	-62.4	171.2	8.3	0	0	108.9	T177 S203	T177-Q201 HydrophobicContact CG2-CG 3.89Å; Q201-S203 PolarHBondContact O-N 3.09Å
202	D	94.4	Very high	93.4	Very high	103 Å²	103	33.7 Å²	33.7	55%	0.551	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	48.6	45.2	-177.8	-167.9	37.5	0	0	0	112.1	N246 V247 C248	D202-N246 WeakPolarHBondContact OD1-CB 3.33Å; D202-N246 PolarHBondContact OD1-ND2 3.41Å; D202-N246 VanDerWaalsContact OD1-ND2 3.17Å; D202-N246 PolarHBondContact OD2-ND2 2.95Å; D202-V247 CarbonylContact C-O 3.54Å; D202-V247 WeakPolarHBondContact CA-O 3.35Å; D202-C248 PolarHBondContact N-O 2.91Å
203	S	93.9	Very high	93.4	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	130.1	-169.4	-174.6	0	0	0	0	111	Q201 C205 N246 V247 Q250 G297	Q201-S203 PolarHBondContact O-N 3.09Å; S203-C205 PolarHBondContact O-N 2.76Å; S203-N246 CarbonylContact O-C 3.53Å; S203-N246 WeakPolarHBondContact O-CA 3.08Å; S203-V247 PolarHBondContact N-O 3.46Å; S203-V247 VanDerWaalsContact O-CG2 3.31Å; S203-V247 WeakPolarHBondContact O-CG2 3.47Å; S203-V247 PolarHBondContact O-N 3.27Å; S203-Q250 PolarHBondContact OG-OE1 3.43Å; S203-G297 VanDerWaalsContact OG-CA 3.24Å; S203-G297 WeakPolarHBondContact OG-CA 3.24Å
204	P	94.3	Very high	93.3	Very high	45 Å²	45	29.2 Å²	29.2	29%	0.292	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.2	175.8	27.9	-33.4	0	0	0	110.9	V295 G297	P204-V295 HydrophobicContact CB-CG1 4.03Å; P204-V295 HydrophobicContact CG-CG1 3.76Å; P204-G297 WeakPolarHBondContact O-CA 3.38Å; P204-G297 PolarHBondContact O-N 2.99Å
205	C	94.3	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	101.6	173.1	-175.9	0	0	0	0	108.9	S203 Y243 S244 E245 V247 V295	S203-C205 PolarHBondContact O-N 2.76Å; C205-Y243 HydrophobicContact CB-CE1 4.33Å; C205-Y243 WeakPolarHBondContact O-CD1 3.12Å; C205-S244 WeakPolarHBondContact O-CA 3.44Å; C205-E245 HydrophobicContact CB-CG 4.42Å; C205-E245 PolarHBondContact N-O 2.77Å; C205-E245 PolarHBondContact O-N 3.48Å; C205-E245 VanDerWaalsContact O-N 3.13Å; C205-V247 HydrophobicContact CB-CG1 4.22Å; C205-V295 WeakPolarHBondContact CA-O 3.39Å
206	E	93.8	Very high	92.5	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.037	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.1	179.6	-56.3	-168.1	-129.6	0	0	111.5	Y243 R288 R293 V295	E206-Y243 VanDerWaalsContact CA-O 3.29Å; E206-Y243 WeakPolarHBondContact CA-O 3.44Å; E206-R288 IonicContact OE2-CZ 3.51Å; E206-R288 IonicContact OE2-NH1 2.61Å; E206-R288 IonicContact OE2-NH2 3.69Å; E206-R288 PolarHBondContact OE2-NH2 3.1Å; E206-R293 HydrophobicContact CB-CB 4.39Å; E206-R293 IonicContact OE1-CZ 3.99Å; E206-R293 IonicContact OE1-NE 2.97Å; E206-R293 PolarHBondContact OE1-NE 2.79Å; E206-R293 IonicContact OE1-NH2 4Å; E206-R293 PolarHBondContact OE1-NH2 3.4Å; E206-R293 IonicContact OE2-CZ 2.79Å; E206-R293 IonicContact OE2-NE 3.98Å; E206-R293 PolarHBondContact OE2-NE 3.5Å; E206-R293 VanDerWaalsContact OE2-NE 3.11Å; E206-R293 IonicContact OE2-NH2 2.84Å; E206-R293 PolarHBondContact OE2-NH2 3.2Å; E206-V295 HydrophobicContact CB-CB 3.98Å; E206-V295 HydrophobicContact CB-CG2 4.13Å; E206-V295 HydrophobicContact CG-CB 4.31Å; E206-V295 HydrophobicContact CG-CG2 4.4Å; E206-V295 PolarHBondContact N-O 2.84Å; E206-V295 PolarHBondContact O-N 3.03Å
207	A	94.4	Very high	92.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.1	179	0	0	0	0	0	111.9	S242 Y243 M294 A345 I348	A207-S242 CarbonylContact O-C 3.55Å; A207-S242 WeakPolarHBondContact O-CA 3.46Å; A207-S242 WeakPolarHBondContact O-CB 3.35Å; A207-Y243 PolarHBondContact N-O 3.45Å; A207-Y243 PolarHBondContact O-N 3.48Å; A207-M294 HydrophobicContact CB-SD 4.11Å; A207-A345 HydrophobicContact CB-CB 3.75Å; A207-I348 HydrophobicContact CB-CB 4.43Å; A207-I348 HydrophobicContact CB-CG2 4Å
208	F	93.5	Very high	91.7	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.009	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.3	173.2	166.4	-93.1	0	0	0	109.3	V74 S75 V210 A240 F241 L292 M294	V74-F208 WeakPolarHBondContact O-CE1 3.12Å; S75-F208 WeakPolarHBondContact OG-CD1 3.39Å; F208-V210 HydrophobicContact CE1-CG2 4.03Å; F208-V210 HydrophobicContact CZ-CG2 3.82Å; F208-A240 HydrophobicContact CE2-CB 3.66Å; F208-A240 HydrophobicContact CZ-CB 4.12Å; F208-F241 WeakPolarHBondContact CA-O 3.39Å; F208-F241 WeakPolarHBondContact CD2-O 3.45Å; F208-L292 HydrophobicContact CD2-CD1 3.73Å; F208-L292 HydrophobicContact CD2-CD2 3.95Å; F208-L292 HydrophobicContact CD2-CG 4.3Å; F208-L292 HydrophobicContact CE2-CD1 3.57Å; F208-L292 HydrophobicContact CE2-CD2 4.41Å; F208-L292 HydrophobicContact CG-CD1 4.48Å; F208-L292 HydrophobicContact CZ-CD1 4.26Å; F208-M294 HydrophobicContact CB-CE 4.18Å; F208-M294 WeakPolarHBondContact O-CE 3.4Å
209	W	93.9	Very high	90.8	Very high	5 Å²	5	32.7 Å²	32.7	2%	0.019	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	167.7	172.7	70.6	102.6	0	0	0	111.1	V105 V121 F241 F344 I348	V105-W209 HydrophobicContact CB-CH2 4.11Å; V105-W209 HydrophobicContact CG2-CH2 3.67Å; V105-W209 HydrophobicContact CG2-CZ2 3.86Å; V121-W209 HydrophobicContact CG2-CZ2 4.31Å; V121-W209 PolarHBondContact O-NE1 2.9Å; W209-F241 HydrophobicContact CD2-CB 3.88Å; W209-F241 VanDerWaalsContact CE2-CB 3.46Å; W209-F241 HydrophobicContact CE3-CB 4.29Å; W209-F241 HydrophobicContact CH2-CB 3.96Å; W209-F241 HydrophobicContact CZ2-CB 3.51Å; W209-F241 HydrophobicContact CZ2-CG 4.24Å; W209-F241 HydrophobicContact CZ3-CB 4.32Å; W209-F241 PolarHBondContact N-O 3.26Å; W209-F241 PolarHBondContact O-N 3.05Å; W209-F344 AromaticContact CD2-CE1 3.6Å; W209-F344 HydrophobicContact CD2-CE1 3.6Å; W209-F344 HydrophobicContact CD2-CZ 4.26Å; W209-F344 AromaticContact CE2-CE1 3.58Å; W209-F344 AromaticContact CE3-CE1 3.89Å; W209-F344 HydrophobicContact CE3-CE1 3.89Å; W209-F344 HydrophobicContact CG-CE1 4.03Å; W209-F344 HydrophobicContact CG-CZ 4.21Å; W209-F344 HydrophobicContact CH2-CD1 4.45Å; W209-F344 HydrophobicContact CH2-CE1 4.18Å; W209-F344 HydrophobicContact CZ2-CD1 4.45Å; W209-F344 AromaticContact CZ2-CE1 3.89Å; W209-F344 HydrophobicContact CZ2-CE1 3.89Å; W209-F344 HydrophobicContact CZ3-CE1 4.18Å; W209-F344 AromaticContact NE1-CE1 3.96Å; W209-I348 HydrophobicContact CB-CD1 3.98Å; W209-I348 HydrophobicContact CG-CD1 4.37Å
210	V	92.2	Very high	89.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.8	178	-178.6	0	0	0	0	108.6	F208 E238 L239 L390 I391	F208-V210 HydrophobicContact CE1-CG2 4.03Å; F208-V210 HydrophobicContact CZ-CG2 3.82Å; V210-E238 HydrophobicContact CG1-CB 3.82Å; V210-L239 WeakPolarHBondContact CA-O 3.19Å; V210-L390 CarbonylContact O-C 3.58Å; V210-L390 WeakPolarHBondContact O-CB 3.47Å; V210-I391 HydrophobicContact CB-CD1 4.47Å; V210-I391 HydrophobicContact CB-CG1 3.87Å; V210-I391 HydrophobicContact CG1-CG1 3.92Å
211	R	92.4	Very high	87.9	Confident	15 Å²	15	41.4 Å²	41.4	6%	0.057	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	177.5	-179.6	67.3	-179.9	141.1	-4.8	110.3	Y120 F214 E238 L239 F241 L390	Y120-R211 HydrophobicContact CE1-CG 4.23Å; Y120-R211 PolarHBondContact O-NE 2.66Å; R211-F214 HydrophobicContact CB-CE2 4.15Å; R211-F214 HydrophobicContact CG-CE2 3.88Å; R211-E238 CarbonylContact O-C 3.57Å; R211-L239 PolarHBondContact N-O 3.45Å; R211-L239 PolarHBondContact O-N 2.74Å; R211-F241 HydrophobicContact CB-CD2 3.99Å; R211-F241 HydrophobicContact CB-CE2 3.81Å; R211-L390 WeakPolarHBondContact CD-O 3.12Å; R211-L390 PolarHBondContact NH1-O 2.8Å
212	G	90.3	Very high	86	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.257	C	S	.	.			trans	-81.6	172.3	171.3	0	0	0	0	0	113.3	Y120 G237 L390 I391	Y120-G212 PolarHBondContact OH-O 2.85Å; G212-G237 CarbonylContact C-O 3.59Å; G212-G237 WeakPolarHBondContact CA-O 3.36Å; G212-L390 PolarHBondContact N-O 2.71Å; G212-I391 WeakPolarHBondContact CA-O 2.79Å
213	G	88.5	Confident	84.2	Confident	7 Å²	7	48.1 Å²	48.1	7%	0.072	27%	0.273	C	S	.	.			trans	106.2	1	172.1	0	0	0	0	0	114.1	Y120 Q215 G237 I277 S393	Y120-G213 WeakPolarHBondContact OH-CA 3.47Å; G213-Q215 VanDerWaalsContact CA-OE1 3.23Å; G213-Q215 PolarHBondContact O-N 2.87Å; G213-G237 PolarHBondContact N-O 2.93Å; G213-I277 WeakPolarHBondContact O-CD1 3.33Å; G213-S393 WeakPolarHBondContact CA-OG 3.23Å
214	F	89.3	Confident	82.5	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-88.6	21.6	178.2	-61.9	-86.2	0	0	0	112.8	F117 Y120 V121 R211 S216 L217 G237 L239 F241 I277	F117-F214 HydrophobicContact CE2-CE1 4.46Å; F117-F214 HydrophobicContact CE2-CZ 4.49Å; Y120-F214 HydrophobicContact CD1-CZ 4.18Å; Y120-F214 HydrophobicContact CE1-CE1 4.17Å; Y120-F214 AromaticContact CE1-CE2 3.97Å; Y120-F214 HydrophobicContact CE1-CE2 3.97Å; Y120-F214 AromaticContact CE1-CZ 3.63Å; Y120-F214 HydrophobicContact CE1-CZ 3.63Å; V121-F214 HydrophobicContact CG1-CZ 4.44Å; R211-F214 HydrophobicContact CB-CE2 4.15Å; R211-F214 HydrophobicContact CG-CE2 3.88Å; F214-S216 PolarHBondContact O-N 2.97Å; F214-L217 HydrophobicContact CB-CD1 4.02Å; F214-L217 HydrophobicContact CB-CG 4.3Å; F214-L217 HydrophobicContact CD1-CD1 3.85Å; F214-L217 HydrophobicContact CD1-CG 4.48Å; F214-L217 HydrophobicContact CG-CD1 4.39Å; F214-L217 WeakPolarHBondContact O-CB 3.28Å; F214-L217 PolarHBondContact O-N 2.75Å; F214-G237 PolarHBondContact N-O 3.46Å; F214-G237 VanDerWaalsContact N-O 3.12Å; F214-L239 HydrophobicContact CB-CD1 3.92Å; F214-L239 HydrophobicContact CB-CG 3.96Å; F214-L239 HydrophobicContact CD1-CD1 3.68Å; F214-L239 HydrophobicContact CD1-CG 4.44Å; F214-L239 HydrophobicContact CD2-CB 4.01Å; F214-L239 HydrophobicContact CD2-CD1 3.77Å; F214-L239 HydrophobicContact CD2-CG 3.68Å; F214-L239 HydrophobicContact CE1-CD1 4.08Å; F214-L239 HydrophobicContact CE2-CB 4.18Å; F214-L239 HydrophobicContact CE2-CD1 4.15Å; F214-L239 HydrophobicContact CE2-CG 4.25Å; F214-L239 HydrophobicContact CG-CD1 3.5Å; F214-L239 HydrophobicContact CG-CG 3.78Å; F214-L239 HydrophobicContact CZ-CD1 4.29Å; F214-F241 AromaticContact CE2-CE2 3.93Å; F214-F241 HydrophobicContact CE2-CE2 3.93Å; F214-F241 HydrophobicContact CE2-CZ 4.08Å; F214-F241 HydrophobicContact CZ-CE2 4.16Å; F214-F241 AromaticContact CZ-CZ 3.86Å; F214-F241 HydrophobicContact CZ-CZ 3.86Å; F214-I277 HydrophobicContact CD1-CG2 3.69Å; F214-I277 HydrophobicContact CE1-CG2 4.19Å; F214-I277 HydrophobicContact CG-CG2 4.44Å
215	Q	85.6	Confident	81.2	Confident	75 Å²	75	55.8 Å²	55.8	35%	0.35	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64.7	-31.4	-178.8	-62.9	85.8	16.9	0	0	111.8	G213 L217 Y218 W236	G213-Q215 VanDerWaalsContact CA-OE1 3.23Å; G213-Q215 PolarHBondContact O-N 2.87Å; Q215-L217 PolarHBondContact O-N 3.48Å; Q215-L217 VanDerWaalsContact O-N 3.17Å; Q215-Y218 WeakPolarHBondContact O-CB 3.4Å; Q215-Y218 PolarHBondContact O-N 3.08Å; Q215-W236 WeakPolarHBondContact CG-O 3.14Å; Q215-W236 PolarHBondContact NE2-O 3.46Å
216	S	85	Confident	80	Confident	87 Å²	87	62 Å²	62	61%	0.608	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-63.6	-15.7	177.4	55.2	0	0	0	0	114.2	F214 Y218	F214-S216 PolarHBondContact O-N 2.97Å; S216-Y218 PolarHBondContact O-N 3.39Å
217	L	85.1	Confident	79.2	Confident	44 Å²	44	65.6 Å²	65.6	23%	0.23	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-75.7	-14	174.8	-59.3	-173.5	0	0	0	112.6	F214 Q215 I228 L239 I277	F214-L217 HydrophobicContact CB-CD1 4.02Å; F214-L217 HydrophobicContact CB-CG 4.3Å; F214-L217 HydrophobicContact CD1-CD1 3.85Å; F214-L217 HydrophobicContact CD1-CG 4.48Å; F214-L217 HydrophobicContact CG-CD1 4.39Å; F214-L217 WeakPolarHBondContact O-CB 3.28Å; F214-L217 PolarHBondContact O-N 2.75Å; Q215-L217 PolarHBondContact O-N 3.48Å; Q215-L217 VanDerWaalsContact O-N 3.17Å; L217-I228 HydrophobicContact CB-CD1 3.4Å; L217-I228 VanDerWaalsContact CB-CD1 3.4Å; L217-I228 HydrophobicContact CD1-CD1 4.11Å; L217-I228 HydrophobicContact CG-CD1 4.42Å; L217-L239 HydrophobicContact CD1-CD1 4.41Å; L217-I277 HydrophobicContact CD2-CG2 4.48Å
218	Y	83.4	Confident	78.5	Confident	21 Å²	21	67 Å²	67	8%	0.082	36%	0.361	C	S	.	.	S	Bend	trans	-89.6	140.3	176	-71.8	-85.9	0	0	0	110.8	Q215 S216 I228 D231	Q215-Y218 WeakPolarHBondContact O-CB 3.4Å; Q215-Y218 PolarHBondContact O-N 3.08Å; S216-Y218 PolarHBondContact O-N 3.39Å; Y218-I228 HydrophobicContact CD1-CD1 4.48Å; Y218-I228 HydrophobicContact CD2-CD1 3.98Å; Y218-I228 HydrophobicContact CE1-CD1 4.16Å; Y218-I228 HydrophobicContact CE1-CG1 3.94Å; Y218-I228 HydrophobicContact CE2-CD1 3.59Å; Y218-I228 HydrophobicContact CE2-CG1 4.07Å; Y218-I228 HydrophobicContact CG-CD1 4.41Å; Y218-I228 PolarHBondContact OH-N 2.93Å; Y218-I228 VanDerWaalsContact OH-N 3.08Å; Y218-D231 WeakPolarHBondContact CE2-OD2 3.49Å; Y218-D231 WeakPolarHBondContact OH-CB 3.33Å; Y218-D231 PolarHBondContact OH-OD2 3.3Å
219	P	76.8	Confident	77.8	Confident	81 Å²	81	68.7 Å²	68.7	53%	0.526	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-63.5	137.3	176.2	24.8	-31.8	0	0	0	111.3	G221	P219-G221 PolarHBondContact O-N 2.99Å
220	D	69.9	Low	77.1	Confident	168 Å²	168	68.6 Å²	68.6	90%	0.898	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	133.6	179.8	-73.2	-38.4	0	0	0	112	E222	D220-E222 PolarHBondContact O-N 2.93Å
221	G	60.6	Low	76.7	Confident	88 Å²	88	68.6 Å²	68.6	91%	0.907	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-9.3	164.7	0	0	0	0	0	116.9	P219	P219-G221 PolarHBondContact O-N 2.99Å
222	E	54.3	Low	76	Confident	157 Å²	157	68.7 Å²	68.7	73%	0.734	38%	0.376	S	S	*	.	S	Bend	trans	-112.7	131.8	170.5	-72.6	-172.8	168.8	0	0	110.2	D220 S224	D220-E222 PolarHBondContact O-N 2.93Å; E222-S224 PolarHBondContact O-N 3.2Å
223	K	56.7	Low	75.5	Confident	204 Å²	204	73.5 Å²	73.5	89%	0.887	40%	0.395	S	S	*	.			trans	-62.8	90.3	161.7	-72.5	-174.3	179.4	-175.4	0	106.1	Q225	K223-Q225 PolarHBondContact O-N 2.88Å
224	S	58.8	Low	74.9	Confident	23 Å²	23	75.9 Å²	75.9	16%	0.161	41%	0.409	C	S	.	.			trans	-49.8	116.9	177.5	178.1	0	0	0	0	107.3	E222 N226 P234	E222-S224 PolarHBondContact O-N 3.2Å; S224-N226 PolarHBondContact O-N 3.1Å; S224-N226 PolarHBondContact OG-N 2.9Å; S224-N226 PolarHBondContact OG-O 2.67Å; S224-P234 WeakPolarHBondContact O-CB 3.36Å
225	Q	65.7	Low	74.5	Confident	186 Å²	186	77.5 Å²	77.5	87%	0.869	43%	0.426	S	S	*	.	S	Bend	trans	-69.2	-21.3	172.4	-67.2	-122.7	-29.8	0	0	110.4	K223	K223-Q225 PolarHBondContact O-N 2.88Å
226	N	70.4	Confident	74.4	Confident	130 Å²	130	76.3 Å²	76.3	70%	0.695	42%	0.418	S	S	*	.	S	Bend	trans	-88.3	116	179	-66	-17.1	0	0	0	109.9	S224	S224-N226 PolarHBondContact O-N 3.1Å; S224-N226 PolarHBondContact OG-N 2.9Å; S224-N226 PolarHBondContact OG-O 2.67Å
227	R	75.8	Confident	74.5	Confident	84 Å²	84	72.1 Å²	72.1	32%	0.317	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-68.8	131.9	168	156.6	169.9	64.4	172.4	10	109.5	E98 D231 P234	E98-R227 IonicContact OE2-CZ 3.17Å; E98-R227 IonicContact OE2-NH2 3.92Å; E98-R227 PolarHBondContact OE2-NH2 3.5Å; R227-D231 WeakPolarHBondContact CD-O 3.01Å; R227-D231 HydrophobicContact CG-CB 4.27Å; R227-P234 HydrophobicContact CB-CG 4.06Å
228	I	80	Confident	74.7	Confident	31 Å²	31	70.2 Å²	70.2	16%	0.159	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-67.6	141.1	162.6	-64.7	175.6	0	0	0	107.5	L217 Y218 G230 D231 L239	L217-I228 HydrophobicContact CB-CD1 3.4Å; L217-I228 VanDerWaalsContact CB-CD1 3.4Å; L217-I228 HydrophobicContact CD1-CD1 4.11Å; L217-I228 HydrophobicContact CG-CD1 4.42Å; Y218-I228 HydrophobicContact CD1-CD1 4.48Å; Y218-I228 HydrophobicContact CD2-CD1 3.98Å; Y218-I228 HydrophobicContact CE1-CD1 4.16Å; Y218-I228 HydrophobicContact CE1-CG1 3.94Å; Y218-I228 HydrophobicContact CE2-CD1 3.59Å; Y218-I228 HydrophobicContact CE2-CG1 4.07Å; Y218-I228 HydrophobicContact CG-CD1 4.41Å; Y218-I228 PolarHBondContact OH-N 2.93Å; Y218-I228 VanDerWaalsContact OH-N 3.08Å; I228-G230 PolarHBondContact O-N 3.48Å; I228-D231 WeakPolarHBondContact O-CB 3.38Å; I228-D231 PolarHBondContact O-N 3.08Å; I228-L239 HydrophobicContact CB-CD2 4.31Å; I228-L239 HydrophobicContact CG2-CD2 3.87Å
229	T	79.8	Confident	75	Confident	36 Å²	36	69.2 Å²	69.2	22%	0.221	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	131.1	-179.6	-53.1	0	0	0	0	110.8	R101 Y103 D231 I287	R101-T229 HydrophobicContact CB-CG2 3.82Å; Y103-T229 WeakPolarHBondContact CE2-O 3.35Å; Y103-T229 WeakPolarHBondContact OH-CB 3.41Å; Y103-T229 PolarHBondContact OH-O 3.44Å; T229-D231 VanDerWaalsContact C-N 3.28Å; T229-D231 PolarHBondContact O-N 3.04Å; T229-I287 HydrophobicContact CG2-CD1 3.67Å; T229-I287 HydrophobicContact CG2-CG1 3.87Å; T229-I287 HydrophobicContact CG2-CG2 4.17Å
230	G	79	Confident	75.7	Confident	4 Å²	4	65.3 Å²	65.3	4%	0.041	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-1.6	-179.9	0	0	0	0	0	117	R101 I228 A240	R101-G230 WeakPolarHBondContact O-CA 3.42Å; I228-G230 PolarHBondContact O-N 3.48Å; G230-A240 PolarHBondContact O-N 3.25Å
231	D	83.1	Confident	76.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-72.4	144.9	163	-154.6	-11.8	0	0	0	110.6	Y218 R227 I228 T229 Y233 W236 G237 E238 L239	Y218-D231 WeakPolarHBondContact CE2-OD2 3.49Å; Y218-D231 WeakPolarHBondContact OH-CB 3.33Å; Y218-D231 PolarHBondContact OH-OD2 3.3Å; R227-D231 WeakPolarHBondContact CD-O 3.01Å; R227-D231 HydrophobicContact CG-CB 4.27Å; I228-D231 WeakPolarHBondContact O-CB 3.38Å; I228-D231 PolarHBondContact O-N 3.08Å; T229-D231 VanDerWaalsContact C-N 3.28Å; T229-D231 PolarHBondContact O-N 3.04Å; D231-Y233 VanDerWaalsContact CG-O 3.23Å; D231-Y233 PolarHBondContact OD1-N 3.37Å; D231-Y233 VanDerWaalsContact OD2-O 3.05Å; D231-W236 PolarHBondContact OD2-N 3.32Å; D231-G237 PolarHBondContact OD2-N 2.97Å; D231-E238 WeakPolarHBondContact CA-O 3.49Å; D231-E238 PolarHBondContact OD1-N 2.66Å; D231-L239 HydrophobicContact CB-CD2 3.95Å
232	A	78.6	Confident	78.4	Confident	16 Å²	16	53.1 Å²	53.1	13%	0.132	26%	0.264	C	S	.	.	S	Bend	trans	-70.2	-49.5	172.8	0	0	0	0	0	111
233	Y	78.2	Confident	80.3	Confident	101 Å²	101	45.7 Å²	45.7	40%	0.396	23%	0.229	S	C	.	.	S	Bend	trans	-136.1	127.4	-166.3	-67.4	-73.6	0	0	0	107.8	E53 D231 G235 W236	E53-Y233 VanDerWaalsContact OE1-CZ 3.25Å; E53-Y233 PolarHBondContact OE1-OH 3.29Å; D231-Y233 VanDerWaalsContact CG-O 3.23Å; D231-Y233 PolarHBondContact OD1-N 3.37Å; D231-Y233 VanDerWaalsContact OD2-O 3.05Å; Y233-G235 PolarHBondContact O-N 2.98Å; Y233-W236 AromaticContact CD2-CD2 3.73Å; Y233-W236 HydrophobicContact CD2-CD2 3.73Å; Y233-W236 AromaticContact CD2-CE2 3.88Å; Y233-W236 AromaticContact CD2-CE3 3.43Å; Y233-W236 HydrophobicContact CD2-CE3 3.43Å; Y233-W236 VanDerWaalsContact CD2-CE3 3.43Å; Y233-W236 AromaticContact CD2-CH2 3.52Å; Y233-W236 HydrophobicContact CD2-CH2 3.52Å; Y233-W236 AromaticContact CD2-CZ2 3.8Å; Y233-W236 HydrophobicContact CD2-CZ2 3.8Å; Y233-W236 AromaticContact CD2-CZ3 3.33Å; Y233-W236 HydrophobicContact CD2-CZ3 3.33Å; Y233-W236 HydrophobicContact CE2-CE3 4.21Å; Y233-W236 AromaticContact CE2-CH2 3.64Å; Y233-W236 HydrophobicContact CE2-CH2 3.64Å; Y233-W236 HydrophobicContact CE2-CZ2 4.22Å; Y233-W236 AromaticContact CE2-CZ3 3.64Å; Y233-W236 HydrophobicContact CE2-CZ3 3.64Å; Y233-W236 HydrophobicContact CG-CD2 4Å; Y233-W236 AromaticContact CG-CE2 3.93Å; Y233-W236 HydrophobicContact CG-CE3 4.18Å; Y233-W236 HydrophobicContact CG-CH2 4.25Å; Y233-W236 HydrophobicContact CG-CZ2 4.06Å; Y233-W236 HydrophobicContact CG-CZ3 4.31Å; Y233-W236 WeakPolarHBondContact O-CB 3.36Å; Y233-W236 PolarHBondContact O-N 3Å; Y233-W236 VanDerWaalsContact O-N 3.1Å
234	P	76.6	Confident	82	Confident	58 Å²	58	37.6 Å²	37.6	38%	0.377	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	129.1	179.9	-21.2	27.5	0	0	0	112.5	S224 R227	S224-P234 WeakPolarHBondContact O-CB 3.36Å; R227-P234 HydrophobicContact CB-CG 4.06Å
235	G	80.1	Confident	83.6	Confident	34 Å²	34	37.5 Å²	37.5	35%	0.351	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-0.4	177.7	0	0	0	0	0	114.7	Y233	Y233-G235 PolarHBondContact O-N 2.98Å
236	W	84.2	Confident	85	Confident	49 Å²	49	32.9 Å²	32.9	19%	0.186	18%	0.176	C	C	.	.	S	Bend	trans	-81.7	-26.3	178.1	-78.1	31.6	0	0	0	112.6	K50 E53 Q215 D231 Y233 E238	K50-W236 HydrophobicContact CB-CZ2 4.31Å; K50-W236 HydrophobicContact CD-CD2 4.02Å; K50-W236 HydrophobicContact CD-CE3 4.2Å; K50-W236 HydrophobicContact CD-CG 4.25Å; K50-W236 HydrophobicContact CG-CD2 3.88Å; K50-W236 HydrophobicContact CG-CE3 3.82Å; K50-W236 HydrophobicContact CG-CH2 4.04Å; K50-W236 HydrophobicContact CG-CZ2 4.1Å; K50-W236 HydrophobicContact CG-CZ3 3.89Å; K50-W236 PolarHBondContact NZ-O 3.13Å; E53-W236 HydrophobicContact CB-CH2 4.25Å; E53-W236 HydrophobicContact CG-CH2 4.33Å; E53-W236 WeakPolarHBondContact OE2-CH2 3.41Å; Q215-W236 WeakPolarHBondContact CG-O 3.14Å; Q215-W236 PolarHBondContact NE2-O 3.46Å; D231-W236 PolarHBondContact OD2-N 3.32Å; Y233-W236 AromaticContact CD2-CD2 3.73Å; Y233-W236 HydrophobicContact CD2-CD2 3.73Å; Y233-W236 AromaticContact CD2-CE2 3.88Å; Y233-W236 AromaticContact CD2-CE3 3.43Å; Y233-W236 HydrophobicContact CD2-CE3 3.43Å; Y233-W236 VanDerWaalsContact CD2-CE3 3.43Å; Y233-W236 AromaticContact CD2-CH2 3.52Å; Y233-W236 HydrophobicContact CD2-CH2 3.52Å; Y233-W236 AromaticContact CD2-CZ2 3.8Å; Y233-W236 HydrophobicContact CD2-CZ2 3.8Å; Y233-W236 AromaticContact CD2-CZ3 3.33Å; Y233-W236 HydrophobicContact CD2-CZ3 3.33Å; Y233-W236 HydrophobicContact CE2-CE3 4.21Å; Y233-W236 AromaticContact CE2-CH2 3.64Å; Y233-W236 HydrophobicContact CE2-CH2 3.64Å; Y233-W236 HydrophobicContact CE2-CZ2 4.22Å; Y233-W236 AromaticContact CE2-CZ3 3.64Å; Y233-W236 HydrophobicContact CE2-CZ3 3.64Å; Y233-W236 HydrophobicContact CG-CD2 4Å; Y233-W236 AromaticContact CG-CE2 3.93Å; Y233-W236 HydrophobicContact CG-CE3 4.18Å; Y233-W236 HydrophobicContact CG-CH2 4.25Å; Y233-W236 HydrophobicContact CG-CZ2 4.06Å; Y233-W236 HydrophobicContact CG-CZ3 4.31Å; Y233-W236 WeakPolarHBondContact O-CB 3.36Å; Y233-W236 PolarHBondContact O-N 3Å; Y233-W236 VanDerWaalsContact O-N 3.1Å; W236-E238 VanDerWaalsContact C-N 3.34Å; W236-E238 HydrophobicContact CB-CG 4.21Å
237	G	87	Confident	86.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.			trans	66.6	36.5	178.4	0	0	0	0	0	112.3	G212 G213 F214 D231	G212-G237 CarbonylContact C-O 3.59Å; G212-G237 WeakPolarHBondContact CA-O 3.36Å; G213-G237 PolarHBondContact N-O 2.93Å; F214-G237 PolarHBondContact N-O 3.46Å; F214-G237 VanDerWaalsContact N-O 3.12Å; D231-G237 PolarHBondContact OD2-N 2.97Å
238	E	88.9	Confident	87.1	Confident	3 Å²	3	23 Å²	23	1%	0.014	13%	0.13	C	C	.	.			trans	-110.4	82.6	-178.9	-67.7	-179.7	-176.2	0	0	110.7	K50 R54 V210 R211 D231 W236 I391	K50-E238 WeakPolarHBondContact CE-OE1 3.45Å; K50-E238 IonicContact NZ-OE1 3.53Å; K50-E238 PolarHBondContact NZ-OE1 3.38Å; K50-E238 VanDerWaalsContact NZ-OE1 3.17Å; R54-E238 IonicContact CZ-OE1 2.81Å; R54-E238 IonicContact NE-OE1 2.76Å; R54-E238 PolarHBondContact NE-OE1 2.86Å; R54-E238 IonicContact NH2-OE1 3.91Å; R54-E238 PolarHBondContact NH2-OE1 2.95Å; V210-E238 HydrophobicContact CG1-CB 3.82Å; R211-E238 CarbonylContact O-C 3.57Å; D231-E238 WeakPolarHBondContact CA-O 3.49Å; D231-E238 PolarHBondContact OD1-N 2.66Å; W236-E238 VanDerWaalsContact C-N 3.34Å; W236-E238 HydrophobicContact CB-CG 4.21Å; E238-I391 HydrophobicContact CG-CG2 4.03Å; E238-I391 VanDerWaalsContact OE1-CG2 3.32Å; E238-I391 WeakPolarHBondContact OE1-CG2 3.49Å
239	L	90.4	Very high	87.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.6	-175.1	-56.4	-174.4	0	0	0	111	Y103 V210 R211 F214 L217 I228 D231 F241 P280	Y103-L239 HydrophobicContact CE2-CD1 4.23Å; V210-L239 WeakPolarHBondContact CA-O 3.19Å; R211-L239 PolarHBondContact N-O 3.45Å; R211-L239 PolarHBondContact O-N 2.74Å; F214-L239 HydrophobicContact CB-CD1 3.92Å; F214-L239 HydrophobicContact CB-CG 3.96Å; F214-L239 HydrophobicContact CD1-CD1 3.68Å; F214-L239 HydrophobicContact CD1-CG 4.44Å; F214-L239 HydrophobicContact CD2-CB 4.01Å; F214-L239 HydrophobicContact CD2-CD1 3.77Å; F214-L239 HydrophobicContact CD2-CG 3.68Å; F214-L239 HydrophobicContact CE1-CD1 4.08Å; F214-L239 HydrophobicContact CE2-CB 4.18Å; F214-L239 HydrophobicContact CE2-CD1 4.15Å; F214-L239 HydrophobicContact CE2-CG 4.25Å; F214-L239 HydrophobicContact CG-CD1 3.5Å; F214-L239 HydrophobicContact CG-CG 3.78Å; F214-L239 HydrophobicContact CZ-CD1 4.29Å; L217-L239 HydrophobicContact CD1-CD1 4.41Å; I228-L239 HydrophobicContact CB-CD2 4.31Å; I228-L239 HydrophobicContact CG2-CD2 3.87Å; D231-L239 HydrophobicContact CB-CD2 3.95Å; L239-F241 HydrophobicContact CB-CE2 3.74Å; L239-F241 HydrophobicContact CB-CZ 4.02Å; L239-F241 VanDerWaalsContact O-CD2 3.31Å; L239-F241 WeakPolarHBondContact O-CD2 3.13Å; L239-F241 WeakPolarHBondContact O-CE2 3.42Å; L239-P280 HydrophobicContact CD1-CG 3.78Å
240	A	91.5	Very high	88.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.8	171.9	0	0	0	0	0	111.9	R100 S102 Y103 F208 G230	R100-A240 HydrophobicContact CG-CB 4.02Å; S102-A240 CarbonylContact C-O 3.59Å; S102-A240 WeakPolarHBondContact CA-O 3.21Å; Y103-A240 PolarHBondContact N-O 3.47Å; F208-A240 HydrophobicContact CE2-CB 3.66Å; F208-A240 HydrophobicContact CZ-CB 4.12Å; G230-A240 PolarHBondContact O-N 3.25Å
241	F	93.3	Very high	89.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.2	176	-65.4	-84.6	0	0	0	109.8	Y103 V105 F117 V121 F208 W209 R211 F214 L239 P280 L285	Y103-F241 HydrophobicContact CD2-CE1 4.38Å; Y103-F241 CarbonylContact O-C 3.56Å; Y103-F241 WeakPolarHBondContact O-CA 3.35Å; V105-F241 HydrophobicContact CG2-CB 4.13Å; V105-F241 HydrophobicContact CG2-CD1 3.87Å; V105-F241 HydrophobicContact CG2-CG 4.39Å; F117-F241 HydrophobicContact CE1-CE1 4.22Å; F117-F241 AromaticContact CZ-CE1 3.8Å; F117-F241 HydrophobicContact CZ-CE1 3.8Å; F117-F241 HydrophobicContact CZ-CZ 4.09Å; V121-F241 HydrophobicContact CG1-CE1 4.03Å; V121-F241 HydrophobicContact CG1-CE2 4.14Å; V121-F241 HydrophobicContact CG1-CZ 3.81Å; F208-F241 WeakPolarHBondContact CA-O 3.39Å; F208-F241 WeakPolarHBondContact CD2-O 3.45Å; W209-F241 HydrophobicContact CD2-CB 3.88Å; W209-F241 VanDerWaalsContact CE2-CB 3.46Å; W209-F241 HydrophobicContact CE3-CB 4.29Å; W209-F241 HydrophobicContact CH2-CB 3.96Å; W209-F241 HydrophobicContact CZ2-CB 3.51Å; W209-F241 HydrophobicContact CZ2-CG 4.24Å; W209-F241 HydrophobicContact CZ3-CB 4.32Å; W209-F241 PolarHBondContact N-O 3.26Å; W209-F241 PolarHBondContact O-N 3.05Å; R211-F241 HydrophobicContact CB-CD2 3.99Å; R211-F241 HydrophobicContact CB-CE2 3.81Å; F214-F241 AromaticContact CE2-CE2 3.93Å; F214-F241 HydrophobicContact CE2-CE2 3.93Å; F214-F241 HydrophobicContact CE2-CZ 4.08Å; F214-F241 HydrophobicContact CZ-CE2 4.16Å; F214-F241 AromaticContact CZ-CZ 3.86Å; F214-F241 HydrophobicContact CZ-CZ 3.86Å; L239-F241 HydrophobicContact CB-CE2 3.74Å; L239-F241 HydrophobicContact CB-CZ 4.02Å; L239-F241 VanDerWaalsContact O-CD2 3.31Å; L239-F241 WeakPolarHBondContact O-CD2 3.13Å; L239-F241 WeakPolarHBondContact O-CE2 3.42Å; F241-P280 HydrophobicContact CE1-CG 4.23Å; F241-P280 HydrophobicContact CZ-CG 4.2Å; F241-L285 HydrophobicContact CD1-CD2 4.32Å; F241-L285 HydrophobicContact CE1-CD2 4.2Å
242	S	93.4	Very high	90.3	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	154.1	173.3	61.9	0	0	0	0	112.1	S102 Y103 V105 A207 R288	S102-S242 VanDerWaalsContact OG-CB 3.3Å; S102-S242 WeakPolarHBondContact OG-CB 3.33Å; S102-S242 PolarHBondContact OG-OG 3.4Å; Y103-S242 PolarHBondContact O-N 2.65Å; V105-S242 PolarHBondContact N-O 2.92Å; A207-S242 CarbonylContact O-C 3.55Å; A207-S242 WeakPolarHBondContact O-CA 3.46Å; A207-S242 WeakPolarHBondContact O-CB 3.35Å; S242-R288 WeakPolarHBondContact OG-CD 3.4Å
243	Y	94.6	Very high	91	Very high	1 Å²	1	19.2 Å²	19.2	0%	0.004	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.6	178	-175	-93.4	0	0	0	108.9	C107 C205 E206 A207 E245 R288 A341 T342 A345	C107-Y243 HydrophobicContact CB-CE2 3.48Å; C107-Y243 VanDerWaalsContact CB-CE2 3.48Å; C107-Y243 WeakPolarHBondContact CB-OH 3.38Å; C107-Y243 PolarHBondContact SG-OH 3Å; C205-Y243 HydrophobicContact CB-CE1 4.33Å; C205-Y243 WeakPolarHBondContact O-CD1 3.12Å; E206-Y243 VanDerWaalsContact CA-O 3.29Å; E206-Y243 WeakPolarHBondContact CA-O 3.44Å; A207-Y243 PolarHBondContact N-O 3.45Å; A207-Y243 PolarHBondContact O-N 3.48Å; Y243-E245 HydrophobicContact CE1-CB 4.32Å; Y243-E245 HydrophobicContact CE1-CG 3.67Å; Y243-E245 PolarHBondContact OH-OE1 3.42Å; Y243-E245 PolarHBondContact OH-OE2 3.44Å; Y243-R288 PolarHBondContact O-NH1 3.25Å; Y243-A341 HydrophobicContact CD2-CB 4.03Å; Y243-A341 HydrophobicContact CE2-CB 3.57Å; Y243-T342 VanDerWaalsContact OH-CA 3.27Å; Y243-T342 WeakPolarHBondContact OH-CA 3.48Å; Y243-T342 PolarHBondContact OH-N 3.37Å; Y243-T342 PolarHBondContact OH-OG1 3.32Å; Y243-A345 HydrophobicContact CD1-CB 3.22Å; Y243-A345 HydrophobicContact CD2-CB 4.16Å; Y243-A345 HydrophobicContact CE1-CB 3.71Å; Y243-A345 HydrophobicContact CG-CB 3.45Å; Y243-A345 VanDerWaalsContact CG-CB 3.45Å
244	S	93	Very high	91.7	Very high	33 Å²	33	15.8 Å²	15.8	23%	0.231	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	116.9	174.3	176	0	0	0	0	109.7	C205	C205-S244 WeakPolarHBondContact O-CA 3.44Å
245	E	92	Very high	92.6	Very high	22 Å²	22	16.6 Å²	16.6	10%	0.103	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	165.2	167.9	79.8	-178	164.6	0	0	109.5	C205 Y243 V247 R312 T342	C205-E245 HydrophobicContact CB-CG 4.42Å; C205-E245 PolarHBondContact N-O 2.77Å; C205-E245 PolarHBondContact O-N 3.48Å; C205-E245 VanDerWaalsContact O-N 3.13Å; Y243-E245 HydrophobicContact CE1-CB 4.32Å; Y243-E245 HydrophobicContact CE1-CG 3.67Å; Y243-E245 PolarHBondContact OH-OE1 3.42Å; Y243-E245 PolarHBondContact OH-OE2 3.44Å; E245-V247 HydrophobicContact CG-CG1 3.94Å; E245-V247 WeakPolarHBondContact OE1-CG1 3.28Å; E245-R312 WeakPolarHBondContact OE1-CD 3.49Å; E245-R312 IonicContact OE1-NE 3.76Å; E245-R312 IonicContact OE2-CZ 2.8Å; E245-R312 IonicContact OE2-NE 3.67Å; E245-R312 PolarHBondContact OE2-NE 3.4Å; E245-R312 IonicContact OE2-NH2 3.06Å; E245-T342 WeakPolarHBondContact OE1-CG2 3.46Å; E245-T342 PolarHBondContact OE1-OG1 2.79Å
246	N	94.3	Very high	93.3	Very high	89 Å²	89	15.2 Å²	15.2	48%	0.476	8%	0.08	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.5	157.6	-69.7	-0.1	0	0	0	108.5	D202 S203	D202-N246 WeakPolarHBondContact OD1-CB 3.33Å; D202-N246 PolarHBondContact OD1-ND2 3.41Å; D202-N246 VanDerWaalsContact OD1-ND2 3.17Å; D202-N246 PolarHBondContact OD2-ND2 2.95Å; S203-N246 CarbonylContact O-C 3.53Å; S203-N246 WeakPolarHBondContact O-CA 3.08Å
247	V	95.5	Very high	93.9	Very high	2 Å²	2	13.1 Å²	13.1	1%	0.012	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	151.2	173.6	-67.9	0	0	0	0	109.9	D202 S203 C205 E245 S249 Q250 T342	D202-V247 CarbonylContact C-O 3.54Å; D202-V247 WeakPolarHBondContact CA-O 3.35Å; S203-V247 PolarHBondContact N-O 3.46Å; S203-V247 VanDerWaalsContact O-CG2 3.31Å; S203-V247 WeakPolarHBondContact O-CG2 3.47Å; S203-V247 PolarHBondContact O-N 3.27Å; C205-V247 HydrophobicContact CB-CG1 4.22Å; E245-V247 HydrophobicContact CG-CG1 3.94Å; E245-V247 WeakPolarHBondContact OE1-CG1 3.28Å; V247-S249 VanDerWaalsContact C-N 3.33Å; V247-S249 PolarHBondContact O-N 3.04Å; V247-Q250 HydrophobicContact CG2-CG 3.54Å; V247-T342 HydrophobicContact CG1-CG2 3.93Å
248	C	96.3	Very high	94.3	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.034	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	-45.5	-175.9	-64.8	0	0	0	0	112.5	C173 F176 D202 T311 S313	C173-C248 WeakPolarHBondContact CA-SG 3.12Å; C173-C248 HydrophobicContact CB-CB 3.5Å; C173-C248 VanDerWaalsContact CB-CB 3.5Å; C173-C248 WeakPolarHBondContact CB-SG 3.47Å; C173-C248 VanDerWaalsContact SG-CA 3.58Å; C173-C248 WeakPolarHBondContact SG-CB 3.27Å; C173-C248 CovalentContact SG-SG 2.05Å; C173-C248 PolarHBondContact SG-SG 3.04Å; F176-C248 HydrophobicContact CB-CB 4.32Å; F176-C248 HydrophobicContact CD2-CB 3.94Å; D202-C248 PolarHBondContact N-O 2.91Å; C248-T311 WeakPolarHBondContact CB-O 3.44Å; C248-T311 PolarHBondContact N-O 3.31Å; C248-S313 PolarHBondContact SG-N 3.33Å; C248-S313 VanDerWaalsContact SG-N 3.43Å
249	S	96.5	Very high	94.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	154.6	175.3	75.1	0	0	0	0	112.2	S180 D200 V247 T310 T311	S180-S249 PolarHBondContact OG-OG 2.88Å; D200-S249 CarbonylContact O-C 3.17Å; D200-S249 WeakPolarHBondContact O-CA 3.28Å; D200-S249 WeakPolarHBondContact O-CB 3Å; V247-S249 VanDerWaalsContact C-N 3.33Å; V247-S249 PolarHBondContact O-N 3.04Å; S249-T310 CarbonylContact O-C 3.46Å; S249-T310 WeakPolarHBondContact O-CA 3.22Å; S249-T310 PolarHBondContact O-OG1 3.37Å; S249-T311 WeakPolarHBondContact CB-OG1 3.12Å; S249-T311 PolarHBondContact N-O 2.81Å; S249-T311 PolarHBondContact N-OG1 2.9Å; S249-T311 VanDerWaalsContact N-OG1 3.08Å; S249-T311 PolarHBondContact O-N 2.67Å; S249-T311 PolarHBondContact O-OG1 2.84Å; S249-T311 PolarHBondContact OG-OG1 2.78Å
250	Q	97.2	Very high	94.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.2	171.2	-72.7	174.9	-12.6	0	0	109.2	V199 D200 S203 V247 P296 W346	V199-Q250 WeakPolarHBondContact CA-O 3.5Å; D200-Q250 PolarHBondContact N-O 3.36Å; D200-Q250 PolarHBondContact O-N 3.39Å; S203-Q250 PolarHBondContact OG-OE1 3.43Å; V247-Q250 HydrophobicContact CG2-CG 3.54Å; Q250-P296 PolarHBondContact OE1-O 3.12Å; Q250-W346 HydrophobicContact CB-CZ2 4.05Å; Q250-W346 HydrophobicContact CG-CZ2 3.97Å
251	V	97.2	Very high	94.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.8	172.4	-175.8	0	0	0	0	107.2	I184 A197 Q198 V199 L308 V309 F435	I184-V251 HydrophobicContact CD1-CG1 4.35Å; A197-V251 HydrophobicContact CB-CG1 4.1Å; Q198-V251 CarbonylContact O-C 3.59Å; Q198-V251 WeakPolarHBondContact O-CA 3.35Å; V199-V251 HydrophobicContact CG2-CG2 4.4Å; V251-L308 HydrophobicContact CB-CB 4.42Å; V251-L308 HydrophobicContact CG1-CB 4.27Å; V251-L308 HydrophobicContact CG1-CD2 3.99Å; V251-L308 WeakPolarHBondContact O-CB 3.42Å; V251-L308 PolarHBondContact O-N 2.97Å; V251-V309 PolarHBondContact N-O 3.28Å; V251-V309 PolarHBondContact O-N 2.05Å; V251-F435 HydrophobicContact CG1-CE1 4.5Å; V251-F435 HydrophobicContact CG2-CE1 3.76Å; V251-F435 HydrophobicContact CG2-CZ 4.03Å
252	R	96.3	Very high	94.9	Very high	6 Å²	6	26.9 Å²	26.9	2%	0.023	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151.8	-176.8	-65.9	-174.5	-68.5	106.4	5.3	112.1	A197 Q198 D200 F298 D302 Q304 F306 W346	A197-R252 CarbonylContact C-O 3.6Å; A197-R252 WeakPolarHBondContact CA-O 3.4Å; A197-R252 WeakPolarHBondContact CB-O 3.39Å; Q198-R252 PolarHBondContact N-O 2.93Å; Q198-R252 PolarHBondContact O-N 3.39Å; Q198-R252 VanDerWaalsContact OE1-CZ 3.24Å; D200-R252 VanDerWaalsContact CG-NH2 3.33Å; D200-R252 IonicContact OD1-CZ 3.79Å; D200-R252 IonicContact OD1-NH2 3.3Å; D200-R252 PolarHBondContact OD1-NH2 3.11Å; D200-R252 IonicContact OD2-CZ 3.93Å; D200-R252 IonicContact OD2-NE 3.83Å; D200-R252 PolarHBondContact OD2-NE 3.24Å; D200-R252 IonicContact OD2-NH2 2.71Å; D200-R252 PolarHBondContact OD2-NH2 2.74Å; R252-F298 VanDerWaalsContact CD-CD1 3.44Å; R252-D302 IonicContact CZ-OD1 3.79Å; R252-D302 IonicContact NH1-OD1 3.76Å; R252-D302 PolarHBondContact NH1-OD1 3.39Å; R252-D302 IonicContact NH1-OD2 3.29Å; R252-Q304 HydrophobicContact CB-CB 3.98Å; R252-Q304 WeakPolarHBondContact CB-O 3.31Å; R252-Q304 WeakPolarHBondContact CD-O 3.32Å; R252-Q304 PolarHBondContact NH1-O 3.13Å; R252-F306 CarbonylContact C-O 3.52Å; R252-F306 VanDerWaalsContact CA-O 3.28Å; R252-F306 WeakPolarHBondContact CA-O 3.46Å; R252-W346 HydrophobicContact CG-CZ2 4.45Å
253	T	95.3	Very high	94.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	165.9	-175.3	63.4	0	0	0	0	111.4	A197 F255 Q304 E305 F306 L308 L439	A197-T253 HydrophobicContact CB-CG2 4.17Å; T253-F255 VanDerWaalsContact C-N 3.27Å; T253-F255 PolarHBondContact O-N 3.4Å; T253-F255 PolarHBondContact OG1-O 3.44Å; T253-Q304 CarbonylContact O-C 3.59Å; T253-Q304 WeakPolarHBondContact O-CA 3.45Å; T253-E305 PolarHBondContact O-N 3.48Å; T253-F306 PolarHBondContact N-O 3.39Å; T253-F306 PolarHBondContact O-N 3.35Å; T253-F306 VanDerWaalsContact O-N 3.09Å; T253-F306 PolarHBondContact OG1-O 3.37Å; T253-L308 HydrophobicContact CG2-CB 3.98Å; T253-L308 HydrophobicContact CG2-CD2 4.12Å; T253-L439 HydrophobicContact CG2-CD1 4.11Å
254	A	92.9	Very high	94.5	Very high	28 Å²	28	36.1 Å²	36.1	23%	0.231	19%	0.185	C	C	.	.	S	Bend	trans	-73.1	-18.5	-179.3	0	0	0	0	0	113.7	F306	A254-F306 VanDerWaalsContact O-CD2 3.28Å; A254-F306 WeakPolarHBondContact O-CD2 3.43Å; A254-F306 WeakPolarHBondContact O-CE2 3.33Å
255	F	94.3	Very high	94.4	Very high	76 Å²	76	40.1 Å²	40.1	33%	0.333	20%	0.2	S	C	.	.	S	Bend	trans	-132.7	145	-169.2	-60.7	-69.4	0	0	0	110.9	T253 F306 L439 E441	T253-F255 VanDerWaalsContact C-N 3.27Å; T253-F255 PolarHBondContact O-N 3.4Å; T253-F255 PolarHBondContact OG1-O 3.44Å; F255-F306 WeakPolarHBondContact O-CB 3.21Å; F255-L439 HydrophobicContact CB-CB 4.26Å; F255-L439 HydrophobicContact CB-CD1 4.46Å; F255-E441 HydrophobicContact CD2-CB 4.22Å; F255-E441 HydrophobicContact CD2-CG 3.9Å; F255-E441 WeakPolarHBondContact CE1-O 3.47Å; F255-E441 HydrophobicContact CE2-CB 4.3Å; F255-E441 HydrophobicContact CE2-CG 4.21Å; F255-E441 HydrophobicContact CG-CB 4.39Å; F255-E441 HydrophobicContact CG-CG 4.37Å
256	P	95.4	Very high	94.4	Very high	5 Å²	5	39 Å²	39	3%	0.032	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-68.2	152.6	179.5	27.5	-32.7	0	0	0	111.6	F306 L439 E440 L447	P256-F306 HydrophobicContact CB-CD1 3.57Å; P256-F306 HydrophobicContact CB-CE1 3.82Å; P256-F306 HydrophobicContact CB-CG 4.09Å; P256-F306 HydrophobicContact CG-CD1 4.25Å; P256-F306 HydrophobicContact CG-CE1 4.09Å; P256-F306 HydrophobicContact CG-CZ 4.37Å; P256-L439 WeakPolarHBondContact O-CA 3.14Å; P256-E440 HydrophobicContact CG-CB 4.4Å; P256-E440 PolarHBondContact O-N 2.79Å; P256-L447 HydrophobicContact CG-CD2 4.14Å
257	L	96.2	Very high	94.1	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-59.6	143.7	162.9	-78.8	166	0	0	0	110.6	L308 C367 Q369 A437 L439	L257-L308 HydrophobicContact CD2-CD1 3.87Å; L257-L308 HydrophobicContact CG-CD1 4.4Å; L257-C367 HydrophobicContact CB-CB 3.75Å; L257-C367 HydrophobicContact CD1-CB 4.46Å; L257-Q369 HydrophobicContact CD1-CG 3.79Å; L257-A437 HydrophobicContact CD2-CB 3.58Å; L257-L439 HydrophobicContact CD2-CD2 3.85Å; L257-L439 HydrophobicContact CG-CD2 4.16Å
258	R	95	Very high	93.8	Very high	110 Å²	110	40.8 Å²	40.8	42%	0.415	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-63.4	142.2	172.2	-61.6	-167	-167.8	-103.2	-1.8	110.5	F260 D438 L439 E440	R258-F260 PolarHBondContact O-N 3.09Å; R258-D438 HydrophobicContact CG-CB 4.28Å; R258-D438 PolarHBondContact N-O 3.04Å; R258-D438 VanDerWaalsContact N-O 3.12Å; R258-L439 PolarHBondContact NE-O 3.48Å; R258-L439 PolarHBondContact NH2-O 3.24Å; R258-E440 WeakPolarHBondContact CD-OE2 3.39Å; R258-E440 HydrophobicContact CG-CB 4.13Å; R258-E440 WeakPolarHBondContact CG-OE2 3.28Å; R258-E440 IonicContact CZ-OE1 2.62Å; R258-E440 IonicContact CZ-OE2 3.61Å; R258-E440 IonicContact NE-OE2 2.73Å; R258-E440 IonicContact NH1-OE1 3.81Å; R258-E440 PolarHBondContact NH1-OE1 3.44Å; R258-E440 IonicContact NH1-OE2 3.48Å; R258-E440 PolarHBondContact NH1-OE2 2.97Å
259	P	94.8	Very high	93.4	Very high	50 Å²	50	42.4 Å²	42.4	33%	0.325	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-53	133.3	170.8	-26.1	35	0	0	0	111.8	V261 P365 C367	P259-V261 VanDerWaalsContact C-N 3.33Å; P259-P365 HydrophobicContact CB-CB 4.3Å; P259-P365 HydrophobicContact CB-CG 4.25Å; P259-P365 HydrophobicContact CG-CB 4.25Å; P259-P365 HydrophobicContact CG-CG 4.19Å; P259-C367 VanDerWaalsContact CA-SG 3.58Å
260	F	95	Very high	92.9	Very high	33 Å²	33	46 Å²	46	15%	0.145	26%	0.261	C	S	.	.	S	Bend	trans	-70.9	-35.4	176.6	-59.8	-61.7	0	0	0	111.4	P131 Y134 R258 C367 Q369 A382 Q384 W403	P131-F260 HydrophobicContact CB-CB 4.11Å; P131-F260 HydrophobicContact CB-CD1 3.99Å; P131-F260 HydrophobicContact CB-CG 4.2Å; P131-F260 HydrophobicContact CG-CB 4Å; P131-F260 HydrophobicContact CG-CD1 3.8Å; P131-F260 HydrophobicContact CG-CD2 4.33Å; P131-F260 HydrophobicContact CG-CE1 4.38Å; P131-F260 HydrophobicContact CG-CG 3.78Å; Y134-F260 HydrophobicContact CE2-CD1 4.48Å; Y134-F260 AromaticContact CE2-CE1 3.94Å; Y134-F260 HydrophobicContact CE2-CE1 3.94Å; Y134-F260 AromaticContact CZ-CE1 3.95Å; Y134-F260 WeakPolarHBondContact OH-CE1 3.45Å; R258-F260 PolarHBondContact O-N 3.09Å; F260-C367 HydrophobicContact CD2-CB 4.27Å; F260-C367 HydrophobicContact CE2-CB 3.77Å; F260-C367 HydrophobicContact CZ-CB 4.24Å; F260-Q369 HydrophobicContact CZ-CG 4.34Å; F260-A382 HydrophobicContact CD2-CB 4.39Å; F260-A382 HydrophobicContact CE1-CB 4.41Å; F260-A382 HydrophobicContact CE2-CB 3.79Å; F260-A382 HydrophobicContact CZ-CB 3.81Å; F260-Q384 HydrophobicContact CD2-CB 4.27Å; F260-W403 HydrophobicContact CB-CH2 3.96Å; F260-W403 HydrophobicContact CB-CZ3 4.01Å; F260-W403 HydrophobicContact CD2-CE3 4.17Å; F260-W403 AromaticContact CD2-CZ3 3.81Å; F260-W403 HydrophobicContact CD2-CZ3 3.81Å; F260-W403 HydrophobicContact CG-CZ3 4.3Å
261	V	94.4	Very high	92.3	Very high	35 Å²	35	51.7 Å²	51.7	21%	0.212	30%	0.297	C	S	.	.	S	Bend	trans	-139.5	162	175	-58.3	0	0	0	0	110.1	P259 E265 A266 Q384 I401 W403	P259-V261 VanDerWaalsContact C-N 3.33Å; V261-E265 HydrophobicContact CB-CB 4.18Å; V261-E265 WeakPolarHBondContact CB-OE2 3.46Å; V261-A266 HydrophobicContact CG2-CB 4.29Å; V261-Q384 PolarHBondContact O-NE2 3.45Å; V261-Q384 PolarHBondContact O-OE1 3.17Å; V261-I401 HydrophobicContact CG2-CD1 3.84Å; V261-W403 HydrophobicContact CG1-CH2 4.07Å; V261-W403 HydrophobicContact CG1-CZ2 3.76Å; V261-W403 HydrophobicContact CG2-CH2 3.78Å; V261-W403 HydrophobicContact CG2-CZ2 4.16Å
262	T	92.7	Very high	91.7	Very high	64 Å²	64	52.9 Å²	52.9	39%	0.393	31%	0.305	S	S	.	.			trans	-71.5	159.5	173.9	61.9	0	0	0	0	111.7	E264 E265 A266	T262-E264 WeakPolarHBondContact CB-OE2 3.21Å; T262-E264 PolarHBondContact O-N 2.89Å; T262-E265 PolarHBondContact N-OE2 3.3Å; T262-E265 PolarHBondContact O-N 3.21Å; T262-E265 WeakPolarHBondContact OG1-CB 3.4Å; T262-E265 WeakPolarHBondContact OG1-CG 3.49Å; T262-E265 PolarHBondContact OG1-N 2.95Å; T262-E265 VanDerWaalsContact OG1-N 3.15Å; T262-E265 PolarHBondContact OG1-OE2 3.09Å; T262-A266 WeakPolarHBondContact O-CB 3.43Å; T262-A266 PolarHBondContact O-N 3.34Å
263	K	89.5	Confident	91	Very high	52 Å²	52	55.2 Å²	55.2	23%	0.226	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-30.9	175.9	-79.5	-171.6	169.7	178.8	0	111.5	A266 A267 I362 T363 P365	K263-A266 WeakPolarHBondContact O-CB 3.34Å; K263-A266 PolarHBondContact O-N 3.01Å; K263-A267 WeakPolarHBondContact O-CB 3.35Å; K263-A267 PolarHBondContact O-N 3.4Å; K263-I362 PolarHBondContact NZ-O 3.41Å; K263-T363 PolarHBondContact NZ-O 3.09Å; K263-P365 HydrophobicContact CD-CG 4.37Å; K263-P365 HydrophobicContact CG-CG 3.72Å
264	E	90.1	Very high	90.2	Very high	144 Å²	144	58.5 Å²	58.5	67%	0.673	35%	0.345	S	S	*	.	H	α-helix	trans	-68.5	-46	177.7	-63.8	71	-157	0	0	111.1	T262 A266 A267 G268	T262-E264 WeakPolarHBondContact CB-OE2 3.21Å; T262-E264 PolarHBondContact O-N 2.89Å; E264-A266 VanDerWaalsContact C-N 3.28Å; E264-A266 PolarHBondContact O-N 3.22Å; E264-A267 PolarHBondContact O-N 3.01Å; E264-G268 PolarHBondContact O-N 2.69Å
265	E	92	Very high	89.3	Confident	116 Å²	116	63.3 Å²	63.3	54%	0.542	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-39.9	171.9	-74.2	163.3	159.6	0	0	110.9	V261 T262 A267 G268 N269	V261-E265 HydrophobicContact CB-CB 4.18Å; V261-E265 WeakPolarHBondContact CB-OE2 3.46Å; T262-E265 PolarHBondContact N-OE2 3.3Å; T262-E265 PolarHBondContact O-N 3.21Å; T262-E265 WeakPolarHBondContact OG1-CB 3.4Å; T262-E265 WeakPolarHBondContact OG1-CG 3.49Å; T262-E265 PolarHBondContact OG1-N 2.95Å; T262-E265 VanDerWaalsContact OG1-N 3.15Å; T262-E265 PolarHBondContact OG1-OE2 3.09Å; E265-A267 VanDerWaalsContact C-N 3.34Å; E265-A267 PolarHBondContact O-N 2.87Å; E265-G268 PolarHBondContact O-N 3.01Å; E265-G268 VanDerWaalsContact O-N 3.12Å; E265-N269 PolarHBondContact O-ND2 3.29Å
266	A	91.7	Very high	88.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-41.4	176.8	0	0	0	0	0	112.6	V261 T262 K263 E264 G268 N269 N386 A398 P399 I401	V261-A266 HydrophobicContact CG2-CB 4.29Å; T262-A266 WeakPolarHBondContact O-CB 3.43Å; T262-A266 PolarHBondContact O-N 3.34Å; K263-A266 WeakPolarHBondContact O-CB 3.34Å; K263-A266 PolarHBondContact O-N 3.01Å; E264-A266 VanDerWaalsContact C-N 3.28Å; E264-A266 PolarHBondContact O-N 3.22Å; A266-G268 PolarHBondContact O-N 3.33Å; A266-N269 WeakPolarHBondContact O-CB 3.12Å; A266-N269 PolarHBondContact O-N 3.03Å; A266-N269 VanDerWaalsContact O-N 3.12Å; A266-N269 PolarHBondContact O-ND2 2.74Å; A266-N386 VanDerWaalsContact CB-ND2 3.3Å; A266-N386 WeakPolarHBondContact CB-ND2 3.45Å; A266-A398 HydrophobicContact CB-CB 4.16Å; A266-P399 WeakPolarHBondContact O-CD 3.47Å; A266-I401 HydrophobicContact CB-CD1 3.52Å; A266-I401 HydrophobicContact CB-CG1 4.38Å
267	A	88.9	Confident	87.7	Confident	60 Å²	60	62.2 Å²	62.2	50%	0.496	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-18.8	176	0	0	0	0	0	113.7	K263 E264 E265 N269 A398	K263-A267 WeakPolarHBondContact O-CB 3.35Å; K263-A267 PolarHBondContact O-N 3.4Å; E264-A267 PolarHBondContact O-N 3.01Å; E265-A267 VanDerWaalsContact C-N 3.34Å; E265-A267 PolarHBondContact O-N 2.87Å; A267-N269 VanDerWaalsContact C-N 3.26Å; A267-N269 PolarHBondContact O-N 3.03Å; A267-A398 HydrophobicContact CB-CB 4.07Å
268	G	89.1	Confident	86.9	Confident	68 Å²	68	67.3 Å²	67.3	70%	0.701	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-13.6	173.8	0	0	0	0	0	114.4	E264 E265 A266	E264-G268 PolarHBondContact O-N 2.69Å; E265-G268 PolarHBondContact O-N 3.01Å; E265-G268 VanDerWaalsContact O-N 3.12Å; A266-G268 PolarHBondContact O-N 3.33Å
269	N	87.9	Confident	86.2	Confident	38 Å²	38	64.4 Å²	64.4	20%	0.203	38%	0.379	C	S	.	.	S	Bend	trans	-72.8	148.1	177	-69.1	-78.2	0	0	0	111.2	H125 E265 A266 A267 P399	H125-N269 HydrophobicContact CB-CB 4.42Å; H125-N269 PolarHBondContact CD2-OD1 3.16Å; E265-N269 PolarHBondContact O-ND2 3.29Å; A266-N269 WeakPolarHBondContact O-CB 3.12Å; A266-N269 PolarHBondContact O-N 3.03Å; A266-N269 VanDerWaalsContact O-N 3.12Å; A266-N269 PolarHBondContact O-ND2 2.74Å; A267-N269 VanDerWaalsContact C-N 3.26Å; A267-N269 PolarHBondContact O-N 3.03Å; N269-P399 HydrophobicContact CB-CG 4.09Å
270	P	86	Confident	85.8	Confident	77 Å²	77	62 Å²	62	50%	0.5	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-62.5	144.6	178.5	26.8	-34.4	0	0	0	110.7
271	P	83	Confident	85.3	Confident	118 Å²	118	65.1 Å²	65.1	77%	0.766	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-60.2	146	176.4	26.9	-34.2	0	0	0	110.2	S273	P271-S273 PolarHBondContact O-N 3.01Å
272	V	85.6	Confident	84.9	Confident	25 Å²	25	69.7 Å²	69.7	15%	0.152	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-64.5	132.6	176.3	-176.7	0	0	0	0	109.3	K119 T124 S274	K119-V272 HydrophobicContact CB-CG1 4Å; T124-V272 WeakPolarHBondContact O-CG2 3.49Å; V272-S274 PolarHBondContact O-N 3.47Å
273	S	80.6	Confident	84.6	Confident	55 Å²	55	68 Å²	68	39%	0.385	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-57.1	133.5	-179.1	168.2	0	0	0	0	111.2	Y120 P271 D275	Y120-S273 WeakPolarHBondContact CD2-O 3.3Å; P271-S273 PolarHBondContact O-N 3.01Å; S273-D275 VanDerWaalsContact C-N 3.35Å; S273-D275 WeakPolarHBondContact OG-CB 3.25Å; S273-D275 VanDerWaalsContact OG-CG 3.26Å; S273-D275 PolarHBondContact OG-N 3.43Å; S273-D275 PolarHBondContact OG-OD2 3.03Å
274	S	78.4	Confident	84.4	Confident	70 Å²	70	67.4 Å²	67.4	49%	0.49	40%	0.397	S	S	.	.	S	Bend	trans	-89.4	2.2	172.2	53.4	0	0	0	0	113	V272 V276 I277	V272-S274 PolarHBondContact O-N 3.47Å; S274-V276 PolarHBondContact O-N 2.95Å; S274-I277 WeakPolarHBondContact O-CD1 3.05Å; S274-I277 WeakPolarHBondContact O-CG1 3.13Å; S274-I277 PolarHBondContact O-N 3.02Å
275	D	75.4	Confident	84.3	Confident	130 Å²	130	61 Å²	61	70%	0.695	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-1.5	-176.3	-54	-40.4	0	0	0	112.9	S273	S273-D275 VanDerWaalsContact C-N 3.35Å; S273-D275 WeakPolarHBondContact OG-CB 3.25Å; S273-D275 VanDerWaalsContact OG-CG 3.26Å; S273-D275 PolarHBondContact OG-N 3.43Å; S273-D275 PolarHBondContact OG-OD2 3.03Å
276	V	76.6	Confident	84.1	Confident	19 Å²	19	62 Å²	62	12%	0.115	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	14.7	-175.8	-60.4	0	0	0	0	112.4	P116 Y120 S274 Y278	P116-V276 HydrophobicContact CB-CB 4.34Å; P116-V276 HydrophobicContact CB-CG1 3.39Å; Y120-V276 VanDerWaalsContact CB-CG2 3.44Å; Y120-V276 HydrophobicContact CD2-CG2 4.21Å; Y120-V276 HydrophobicContact CG-CG2 3.82Å; S274-V276 PolarHBondContact O-N 2.95Å; V276-Y278 HydrophobicContact CB-CE2 4.27Å; V276-Y278 VanDerWaalsContact O-CD2 3.24Å; V276-Y278 WeakPolarHBondContact O-CD2 3.24Å; V276-Y278 PolarHBondContact O-N 3.24Å
277	I	78.1	Confident	83.9	Confident	38 Å²	38	64.3 Å²	64.3	20%	0.195	38%	0.382	C	S	.	.			trans	-74.3	82.5	176.4	-61.8	163.2	0	0	0	108.5	Y120 G213 F214 L217 S274	Y120-I277 HydrophobicContact CE1-CG1 3.92Å; Y120-I277 HydrophobicContact CE2-CD1 4.16Å; Y120-I277 HydrophobicContact CE2-CG1 3.97Å; Y120-I277 WeakPolarHBondContact OH-CD1 3.47Å; G213-I277 WeakPolarHBondContact O-CD1 3.33Å; F214-I277 HydrophobicContact CD1-CG2 3.69Å; F214-I277 HydrophobicContact CE1-CG2 4.19Å; F214-I277 HydrophobicContact CG-CG2 4.44Å; L217-I277 HydrophobicContact CD2-CG2 4.48Å; S274-I277 WeakPolarHBondContact O-CD1 3.05Å; S274-I277 WeakPolarHBondContact O-CG1 3.13Å; S274-I277 PolarHBondContact O-N 3.02Å
278	Y	79.4	Confident	83.6	Confident	112 Å²	112	62 Å²	62	44%	0.439	36%	0.361	S	S	.	.			trans	-101.9	157.7	168.8	-55.7	-70.7	0	0	0	109.9	V276 P280 L282 I283	V276-Y278 HydrophobicContact CB-CE2 4.27Å; V276-Y278 VanDerWaalsContact O-CD2 3.24Å; V276-Y278 WeakPolarHBondContact O-CD2 3.24Å; V276-Y278 PolarHBondContact O-N 3.24Å; Y278-P280 WeakPolarHBondContact O-CD 3.48Å; Y278-L282 HydrophobicContact CD1-CD2 4.14Å; Y278-L282 HydrophobicContact CG-CD2 4.47Å; Y278-I283 HydrophobicContact CD2-CG2 4.46Å
279	T	81.8	Confident	83.1	Confident	49 Å²	49	65.7 Å²	65.7	30%	0.301	36%	0.364	S	S	.	.			trans	-59.3	127.4	165.5	-52.3	0	0	0	0	108.4	E281 L282	T279-E281 HydrophobicContact CG2-CB 4.1Å; T279-E281 HydrophobicContact CG2-CG 4.46Å; T279-E281 PolarHBondContact O-N 3.43Å; T279-L282 VanDerWaalsContact O-CB 3.24Å; T279-L282 WeakPolarHBondContact O-CB 3.42Å; T279-L282 PolarHBondContact O-N 2.76Å
280	P	85.7	Confident	82.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.5	-178.6	-30	37.7	0	0	0	113.9	Y103 F117 L239 F241 Y278 L282 I283 G284 L285	Y103-P280 HydrophobicContact CD1-CB 3.76Å; Y103-P280 HydrophobicContact CD2-CB 3.79Å; Y103-P280 HydrophobicContact CD2-CG 3.73Å; Y103-P280 HydrophobicContact CE1-CB 3.86Å; Y103-P280 HydrophobicContact CE2-CB 3.85Å; Y103-P280 HydrophobicContact CE2-CG 3.64Å; Y103-P280 HydrophobicContact CG-CB 3.72Å; Y103-P280 HydrophobicContact CG-CG 4.18Å; F117-P280 HydrophobicContact CZ-CG 4.38Å; L239-P280 HydrophobicContact CD1-CG 3.78Å; F241-P280 HydrophobicContact CE1-CG 4.23Å; F241-P280 HydrophobicContact CZ-CG 4.2Å; Y278-P280 WeakPolarHBondContact O-CD 3.48Å; P280-L282 VanDerWaalsContact C-N 3.31Å; P280-L282 PolarHBondContact O-N 2.95Å; P280-I283 WeakPolarHBondContact O-CG1 3.46Å; P280-I283 PolarHBondContact O-N 3.43Å; P280-G284 PolarHBondContact O-N 3.48Å; P280-L285 HydrophobicContact CB-CB 4.13Å; P280-L285 HydrophobicContact CB-CD2 4.45Å; P280-L285 WeakPolarHBondContact O-CB 3.39Å; P280-L285 PolarHBondContact O-N 3.35Å
281	E	85.6	Confident	82.1	Confident	98 Å²	98	68.2 Å²	68.2	46%	0.458	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.4	175.6	-65.8	160.4	-169.8	0	0	112.9	Y103 T279 I283 G284	Y103-E281 HydrophobicContact CE1-CG 3.77Å; Y103-E281 PolarHBondContact OH-OE1 3.41Å; T279-E281 HydrophobicContact CG2-CB 4.1Å; T279-E281 HydrophobicContact CG2-CG 4.46Å; T279-E281 PolarHBondContact O-N 3.43Å; E281-I283 VanDerWaalsContact C-N 3.31Å; E281-I283 PolarHBondContact O-N 3.35Å; E281-G284 PolarHBondContact O-N 3.06Å; E281-G284 VanDerWaalsContact O-N 3.15Å
282	L	85.7	Confident	82.1	Confident	131 Å²	131	63.7 Å²	63.7	69%	0.686	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-36.1	179.2	-176.5	66.9	0	0	0	111.7	Y278 T279 P280 G284	Y278-L282 HydrophobicContact CD1-CD2 4.14Å; Y278-L282 HydrophobicContact CG-CD2 4.47Å; T279-L282 VanDerWaalsContact O-CB 3.24Å; T279-L282 WeakPolarHBondContact O-CB 3.42Å; T279-L282 PolarHBondContact O-N 2.76Å; P280-L282 VanDerWaalsContact C-N 3.31Å; P280-L282 PolarHBondContact O-N 2.95Å; L282-G284 PolarHBondContact O-N 3.06Å
283	I	85.3	Confident	82.1	Confident	29 Å²	29	68.2 Å²	68.2	15%	0.149	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	10.7	177.7	58.7	169.6	0	0	0	112.3	L114 F117 Y278 P280 E281 L285	L114-I283 HydrophobicContact CD2-CB 3.8Å; L114-I283 HydrophobicContact CD2-CD1 4.35Å; L114-I283 HydrophobicContact CD2-CG2 4.23Å; F117-I283 HydrophobicContact CB-CD1 4.18Å; F117-I283 HydrophobicContact CD1-CD1 3.39Å; F117-I283 HydrophobicContact CD2-CD1 3.46Å; F117-I283 VanDerWaalsContact CD2-CD1 3.46Å; F117-I283 HydrophobicContact CE1-CD1 3.47Å; F117-I283 VanDerWaalsContact CE1-CD1 3.47Å; F117-I283 HydrophobicContact CE2-CD1 3.53Å; F117-I283 HydrophobicContact CG-CD1 3.38Å; F117-I283 HydrophobicContact CZ-CD1 3.53Å; Y278-I283 HydrophobicContact CD2-CG2 4.46Å; P280-I283 WeakPolarHBondContact O-CG1 3.46Å; P280-I283 PolarHBondContact O-N 3.43Å; E281-I283 VanDerWaalsContact C-N 3.31Å; E281-I283 PolarHBondContact O-N 3.35Å; I283-L285 HydrophobicContact CD1-CD1 3.52Å; I283-L285 HydrophobicContact CG1-CD1 3.64Å
284	G	85.2	Confident	82.6	Confident	38 Å²	38	66.2 Å²	66.2	39%	0.392	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	9	172.4	0	0	0	0	0	115.6	P280 E281 L282 K286	P280-G284 PolarHBondContact O-N 3.48Å; E281-G284 PolarHBondContact O-N 3.06Å; E281-G284 VanDerWaalsContact O-N 3.15Å; L282-G284 PolarHBondContact O-N 3.06Å; G284-K286 PolarHBondContact O-N 3.18Å
285	L	88.6	Confident	83.3	Confident	10 Å²	10	64.5 Å²	64.5	5%	0.052	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-65.2	131.1	176.6	-90.6	74.1	0	0	0	110.2	Y103 V105 F117 F241 P280 I283	Y103-L285 HydrophobicContact CD1-CB 4.31Å; V105-L285 HydrophobicContact CG2-CD2 4.25Å; F117-L285 HydrophobicContact CE1-CD1 4.18Å; F117-L285 HydrophobicContact CE1-CD2 3.83Å; F117-L285 HydrophobicContact CZ-CD2 4.36Å; F241-L285 HydrophobicContact CD1-CD2 4.32Å; F241-L285 HydrophobicContact CE1-CD2 4.2Å; P280-L285 HydrophobicContact CB-CB 4.13Å; P280-L285 HydrophobicContact CB-CD2 4.45Å; P280-L285 WeakPolarHBondContact O-CB 3.39Å; P280-L285 PolarHBondContact O-N 3.35Å; I283-L285 HydrophobicContact CD1-CD1 3.52Å; I283-L285 HydrophobicContact CG1-CD1 3.64Å
286	K	87.8	Confident	84.2	Confident	136 Å²	136	58.3 Å²	58.3	59%	0.591	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	150.3	177.3	-64.8	174.7	-173.1	161.3	0	110.3	K104 G284	K104-K286 PolarHBondContact N-O 3.41Å; G284-K286 PolarHBondContact O-N 3.18Å
287	I	86.6	Confident	85	Confident	50 Å²	50	58 Å²	58	26%	0.256	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.5	169.9	-59.4	169.9	0	0	0	107.7	R101 Y103 T229	R101-I287 HydrophobicContact CB-CG2 3.79Å; R101-I287 HydrophobicContact CG-CG2 4.15Å; Y103-I287 HydrophobicContact CD1-CG1 4.35Å; Y103-I287 HydrophobicContact CE1-CG1 4.09Å; T229-I287 HydrophobicContact CG2-CD1 3.67Å; T229-I287 HydrophobicContact CG2-CG1 3.87Å; T229-I287 HydrophobicContact CG2-CG2 4.17Å
288	R	84.1	Confident	85.7	Confident	12 Å²	12	57 Å²	57	5%	0.045	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-75.4	130	172.6	-169.4	166.2	-177	165.7	-3	110.2	S102 K104 E206 S242 Y243 D290	S102-R288 WeakPolarHBondContact O-CB 3.33Å; S102-R288 PolarHBondContact O-N 3.17Å; S102-R288 WeakPolarHBondContact OG-CB 3.36Å; K104-R288 HydrophobicContact CB-CB 4.48Å; E206-R288 IonicContact OE2-CZ 3.51Å; E206-R288 IonicContact OE2-NH1 2.61Å; E206-R288 IonicContact OE2-NH2 3.69Å; E206-R288 PolarHBondContact OE2-NH2 3.1Å; S242-R288 WeakPolarHBondContact OG-CD 3.4Å; Y243-R288 PolarHBondContact O-NH1 3.25Å; R288-D290 WeakPolarHBondContact CD-OD1 3.38Å; R288-D290 WeakPolarHBondContact CG-OD1 3.37Å; R288-D290 IonicContact CZ-OD1 2.86Å; R288-D290 IonicContact CZ-OD2 3.18Å; R288-D290 VanDerWaalsContact CZ-OD2 3.29Å; R288-D290 IonicContact NE-OD1 2.61Å; R288-D290 PolarHBondContact NE-OD1 3.48Å; R288-D290 IonicContact NE-OD2 2.97Å; R288-D290 PolarHBondContact NE-OD2 3.23Å; R288-D290 IonicContact NH2-OD1 3.78Å; R288-D290 IonicContact NH2-OD2 3.85Å; R288-D290 PolarHBondContact NH2-OD2 3.29Å
289	D	77.8	Confident	86.2	Confident	145 Å²	145	59 Å²	59	78%	0.775	30%	0.303	S	S	*	.			trans	-102.8	-16.2	-178.9	-71.1	-36.5	0	0	0	113.3
290	D	75.7	Confident	86.6	Confident	81 Å²	81	57.8 Å²	57.8	43%	0.433	29%	0.293	S	S	.	.	S	Bend	trans	-95.5	171.7	-179.9	63.7	-50.9	0	0	0	113.2	R288	R288-D290 WeakPolarHBondContact CD-OD1 3.38Å; R288-D290 WeakPolarHBondContact CG-OD1 3.37Å; R288-D290 IonicContact CZ-OD1 2.86Å; R288-D290 IonicContact CZ-OD2 3.18Å; R288-D290 VanDerWaalsContact CZ-OD2 3.29Å; R288-D290 IonicContact NE-OD1 2.61Å; R288-D290 PolarHBondContact NE-OD1 3.48Å; R288-D290 IonicContact NE-OD2 2.97Å; R288-D290 PolarHBondContact NE-OD2 3.23Å; R288-D290 IonicContact NH2-OD1 3.78Å; R288-D290 IonicContact NH2-OD2 3.85Å; R288-D290 PolarHBondContact NH2-OD2 3.29Å
291	L	76.4	Confident	86.6	Confident	87 Å²	87	58.6 Å²	58.6	46%	0.455	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-61	139.5	-174.1	-49.3	177.3	0	0	0	110.9	D77 R293	D77-L291 WeakPolarHBondContact OD1-CD2 3.32Å; D77-L291 VanDerWaalsContact OD2-CD2 3.24Å; D77-L291 WeakPolarHBondContact OD2-CD2 3.3Å; L291-R293 PolarHBondContact O-N 2.61Å
292	L	84.4	Confident	86.9	Confident	22 Å²	22	55.5 Å²	55.5	12%	0.115	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-73.1	117.6	173.9	-60.5	178.9	0	0	0	109	S102 F208	S102-L292 VanDerWaalsContact OG-CD2 3.23Å; S102-L292 WeakPolarHBondContact OG-CD2 3.35Å; F208-L292 HydrophobicContact CD2-CD1 3.73Å; F208-L292 HydrophobicContact CD2-CD2 3.95Å; F208-L292 HydrophobicContact CD2-CG 4.3Å; F208-L292 HydrophobicContact CE2-CD1 3.57Å; F208-L292 HydrophobicContact CE2-CD2 4.41Å; F208-L292 HydrophobicContact CG-CD1 4.48Å; F208-L292 HydrophobicContact CZ-CD1 4.26Å
293	R	84.5	Confident	87.2	Confident	120 Å²	120	53.8 Å²	53.8	45%	0.453	29%	0.285	S	S	.	.			trans	-121.1	151.1	179.1	-60	-170.7	-69.8	-151.5	2.7	111.3	E206 L291 V295	E206-R293 HydrophobicContact CB-CB 4.39Å; E206-R293 IonicContact OE1-CZ 3.99Å; E206-R293 IonicContact OE1-NE 2.97Å; E206-R293 PolarHBondContact OE1-NE 2.79Å; E206-R293 IonicContact OE1-NH2 4Å; E206-R293 PolarHBondContact OE1-NH2 3.4Å; E206-R293 IonicContact OE2-CZ 2.79Å; E206-R293 IonicContact OE2-NE 3.98Å; E206-R293 PolarHBondContact OE2-NE 3.5Å; E206-R293 VanDerWaalsContact OE2-NE 3.11Å; E206-R293 IonicContact OE2-NH2 2.84Å; E206-R293 PolarHBondContact OE2-NH2 3.2Å; L291-R293 PolarHBondContact O-N 2.61Å; R293-V295 HydrophobicContact CB-CG2 3.97Å
294	M	91.4	Very high	87.6	Confident	14 Å²	14	53 Å²	53	7%	0.069	28%	0.28	C	S	.	.			trans	-119	107.6	169.4	-168.2	66.4	66.5	0	0	107	I71 A207 F208 I348 G349 H352 F353	I71-M294 HydrophobicContact CD1-CB 4.43Å; I71-M294 HydrophobicContact CD1-CG 4.39Å; I71-M294 HydrophobicContact CG2-CB 3.83Å; A207-M294 HydrophobicContact CB-SD 4.11Å; F208-M294 HydrophobicContact CB-CE 4.18Å; F208-M294 WeakPolarHBondContact O-CE 3.4Å; M294-I348 HydrophobicContact CE-CG2 3.96Å; M294-I348 HydrophobicContact SD-CG2 3.89Å; M294-G349 VanDerWaalsContact SD-CA 3.55Å; M294-H352 HydrophobicContact CE-CB 4.37Å; M294-H352 WeakPolarHBondContact CE-ND1 3.44Å; M294-H352 HydrophobicContact CG-CB 3.76Å; M294-H352 HydrophobicContact SD-CB 4.29Å; M294-F353 HydrophobicContact CG-CE2 4.37Å; M294-F353 WeakPolarHBondContact O-CE2 3.1Å
295	V	93.1	Very high	88	Confident	33 Å²	33	51.4 Å²	51.4	20%	0.2	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-136.4	101.5	-173.7	-172.5	0	0	0	0	108.4	P204 C205 E206 R293 G297	P204-V295 HydrophobicContact CB-CG1 4.03Å; P204-V295 HydrophobicContact CG-CG1 3.76Å; C205-V295 WeakPolarHBondContact CA-O 3.39Å; E206-V295 HydrophobicContact CB-CB 3.98Å; E206-V295 HydrophobicContact CB-CG2 4.13Å; E206-V295 HydrophobicContact CG-CB 4.31Å; E206-V295 HydrophobicContact CG-CG2 4.4Å; E206-V295 PolarHBondContact N-O 2.84Å; E206-V295 PolarHBondContact O-N 3.03Å; R293-V295 HydrophobicContact CB-CG2 3.97Å; V295-G297 PolarHBondContact O-N 3.01Å
296	P	94	Very high	88.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-80.1	2.7	176.4	31.2	-33.8	0	0	0	114	Q250 F298 W346 Q350 F353	Q250-P296 PolarHBondContact OE1-O 3.12Å; P296-F298 HydrophobicContact CB-CD1 4.03Å; P296-F298 HydrophobicContact CB-CE1 3.57Å; P296-F298 HydrophobicContact CB-CZ 4.09Å; P296-F298 HydrophobicContact CG-CD1 3.78Å; P296-F298 HydrophobicContact CG-CD2 4.4Å; P296-F298 HydrophobicContact CG-CE1 3.47Å; P296-F298 VanDerWaalsContact CG-CE1 3.47Å; P296-F298 HydrophobicContact CG-CE2 4.11Å; P296-F298 HydrophobicContact CG-CG 4.25Å; P296-F298 HydrophobicContact CG-CZ 3.63Å; P296-W346 VanDerWaalsContact O-CD1 3.29Å; P296-W346 PolarHBondContact O-NE1 3.29Å; P296-Q350 HydrophobicContact CB-CG 3.99Å; P296-F353 HydrophobicContact CG-CD1 3.98Å; P296-F353 HydrophobicContact CG-CD2 4.03Å; P296-F353 HydrophobicContact CG-CE1 3.96Å; P296-F353 HydrophobicContact CG-CE2 4.05Å; P296-F353 HydrophobicContact CG-CG 4.02Å; P296-F353 HydrophobicContact CG-CZ 4.01Å
297	G	93.3	Very high	88.7	Confident	14 Å²	14	44.7 Å²	44.7	14%	0.144	23%	0.233	C	C	.	.	S	Bend	trans	103.2	-0.2	-174.6	0	0	0	0	0	114.9	S203 P204 V295	S203-G297 VanDerWaalsContact OG-CA 3.24Å; S203-G297 WeakPolarHBondContact OG-CA 3.24Å; P204-G297 WeakPolarHBondContact O-CA 3.38Å; P204-G297 PolarHBondContact O-N 2.99Å; V295-G297 PolarHBondContact O-N 3.01Å
298	F	93.2	Very high	89.2	Confident	16 Å²	16	42.3 Å²	42.3	7%	0.07	22%	0.221	C	C	.	.	S	Bend	trans	-145.2	164.1	179.7	61.2	-89.1	0	0	0	111.8	R252 P296 D302 E305 Q350 F353	R252-F298 VanDerWaalsContact CD-CD1 3.44Å; P296-F298 HydrophobicContact CB-CD1 4.03Å; P296-F298 HydrophobicContact CB-CE1 3.57Å; P296-F298 HydrophobicContact CB-CZ 4.09Å; P296-F298 HydrophobicContact CG-CD1 3.78Å; P296-F298 HydrophobicContact CG-CD2 4.4Å; P296-F298 HydrophobicContact CG-CE1 3.47Å; P296-F298 VanDerWaalsContact CG-CE1 3.47Å; P296-F298 HydrophobicContact CG-CE2 4.11Å; P296-F298 HydrophobicContact CG-CG 4.25Å; P296-F298 HydrophobicContact CG-CZ 3.63Å; F298-D302 HydrophobicContact CB-CB 4.18Å; F298-D302 HydrophobicContact CD2-CB 3.9Å; F298-D302 HydrophobicContact CG-CB 4.38Å; F298-E305 WeakPolarHBondContact CE1-O 3.11Å; F298-E305 HydrophobicContact CE2-CB 3.99Å; F298-E305 HydrophobicContact CE2-CG 3.97Å; F298-E305 VanDerWaalsContact CZ-CA 3.49Å; F298-E305 HydrophobicContact CZ-CB 3.87Å; F298-E305 HydrophobicContact CZ-CG 4.38Å; F298-E305 WeakPolarHBondContact CZ-O 3.37Å; F298-Q350 HydrophobicContact CE1-CG 4.26Å; F298-F353 HydrophobicContact CD2-CD1 4.16Å; F298-F353 HydrophobicContact CD2-CE1 4.35Å; F298-F353 AromaticContact CE2-CD1 3.61Å; F298-F353 HydrophobicContact CE2-CD1 3.61Å; F298-F353 HydrophobicContact CE2-CE1 4.23Å; F298-F353 HydrophobicContact CE2-CG 4.4Å; F298-F353 HydrophobicContact CZ-CD1 4.24Å; F298-F353 WeakPolarHBondContact O-CE1 3.47Å
299	E	90.5	Very high	89.8	Confident	153 Å²	153	41.8 Å²	41.8	72%	0.715	22%	0.219	S	C	*	.			trans	-87.9	152.4	176.7	-67.1	-166.7	168.2	0	0	112.6	G301 D302	E299-G301 PolarHBondContact O-N 3.31Å; E299-D302 WeakPolarHBondContact O-CB 3.45Å; E299-D302 PolarHBondContact O-N 3.02Å; E299-D302 VanDerWaalsContact O-N 3.12Å
300	Y	89.2	Confident	90.8	Very high	24 Å²	24	34.9 Å²	34.9	9%	0.094	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	120.7	-178.7	178.6	-110	0	0	0	111.1	A67 P68 F353 L451 A455 Y456	A67-Y300 HydrophobicContact CB-CD2 3.85Å; A67-Y300 HydrophobicContact CB-CE2 3.43Å; A67-Y300 VanDerWaalsContact CB-CE2 3.43Å; P68-Y300 HydrophobicContact CG-CD1 3.63Å; P68-Y300 HydrophobicContact CG-CE1 4.18Å; P68-Y300 HydrophobicContact CG-CG 3.85Å; Y300-F353 HydrophobicContact CD2-CD1 4.22Å; Y300-L451 HydrophobicContact CE2-CD1 4.46Å; Y300-A455 HydrophobicContact CD1-CB 4.24Å; Y300-A455 HydrophobicContact CE1-CB 3.69Å; Y300-A455 HydrophobicContact CE2-CB 4.09Å; Y300-Y456 HydrophobicContact CD1-CD2 4.42Å
301	G	86.9	Confident	91.8	Very high	17 Å²	17	31 Å²	31	18%	0.175	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.7	-1.7	-176.3	0	0	0	0	0	114.8	E299	E299-G301 PolarHBondContact O-N 3.31Å
302	D	92.2	Very high	92.8	Very high	34 Å²	34	27.1 Å²	27.1	18%	0.182	14%	0.141	C	C	.	.			trans	-59.2	139.5	166.3	-169.1	-86.9	0	0	0	110.7	Q198 R252 F298 E299 Q304 E305	Q198-D302 PolarHBondContact OE1-OD1 2.88Å; Q198-D302 PolarHBondContact OE1-OD2 3.37Å; R252-D302 IonicContact CZ-OD1 3.79Å; R252-D302 IonicContact NH1-OD1 3.76Å; R252-D302 PolarHBondContact NH1-OD1 3.39Å; R252-D302 IonicContact NH1-OD2 3.29Å; F298-D302 HydrophobicContact CB-CB 4.18Å; F298-D302 HydrophobicContact CD2-CB 3.9Å; F298-D302 HydrophobicContact CG-CB 4.38Å; E299-D302 WeakPolarHBondContact O-CB 3.45Å; E299-D302 PolarHBondContact O-N 3.02Å; E299-D302 VanDerWaalsContact O-N 3.12Å; D302-Q304 VanDerWaalsContact C-N 3.33Å; D302-Q304 PolarHBondContact O-N 3.31Å; D302-Q304 WeakPolarHBondContact OD1-CA 3.16Å; D302-Q304 WeakPolarHBondContact OD1-CB 3.33Å; D302-Q304 PolarHBondContact OD1-N 2.85Å; D302-E305 WeakPolarHBondContact O-CG 3.43Å
303	P	91.1	Very high	93.3	Very high	94 Å²	94	26.1 Å²	26.1	61%	0.61	14%	0.136	S	C	*	.	S	Bend	trans	-70.4	-25.2	179.2	26.6	-34.2	0	0	0	114.1	E305	P303-E305 PolarHBondContact O-N 3.48Å
304	Q	93.8	Very high	93.8	Very high	12 Å²	12	20.5 Å²	20.5	6%	0.056	11%	0.114	C	C	.	.			trans	-97.1	66.6	-177.8	-55.6	-55.6	71.2	0	0	110.9	T196 Q198 R252 T253 D302 F306	T196-Q304 PolarHBondContact O-NE2 3.13Å; Q198-Q304 HydrophobicContact CB-CB 4.46Å; Q198-Q304 HydrophobicContact CB-CG 4.26Å; Q198-Q304 HydrophobicContact CG-CB 4.4Å; Q198-Q304 HydrophobicContact CG-CG 3.8Å; R252-Q304 HydrophobicContact CB-CB 3.98Å; R252-Q304 WeakPolarHBondContact CB-O 3.31Å; R252-Q304 WeakPolarHBondContact CD-O 3.32Å; R252-Q304 PolarHBondContact NH1-O 3.13Å; T253-Q304 CarbonylContact O-C 3.59Å; T253-Q304 WeakPolarHBondContact O-CA 3.45Å; D302-Q304 VanDerWaalsContact C-N 3.33Å; D302-Q304 PolarHBondContact O-N 3.31Å; D302-Q304 WeakPolarHBondContact OD1-CA 3.16Å; D302-Q304 WeakPolarHBondContact OD1-CB 3.33Å; D302-Q304 PolarHBondContact OD1-N 2.85Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.21Å
305	E	93.3	Very high	93.9	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.028	12%	0.118	C	C	.	.			trans	-78.4	-11.6	-173.2	-58.6	178.4	161.3	0	0	114.3	T253 F298 D302 P303 R448	T253-E305 PolarHBondContact O-N 3.48Å; F298-E305 WeakPolarHBondContact CE1-O 3.11Å; F298-E305 HydrophobicContact CE2-CB 3.99Å; F298-E305 HydrophobicContact CE2-CG 3.97Å; F298-E305 VanDerWaalsContact CZ-CA 3.49Å; F298-E305 HydrophobicContact CZ-CB 3.87Å; F298-E305 HydrophobicContact CZ-CG 4.38Å; F298-E305 WeakPolarHBondContact CZ-O 3.37Å; D302-E305 WeakPolarHBondContact O-CG 3.43Å; P303-E305 PolarHBondContact O-N 3.48Å; E305-R448 IonicContact OE1-CZ 3.61Å; E305-R448 IonicContact OE1-NE 2.93Å; E305-R448 IonicContact OE1-NH2 3.29Å; E305-R448 PolarHBondContact OE1-NH2 3.19Å; E305-R448 IonicContact OE2-CZ 2.78Å; E305-R448 VanDerWaalsContact OE2-CZ 3.3Å; E305-R448 IonicContact OE2-NE 3.21Å; E305-R448 PolarHBondContact OE2-NE 3.09Å; E305-R448 IonicContact OE2-NH2 3.97Å; E305-R448 PolarHBondContact OE2-NH2 3.47Å
306	F	95.6	Very high	93.8	Very high	5 Å²	5	21.9 Å²	21.9	2%	0.022	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.8	-171.2	-60.1	-81.7	0	0	0	112.6	R252 T253 A254 F255 P256 Q304 L354 L366 L447	R252-F306 CarbonylContact C-O 3.52Å; R252-F306 VanDerWaalsContact CA-O 3.28Å; R252-F306 WeakPolarHBondContact CA-O 3.46Å; T253-F306 PolarHBondContact N-O 3.39Å; T253-F306 PolarHBondContact O-N 3.35Å; T253-F306 VanDerWaalsContact O-N 3.09Å; T253-F306 PolarHBondContact OG1-O 3.37Å; A254-F306 VanDerWaalsContact O-CD2 3.28Å; A254-F306 WeakPolarHBondContact O-CD2 3.43Å; A254-F306 WeakPolarHBondContact O-CE2 3.33Å; F255-F306 WeakPolarHBondContact O-CB 3.21Å; P256-F306 HydrophobicContact CB-CD1 3.57Å; P256-F306 HydrophobicContact CB-CE1 3.82Å; P256-F306 HydrophobicContact CB-CG 4.09Å; P256-F306 HydrophobicContact CG-CD1 4.25Å; P256-F306 HydrophobicContact CG-CE1 4.09Å; P256-F306 HydrophobicContact CG-CZ 4.37Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.21Å; F306-L354 HydrophobicContact CE1-CD1 3.76Å; F306-L354 HydrophobicContact CE1-CD2 4.2Å; F306-L354 HydrophobicContact CZ-CD1 4.34Å; F306-L354 HydrophobicContact CZ-CD2 3.95Å; F306-L366 HydrophobicContact CE1-CD2 4.3Å; F306-L447 HydrophobicContact CE1-CD2 4.46Å; F306-L447 HydrophobicContact CE2-CD1 4.24Å; F306-L447 HydrophobicContact CZ-CD1 4Å; F306-L447 HydrophobicContact CZ-CD2 3.93Å; F306-L447 HydrophobicContact CZ-CG 4.42Å
307	G	95.3	Very high	93.6	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.5	176.4	0	0	0	0	0	113.1
308	L	96.9	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-65.3	167.7	177.3	57.7	0	0	0	109.7	L194 V251 T253 L257 Q369 L439	L194-L308 HydrophobicContact CD2-CD2 4Å; V251-L308 HydrophobicContact CB-CB 4.42Å; V251-L308 HydrophobicContact CG1-CB 4.27Å; V251-L308 HydrophobicContact CG1-CD2 3.99Å; V251-L308 WeakPolarHBondContact O-CB 3.42Å; V251-L308 PolarHBondContact O-N 2.97Å; T253-L308 HydrophobicContact CG2-CB 3.98Å; T253-L308 HydrophobicContact CG2-CD2 4.12Å; L257-L308 HydrophobicContact CD2-CD1 3.87Å; L257-L308 HydrophobicContact CG-CD1 4.4Å; L308-Q369 WeakPolarHBondContact O-CB 3.29Å; L308-Q369 PolarHBondContact O-OE1 3.22Å; L308-L439 HydrophobicContact CD1-CD2 4.34Å
309	V	97.8	Very high	93.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.1	-179.4	173.1	0	0	0	0	109.8	V251 T311 W346 Q369 I371 F434 F435	V251-V309 PolarHBondContact N-O 3.28Å; V251-V309 PolarHBondContact O-N 2.05Å; V309-T311 HydrophobicContact CG1-CG2 4.2Å; V309-W346 VanDerWaalsContact C-CH2 3.48Å; V309-Q369 WeakPolarHBondContact CA-O 3.46Å; V309-Q369 HydrophobicContact CG2-CB 4.12Å; V309-I371 HydrophobicContact CG1-CD1 3.86Å; V309-I371 HydrophobicContact CG1-CG1 3.95Å; V309-F434 HydrophobicContact CG2-CB 3.71Å; V309-F435 HydrophobicContact CB-CE2 4.4Å; V309-F435 HydrophobicContact CG1-CE2 4.19Å; V309-F435 HydrophobicContact CG2-CD2 4.23Å; V309-F435 HydrophobicContact CG2-CE2 4.34Å
310	T	97.8	Very high	93.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.5	163.6	-174.1	0	0	0	0	110.2	S249 T342 W346 Q369 A370 I371	S249-T310 CarbonylContact O-C 3.46Å; S249-T310 WeakPolarHBondContact O-CA 3.22Å; S249-T310 PolarHBondContact O-OG1 3.37Å; T310-T342 HydrophobicContact CG2-CG2 4Å; T310-W346 HydrophobicContact CG2-CD2 4.32Å; T310-W346 HydrophobicContact CG2-CE3 3.62Å; T310-W346 HydrophobicContact CG2-CZ3 3.78Å; T310-Q369 PolarHBondContact N-O 3.09Å; T310-A370 HydrophobicContact CG2-CB 3.65Å; T310-A370 CarbonylContact O-C 3.18Å; T310-A370 WeakPolarHBondContact O-CA 3.33Å; T310-I371 PolarHBondContact O-N 3.4Å
311	T	98.1	Very high	93.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.9	178.3	65.2	0	0	0	0	110	F176 C248 S249 V309 I371	F176-T311 HydrophobicContact CB-CG2 4.17Å; F176-T311 WeakPolarHBondContact CB-OG1 3.46Å; F176-T311 HydrophobicContact CD1-CG2 3.63Å; F176-T311 HydrophobicContact CE1-CG2 4.06Å; F176-T311 VanDerWaalsContact CG-CB 3.43Å; F176-T311 HydrophobicContact CG-CG2 3.9Å; C248-T311 WeakPolarHBondContact CB-O 3.44Å; C248-T311 PolarHBondContact N-O 3.31Å; S249-T311 WeakPolarHBondContact CB-OG1 3.12Å; S249-T311 PolarHBondContact N-O 2.81Å; S249-T311 PolarHBondContact N-OG1 2.9Å; S249-T311 VanDerWaalsContact N-OG1 3.08Å; S249-T311 PolarHBondContact O-N 2.67Å; S249-T311 PolarHBondContact O-OG1 2.84Å; S249-T311 PolarHBondContact OG-OG1 2.78Å; V309-T311 HydrophobicContact CG1-CG2 4.2Å; T311-I371 CarbonylContact C-O 3.09Å; T311-I371 VanDerWaalsContact CA-O 3.3Å; T311-I371 WeakPolarHBondContact CA-O 3.49Å; T311-I371 HydrophobicContact CG2-CB 4.4Å
312	R	96.1	Very high	93.7	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.019	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	137.5	-178.3	172.3	174.3	-174.5	-75.2	-12.4	109.9	C107 P108 F176 E245 T342 I371 L372 S373	C107-R312 VanDerWaalsContact C-NH2 3.3Å; C107-R312 PolarHBondContact SG-NE 2.89Å; C107-R312 VanDerWaalsContact SG-NE 3.39Å; C107-R312 PolarHBondContact SG-NH2 3.35Å; P108-R312 VanDerWaalsContact N-NH2 3.2Å; F176-R312 WeakPolarHBondContact CE2-O 3.26Å; E245-R312 WeakPolarHBondContact OE1-CD 3.49Å; E245-R312 IonicContact OE1-NE 3.76Å; E245-R312 IonicContact OE2-CZ 2.8Å; E245-R312 IonicContact OE2-NE 3.67Å; E245-R312 PolarHBondContact OE2-NE 3.4Å; E245-R312 IonicContact OE2-NH2 3.06Å; R312-T342 WeakPolarHBondContact CD-OG1 3.29Å; R312-I371 PolarHBondContact N-O 3.07Å; R312-L372 HydrophobicContact CB-CD1 3.91Å; R312-L372 HydrophobicContact CB-CG 4Å; R312-L372 HydrophobicContact CG-CG 4.27Å; R312-L372 VanDerWaalsContact O-CA 3.22Å; R312-L372 WeakPolarHBondContact O-CA 3.49Å; R312-S373 PolarHBondContact O-N 2.96Å
313	S	96.1	Very high	93.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.014	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	145.4	167.8	156.1	0	0	0	0	109.7	N169 C248 G315 S373	N169-S313 WeakPolarHBondContact CA-OG 3.31Å; N169-S313 WeakPolarHBondContact OD1-CB 3.16Å; N169-S313 PolarHBondContact OD1-OG 2.98Å; C248-S313 PolarHBondContact SG-N 3.33Å; C248-S313 VanDerWaalsContact SG-N 3.43Å; S313-G315 PolarHBondContact OG-N 3.28Å; S313-S373 VanDerWaalsContact CA-O 3.28Å; S313-S373 WeakPolarHBondContact CA-O 3.39Å
314	F	94.9	Very high	93.7	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	15%	0.15	C	C	.	.			trans	-111.2	15.2	165.6	58.7	-102.1	0	0	0	112.1	D316 L317 I335 L372 S373 D374 K377 Y379	F314-D316 PolarHBondContact O-N 3.4Å; F314-L317 HydrophobicContact CB-CB 4.48Å; F314-L317 WeakPolarHBondContact O-CB 3.19Å; F314-L317 PolarHBondContact O-N 3.21Å; F314-I335 HydrophobicContact CD1-CG2 4.23Å; F314-I335 HydrophobicContact CD2-CD1 3.95Å; F314-I335 HydrophobicContact CD2-CG1 4.29Å; F314-I335 HydrophobicContact CE1-CD1 4.5Å; F314-I335 HydrophobicContact CE1-CG2 4.47Å; F314-I335 HydrophobicContact CE2-CD1 3.93Å; F314-I335 HydrophobicContact CG-CD1 4.29Å; F314-I335 HydrophobicContact CG-CG1 4.25Å; F314-I335 HydrophobicContact CZ-CD1 4.22Å; F314-L372 HydrophobicContact CD1-CB 3.9Å; F314-L372 HydrophobicContact CE1-CB 4.27Å; F314-S373 VanDerWaalsContact CE1-N 3.34Å; F314-S373 PolarHBondContact N-O 3.29Å; F314-S373 VanDerWaalsContact N-O 3.15Å; F314-D374 HydrophobicContact CD2-CB 4.2Å; F314-D374 HydrophobicContact CE2-CB 3.65Å; F314-D374 HydrophobicContact CZ-CB 4.03Å; F314-K377 HydrophobicContact CZ-CB 3.99Å; F314-Y379 AromaticContact CE1-CD2 3.87Å; F314-Y379 HydrophobicContact CE1-CD2 3.87Å; F314-Y379 HydrophobicContact CE1-CE2 4.44Å; F314-Y379 HydrophobicContact CZ-CD2 4.18Å; F314-Y379 HydrophobicContact CZ-CE2 4.36Å
315	G	92.6	Very high	93.6	Very high	13 Å²	13	35.7 Å²	35.7	13%	0.134	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.5	177.3	0	0	0	0	0	113.5	S313 L317 Y318	S313-G315 PolarHBondContact OG-N 3.28Å; G315-L317 VanDerWaalsContact C-N 3.25Å; G315-L317 PolarHBondContact O-N 2.73Å; G315-Y318 WeakPolarHBondContact O-CD2 3.49Å; G315-Y318 PolarHBondContact O-N 3.25Å
316	D	90.5	Very high	93.6	Very high	64 Å²	64	36.6 Å²	36.6	34%	0.342	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20	174.3	62.7	-12.3	0	0	0	113.6	P108 F314 Y318	P108-D316 WeakPolarHBondContact CD-OD2 3.3Å; F314-D316 PolarHBondContact O-N 3.4Å; D316-Y318 VanDerWaalsContact C-N 3.31Å; D316-Y318 PolarHBondContact O-N 3.45Å
317	L	91.3	Very high	93.5	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-29	176.4	-173.3	68.6	0	0	0	111.9	P108 F314 G315 A319 N320 L321 C334 I335	P108-L317 HydrophobicContact CB-CB 4.15Å; P108-L317 HydrophobicContact CB-CD1 3.38Å; P108-L317 HydrophobicContact CB-CG 4.33Å; P108-L317 HydrophobicContact CG-CD1 4.36Å; F314-L317 HydrophobicContact CB-CB 4.48Å; F314-L317 WeakPolarHBondContact O-CB 3.19Å; F314-L317 PolarHBondContact O-N 3.21Å; G315-L317 VanDerWaalsContact C-N 3.25Å; G315-L317 PolarHBondContact O-N 2.73Å; L317-A319 VanDerWaalsContact C-N 3.29Å; L317-A319 PolarHBondContact O-N 3Å; L317-N320 WeakPolarHBondContact O-CB 3.24Å; L317-N320 PolarHBondContact O-N 3.23Å; L317-L321 HydrophobicContact CB-CD1 4.41Å; L317-L321 HydrophobicContact CD1-CG 4.38Å; L317-L321 HydrophobicContact CD2-CD1 3.67Å; L317-L321 HydrophobicContact CD2-CD2 4.48Å; L317-L321 HydrophobicContact CD2-CG 4.22Å; L317-L321 HydrophobicContact CG-CD1 3.6Å; L317-L321 HydrophobicContact CG-CD2 4.34Å; L317-L321 HydrophobicContact CG-CG 3.77Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.45Å; L317-C334 HydrophobicContact CD1-CB 3.91Å; L317-C334 HydrophobicContact CD2-CB 3.78Å; L317-C334 HydrophobicContact CG-CB 4.43Å; L317-I335 HydrophobicContact CD2-CD1 4.45Å; L317-I335 HydrophobicContact CD2-CG1 3.59Å
318	Y	90.8	Very high	93.4	Very high	65 Å²	65	46.8 Å²	46.8	26%	0.255	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-33.3	-173.5	-73	-49.7	0	0	0	114.2	G315 D316 N320 L321 S322 D374	G315-Y318 WeakPolarHBondContact O-CD2 3.49Å; G315-Y318 PolarHBondContact O-N 3.25Å; D316-Y318 VanDerWaalsContact C-N 3.31Å; D316-Y318 PolarHBondContact O-N 3.45Å; Y318-N320 VanDerWaalsContact C-N 3.31Å; Y318-N320 PolarHBondContact O-N 2.89Å; Y318-L321 HydrophobicContact CD1-CD1 4.18Å; Y318-S322 VanDerWaalsContact O-CB 3.3Å; Y318-S322 WeakPolarHBondContact O-CB 3.4Å; Y318-S322 PolarHBondContact O-N 2.97Å; Y318-S322 PolarHBondContact O-OG 3.29Å; Y318-D374 HydrophobicContact CE2-CB 3.92Å; Y318-D374 PolarHBondContact OH-OD2 2.81Å
319	A	89.2	Confident	93.3	Very high	73 Å²	73	53.1 Å²	53.1	60%	0.603	28%	0.283	S	S	*	.	H	α-helix	trans	-63.9	-40.2	176.1	0	0	0	0	0	111.4	L317 R323	L317-A319 VanDerWaalsContact C-N 3.29Å; L317-A319 PolarHBondContact O-N 3Å; A319-R323 WeakPolarHBondContact O-CB 3.35Å; A319-R323 PolarHBondContact O-N 3.43Å
320	N	90.2	Very high	93.1	Very high	32 Å²	32	55 Å²	55	17%	0.171	29%	0.292	C	S	.	.	H	α-helix	trans	-71.5	-47.7	177.7	-80.5	-11.7	0	0	0	111.5	L317 Y318 S322 R323 W324	L317-N320 WeakPolarHBondContact O-CB 3.24Å; L317-N320 PolarHBondContact O-N 3.23Å; Y318-N320 VanDerWaalsContact C-N 3.31Å; Y318-N320 PolarHBondContact O-N 2.89Å; N320-S322 VanDerWaalsContact C-N 3.35Å; N320-S322 PolarHBondContact O-N 3.14Å; N320-R323 WeakPolarHBondContact O-CB 3.12Å; N320-R323 PolarHBondContact O-N 2.89Å; N320-R323 VanDerWaalsContact O-N 3.15Å; N320-R323 PolarHBondContact OD1-NH2 3.03Å; N320-W324 HydrophobicContact CB-CD2 4.39Å; N320-W324 HydrophobicContact CB-CE3 4.31Å; N320-W324 HydrophobicContact CB-CH2 3.56Å; N320-W324 HydrophobicContact CB-CZ2 3.61Å; N320-W324 HydrophobicContact CB-CZ3 3.92Å; N320-W324 PolarHBondContact O-N 3.17Å
321	L	91.7	Very high	93	Very high	11 Å²	11	56.4 Å²	56.4	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-44.5	178.9	-66.7	169.2	0	0	0	112.2	L317 Y318 R323 W324 E325 A326 E331 C334	L317-L321 HydrophobicContact CB-CD1 4.41Å; L317-L321 HydrophobicContact CD1-CG 4.38Å; L317-L321 HydrophobicContact CD2-CD1 3.67Å; L317-L321 HydrophobicContact CD2-CD2 4.48Å; L317-L321 HydrophobicContact CD2-CG 4.22Å; L317-L321 HydrophobicContact CG-CD1 3.6Å; L317-L321 HydrophobicContact CG-CD2 4.34Å; L317-L321 HydrophobicContact CG-CG 3.77Å; L317-L321 WeakPolarHBondContact O-CG 3.46Å; L317-L321 PolarHBondContact O-N 3.45Å; Y318-L321 HydrophobicContact CD1-CD1 4.18Å; L321-R323 VanDerWaalsContact C-N 3.3Å; L321-R323 PolarHBondContact O-N 3.35Å; L321-W324 HydrophobicContact CD2-CE3 4.23Å; L321-W324 HydrophobicContact CD2-CZ3 4.33Å; L321-W324 PolarHBondContact O-N 3.22Å; L321-E325 PolarHBondContact O-N 3.35Å; L321-A326 HydrophobicContact CB-CB 4.17Å; L321-A326 HydrophobicContact CD2-CB 3.6Å; L321-A326 HydrophobicContact CG-CB 4.49Å; L321-A326 PolarHBondContact O-N 2.97Å; L321-E331 HydrophobicContact CD1-CB 4.01Å; L321-E331 HydrophobicContact CD1-CG 3.69Å; L321-E331 HydrophobicContact CD2-CB 4.22Å; L321-C334 HydrophobicContact CD2-CB 4.41Å
322	S	91.4	Very high	92.8	Very high	92 Å²	92	58.5 Å²	58.5	64%	0.643	31%	0.308	S	S	*	.	H	α-helix	trans	-62.7	-39	177.4	-55.8	0	0	0	0	111.6	Y318 N320 W324 E325	Y318-S322 VanDerWaalsContact O-CB 3.3Å; Y318-S322 WeakPolarHBondContact O-CB 3.4Å; Y318-S322 PolarHBondContact O-N 2.97Å; Y318-S322 PolarHBondContact O-OG 3.29Å; N320-S322 VanDerWaalsContact C-N 3.35Å; N320-S322 PolarHBondContact O-N 3.14Å; S322-W324 VanDerWaalsContact C-N 3.31Å; S322-W324 PolarHBondContact O-N 2.49Å; S322-E325 PolarHBondContact O-N 2.9Å
323	R	92.1	Very high	92.8	Very high	162 Å²	162	61.1 Å²	61.1	61%	0.611	32%	0.32	S	S	*	.	H	α-helix	trans	-66.6	-33.4	176.9	-177.9	-176.6	66.9	-176.3	-3.9	112.3	A319 N320 L321 E325	A319-R323 WeakPolarHBondContact O-CB 3.35Å; A319-R323 PolarHBondContact O-N 3.43Å; N320-R323 WeakPolarHBondContact O-CB 3.12Å; N320-R323 PolarHBondContact O-N 2.89Å; N320-R323 VanDerWaalsContact O-N 3.15Å; N320-R323 PolarHBondContact OD1-NH2 3.03Å; L321-R323 VanDerWaalsContact C-N 3.3Å; L321-R323 PolarHBondContact O-N 3.35Å; R323-E325 VanDerWaalsContact C-N 3.32Å
324	W	91.9	Very high	92.8	Very high	47 Å²	47	61 Å²	61	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-85.7	-6.5	179.8	-56.3	-33.7	0	0	0	113.5	P109 D110 Y112 N320 L321 S322 A326	P109-W324 WeakPolarHBondContact O-CH2 3.29Å; D110-W324 WeakPolarHBondContact O-CZ2 3.45Å; Y112-W324 HydrophobicContact CD1-CB 3.94Å; Y112-W324 HydrophobicContact CD1-CD2 4.15Å; Y112-W324 HydrophobicContact CD1-CE3 4.19Å; Y112-W324 HydrophobicContact CD1-CG 4.05Å; Y112-W324 HydrophobicContact CE1-CB 4.23Å; N320-W324 HydrophobicContact CB-CD2 4.39Å; N320-W324 HydrophobicContact CB-CE3 4.31Å; N320-W324 HydrophobicContact CB-CH2 3.56Å; N320-W324 HydrophobicContact CB-CZ2 3.61Å; N320-W324 HydrophobicContact CB-CZ3 3.92Å; N320-W324 PolarHBondContact O-N 3.17Å; L321-W324 HydrophobicContact CD2-CE3 4.23Å; L321-W324 HydrophobicContact CD2-CZ3 4.33Å; L321-W324 PolarHBondContact O-N 3.22Å; S322-W324 VanDerWaalsContact C-N 3.31Å; S322-W324 PolarHBondContact O-N 2.49Å; W324-A326 HydrophobicContact CB-CB 4.39Å; W324-A326 PolarHBondContact O-N 2.71Å
325	E	92.9	Very high	92.8	Very high	170 Å²	170	61 Å²	61	79%	0.794	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.2	-169.7	-58.2	179.8	171.6	0	0	110.8	L321 S322 R323	L321-E325 PolarHBondContact O-N 3.35Å; S322-E325 PolarHBondContact O-N 2.9Å; R323-E325 VanDerWaalsContact C-N 3.32Å
326	A	91.8	Very high	93	Very high	25 Å²	25	60.8 Å²	60.8	21%	0.207	32%	0.315	C	S	.	.			trans	-66.8	135.4	-171	0	0	0	0	0	111.9	L321 W324 E330	L321-A326 HydrophobicContact CB-CB 4.17Å; L321-A326 HydrophobicContact CD2-CB 3.6Å; L321-A326 HydrophobicContact CG-CB 4.49Å; L321-A326 PolarHBondContact O-N 2.97Å; W324-A326 HydrophobicContact CB-CB 4.39Å; W324-A326 PolarHBondContact O-N 2.71Å; A326-E330 VanDerWaalsContact CA-OE2 3.25Å; A326-E330 WeakPolarHBondContact CA-OE2 3.3Å; A326-E330 HydrophobicContact CB-CB 4.11Å
327	E	94.1	Very high	93.3	Very high	127 Å²	127	57.7 Å²	57.7	59%	0.593	30%	0.299	S	S	*	.			trans	-73.8	161.6	175	-67.9	-64.2	159.8	0	0	111.2	D329 E330 E331	E327-D329 PolarHBondContact O-N 2.87Å; E327-D329 VanDerWaalsContact O-N 3.15Å; E327-E330 HydrophobicContact CB-CG 4.45Å; E327-E330 PolarHBondContact N-OE2 3.39Å; E327-E330 WeakPolarHBondContact O-CB 3.42Å; E327-E330 PolarHBondContact O-N 3.05Å; E327-E331 PolarHBondContact O-N 2.99Å
328	P	92.9	Very high	93.5	Very high	91 Å²	91	57.7 Å²	57.7	59%	0.591	30%	0.299	S	S	*	.	H	α-helix	trans	-55.3	-34.1	-179.2	-28.1	35.8	0	0	0	114.8	H332	P328-H332 WeakPolarHBondContact O-CB 3.34Å; P328-H332 PolarHBondContact O-N 3.38Å
329	D	94.5	Very high	93.8	Very high	133 Å²	133	54.6 Å²	54.6	71%	0.711	29%	0.287	S	S	*	.	H	α-helix	trans	-69.7	-36	176.8	-67.8	-21.7	0	0	0	111.4	E327 H332 E333	E327-D329 PolarHBondContact O-N 2.87Å; E327-D329 VanDerWaalsContact O-N 3.15Å; D329-H332 WeakPolarHBondContact O-CB 3.5Å; D329-H332 PolarHBondContact O-N 3.24Å; D329-E333 PolarHBondContact O-N 3.08Å
330	E	94.7	Very high	94.2	Very high	39 Å²	39	51.1 Å²	51.1	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-72.7	-37.7	177.2	-63.5	176.7	145.4	0	0	111.6	Y112 A326 E327 H332 E333 C334	Y112-E330 HydrophobicContact CD2-CG 4.22Å; Y112-E330 WeakPolarHBondContact CD2-OE1 2.99Å; Y112-E330 VanDerWaalsContact CE2-OE1 3.24Å; Y112-E330 WeakPolarHBondContact CE2-OE1 3.5Å; A326-E330 VanDerWaalsContact CA-OE2 3.25Å; A326-E330 WeakPolarHBondContact CA-OE2 3.3Å; A326-E330 HydrophobicContact CB-CB 4.11Å; E327-E330 HydrophobicContact CB-CG 4.45Å; E327-E330 PolarHBondContact N-OE2 3.39Å; E327-E330 WeakPolarHBondContact O-CB 3.42Å; E327-E330 PolarHBondContact O-N 3.05Å; E330-H332 VanDerWaalsContact C-N 3.32Å; E330-E333 PolarHBondContact O-N 2.9Å; E330-C334 WeakPolarHBondContact O-CB 3.34Å; E330-C334 PolarHBondContact O-N 3.02Å; E330-C334 PolarHBondContact O-SG 3.3Å
331	E	94.3	Very high	94.5	Very high	31 Å²	31	49.8 Å²	49.8	15%	0.145	25%	0.251	C	S	.	.	H	α-helix	trans	-55.5	-49.9	167.9	173.2	-174.2	154.9	0	0	110	L321 E327 E333 C334 I335 K377	L321-E331 HydrophobicContact CD1-CB 4.01Å; L321-E331 HydrophobicContact CD1-CG 3.69Å; L321-E331 HydrophobicContact CD2-CB 4.22Å; E327-E331 PolarHBondContact O-N 2.99Å; E331-E333 PolarHBondContact O-N 3.44Å; E331-C334 PolarHBondContact O-N 3.15Å; E331-I335 HydrophobicContact CG-CD1 3.9Å; E331-I335 WeakPolarHBondContact O-CG1 3.33Å; E331-I335 PolarHBondContact O-N 3.18Å; E331-K377 VanDerWaalsContact CD-NZ 3.34Å; E331-K377 IonicContact OE1-NZ 2.9Å; E331-K377 PolarHBondContact OE1-NZ 3.12Å; E331-K377 IonicContact OE2-NZ 3.77Å; E331-K377 PolarHBondContact OE2-NZ 3.03Å
332	H	95.3	Very high	94.7	Very high	44 Å²	44	49.2 Å²	49.2	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-48.5	-179.9	-177.3	73.1	0	0	0	111.7	P328 D329 E330 C334 I335 L336 Y379 F404 G406	P328-H332 WeakPolarHBondContact O-CB 3.34Å; P328-H332 PolarHBondContact O-N 3.38Å; D329-H332 WeakPolarHBondContact O-CB 3.5Å; D329-H332 PolarHBondContact O-N 3.24Å; E330-H332 VanDerWaalsContact C-N 3.32Å; H332-C334 VanDerWaalsContact C-N 3.32Å; H332-C334 PolarHBondContact O-N 3.42Å; H332-I335 PolarHBondContact O-N 2.76Å; H332-L336 WeakPolarHBondContact NE2-CD1 3.44Å; H332-L336 WeakPolarHBondContact O-CG 3.48Å; H332-L336 PolarHBondContact O-N 2.98Å; H332-Y379 AromaticContact CE1-CE1 3.67Å; H332-Y379 AromaticContact ND1-CE1 3.45Å; H332-Y379 WeakPolarHBondContact ND1-CE1 3.31Å; H332-Y379 AromaticContact ND1-CZ 3.67Å; H332-Y379 PolarHBondContact ND1-OH 2.78Å; H332-F404 AromaticContact CE1-CE2 3.75Å; H332-F404 AromaticContact NE2-CE2 3.75Å; H332-G406 PolarHBondContact CE1-O 2.82Å
333	E	95.2	Very high	95	Very high	59 Å²	59	44.9 Å²	44.9	28%	0.276	22%	0.218	S	C	.	.	H	α-helix	trans	-61.8	-37.2	177.5	-73.6	-159.4	172.3	0	0	113.4	L115 D329 E330 E331 L336 S337	L115-E333 HydrophobicContact CB-CB 4.09Å; L115-E333 HydrophobicContact CB-CG 4.31Å; L115-E333 HydrophobicContact CD2-CB 4.33Å; L115-E333 HydrophobicContact CD2-CG 3.94Å; D329-E333 PolarHBondContact O-N 3.08Å; E330-E333 PolarHBondContact O-N 2.9Å; E331-E333 PolarHBondContact O-N 3.44Å; E333-L336 PolarHBondContact O-N 3.26Å; E333-S337 WeakPolarHBondContact O-CB 3.28Å; E333-S337 PolarHBondContact O-N 2.91Å; E333-S337 PolarHBondContact O-OG 2.91Å
334	C	95.8	Very high	95.2	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-42.3	176.9	-71.2	0	0	0	0	111.4	L317 L321 E330 E331 H332 S337 A338	L317-C334 HydrophobicContact CD1-CB 3.91Å; L317-C334 HydrophobicContact CD2-CB 3.78Å; L317-C334 HydrophobicContact CG-CB 4.43Å; L321-C334 HydrophobicContact CD2-CB 4.41Å; E330-C334 WeakPolarHBondContact O-CB 3.34Å; E330-C334 PolarHBondContact O-N 3.02Å; E330-C334 PolarHBondContact O-SG 3.3Å; E331-C334 PolarHBondContact O-N 3.15Å; H332-C334 VanDerWaalsContact C-N 3.32Å; H332-C334 PolarHBondContact O-N 3.42Å; C334-S337 PolarHBondContact O-N 2.85Å; C334-A338 WeakPolarHBondContact O-CB 3.43Å; C334-A338 PolarHBondContact O-N 2.98Å
335	I	96.3	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-41	177	-62.5	168.3	0	0	0	110.7	F314 L317 E331 H332 A338 G339 L372 Y379	F314-I335 HydrophobicContact CD1-CG2 4.23Å; F314-I335 HydrophobicContact CD2-CD1 3.95Å; F314-I335 HydrophobicContact CD2-CG1 4.29Å; F314-I335 HydrophobicContact CE1-CD1 4.5Å; F314-I335 HydrophobicContact CE1-CG2 4.47Å; F314-I335 HydrophobicContact CE2-CD1 3.93Å; F314-I335 HydrophobicContact CG-CD1 4.29Å; F314-I335 HydrophobicContact CG-CG1 4.25Å; F314-I335 HydrophobicContact CZ-CD1 4.22Å; L317-I335 HydrophobicContact CD2-CD1 4.45Å; L317-I335 HydrophobicContact CD2-CG1 3.59Å; E331-I335 HydrophobicContact CG-CD1 3.9Å; E331-I335 WeakPolarHBondContact O-CG1 3.33Å; E331-I335 PolarHBondContact O-N 3.18Å; H332-I335 PolarHBondContact O-N 2.76Å; I335-A338 PolarHBondContact O-N 3.36Å; I335-G339 PolarHBondContact O-N 3.12Å; I335-L372 HydrophobicContact CG2-CD2 4.26Å; I335-Y379 HydrophobicContact CB-CE2 4.38Å; I335-Y379 HydrophobicContact CD1-CD2 4.34Å; I335-Y379 HydrophobicContact CD1-CE2 3.6Å; I335-Y379 HydrophobicContact CG2-CD1 3.93Å; I335-Y379 HydrophobicContact CG2-CD2 3.65Å; I335-Y379 HydrophobicContact CG2-CE1 4.09Å; I335-Y379 HydrophobicContact CG2-CE2 3.82Å; I335-Y379 HydrophobicContact CG2-CG 3.69Å
336	L	96.9	Very high	95.7	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-45	174.2	-71.2	-174.7	0	0	0	112.1	L115 H332 E333 A338 G339 I340 F381 F404	L115-L336 HydrophobicContact CD1-CB 3.94Å; L115-L336 HydrophobicContact CD2-CB 4.35Å; L115-L336 HydrophobicContact CD2-CD1 3.92Å; H332-L336 WeakPolarHBondContact NE2-CD1 3.44Å; H332-L336 WeakPolarHBondContact O-CG 3.48Å; H332-L336 PolarHBondContact O-N 2.98Å; E333-L336 PolarHBondContact O-N 3.26Å; L336-A338 VanDerWaalsContact C-N 3.26Å; L336-A338 PolarHBondContact O-N 3.29Å; L336-G339 PolarHBondContact O-N 2.98Å; L336-I340 VanDerWaalsContact O-CG1 3.29Å; L336-I340 WeakPolarHBondContact O-CG1 3.32Å; L336-I340 PolarHBondContact O-N 2.93Å; L336-F381 HydrophobicContact CD2-CE1 3.72Å; L336-F381 HydrophobicContact CD2-CZ 4.01Å; L336-F404 HydrophobicContact CD1-CE1 4.27Å; L336-F404 HydrophobicContact CD1-CE2 4.39Å; L336-F404 HydrophobicContact CD1-CZ 4.1Å; L336-F404 HydrophobicContact CD2-CB 4.05Å; L336-F404 HydrophobicContact CD2-CD1 3.91Å; L336-F404 HydrophobicContact CD2-CD2 3.47Å; L336-F404 VanDerWaalsContact CD2-CD2 3.47Å; L336-F404 HydrophobicContact CD2-CE1 4.21Å; L336-F404 HydrophobicContact CD2-CE2 3.81Å; L336-F404 HydrophobicContact CD2-CG 3.51Å; L336-F404 HydrophobicContact CD2-CZ 4.16Å
337	S	96	Very high	95.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58	-44	176.8	-58.6	0	0	0	0	110.8	L115 Y118 E333 C334 I340 A341	L115-S337 WeakPolarHBondContact CA-OG 3.2Å; L115-S337 PolarHBondContact N-OG 3.37Å; Y118-S337 WeakPolarHBondContact CD1-O 3.42Å; E333-S337 WeakPolarHBondContact O-CB 3.28Å; E333-S337 PolarHBondContact O-N 2.91Å; E333-S337 PolarHBondContact O-OG 2.91Å; C334-S337 PolarHBondContact O-N 2.85Å; S337-I340 PolarHBondContact O-N 3Å; S337-A341 WeakPolarHBondContact O-CB 3.5Å; S337-A341 PolarHBondContact O-N 3Å
338	A	95.8	Very high	96	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-64.3	-46.1	177.8	0	0	0	0	0	112.1	C107 C334 I335 L336 I340 A341 T342 L372	C107-A338 VanDerWaalsContact SG-CA 3.56Å; C107-A338 VanDerWaalsContact SG-CB 3.59Å; C334-A338 WeakPolarHBondContact O-CB 3.43Å; C334-A338 PolarHBondContact O-N 2.98Å; I335-A338 PolarHBondContact O-N 3.36Å; L336-A338 VanDerWaalsContact C-N 3.26Å; L336-A338 PolarHBondContact O-N 3.29Å; A338-I340 PolarHBondContact O-N 2.85Å; A338-A341 PolarHBondContact O-N 3Å; A338-T342 PolarHBondContact O-N 2.83Å; A338-T342 PolarHBondContact O-OG1 2.89Å; A338-L372 HydrophobicContact CB-CD2 4.35Å
339	G	96.7	Very high	96.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.7	-42.1	176	0	0	0	0	0	113.4	I335 L336 C343	I335-G339 PolarHBondContact O-N 3.12Å; L336-G339 PolarHBondContact O-N 2.98Å; G339-C343 WeakPolarHBondContact O-CB 3.46Å; G339-C343 PolarHBondContact O-N 3.21Å; G339-C343 VanDerWaalsContact O-N 3.08Å; G339-C343 PolarHBondContact O-SG 2.89Å
340	I	97.3	Very high	96.2	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.005	4%	0.044	C	C	.	.	H	α-helix	trans	-60.6	-50.7	174.6	-69	165	0	0	0	110.3	L115 K119 T122 T124 V126 L336 S337 A338 C343 F344 Y383 C402	L115-I340 HydrophobicContact CD1-CD1 3.56Å; K119-I340 HydrophobicContact CG-CD1 4.11Å; T122-I340 HydrophobicContact CG2-CG2 4.25Å; T124-I340 HydrophobicContact CG2-CG2 4.33Å; V126-I340 HydrophobicContact CG2-CD1 3.57Å; V126-I340 HydrophobicContact CG2-CG1 4.37Å; L336-I340 VanDerWaalsContact O-CG1 3.29Å; L336-I340 WeakPolarHBondContact O-CG1 3.32Å; L336-I340 PolarHBondContact O-N 2.93Å; S337-I340 PolarHBondContact O-N 3Å; A338-I340 PolarHBondContact O-N 2.85Å; I340-C343 PolarHBondContact O-N 3.16Å; I340-F344 WeakPolarHBondContact O-CB 3.48Å; I340-F344 PolarHBondContact O-N 2.9Å; I340-Y383 HydrophobicContact CG2-CE2 4.43Å; I340-C402 HydrophobicContact CG1-CB 4.26Å
341	A	96.6	Very high	96.3	Very high	3 Å²	3	7.3 Å²	7.3	3%	0.025	4%	0.035	C	C	.	.	H	α-helix	trans	-64.5	-44.8	-176.2	0	0	0	0	0	112.1	V105 Y118 Y243 S337 A338 A345	V105-A341 HydrophobicContact CG1-CB 4.35Å; Y118-A341 HydrophobicContact CD1-CB 3.9Å; Y118-A341 HydrophobicContact CE1-CB 3.76Å; Y243-A341 HydrophobicContact CD2-CB 4.03Å; Y243-A341 HydrophobicContact CE2-CB 3.57Å; S337-A341 WeakPolarHBondContact O-CB 3.5Å; S337-A341 PolarHBondContact O-N 3Å; A338-A341 PolarHBondContact O-N 3Å; A341-A345 WeakPolarHBondContact O-CB 3.35Å; A341-A345 PolarHBondContact O-N 2.57Å
342	T	96.2	Very high	96.3	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-58.9	-51.6	176.1	-57.4	0	0	0	0	111.4	Y243 E245 V247 T310 R312 A338 F344 W346	Y243-T342 VanDerWaalsContact OH-CA 3.27Å; Y243-T342 WeakPolarHBondContact OH-CA 3.48Å; Y243-T342 PolarHBondContact OH-N 3.37Å; Y243-T342 PolarHBondContact OH-OG1 3.32Å; E245-T342 WeakPolarHBondContact OE1-CG2 3.46Å; E245-T342 PolarHBondContact OE1-OG1 2.79Å; V247-T342 HydrophobicContact CG1-CG2 3.93Å; T310-T342 HydrophobicContact CG2-CG2 4Å; R312-T342 WeakPolarHBondContact CD-OG1 3.29Å; A338-T342 PolarHBondContact O-N 2.83Å; A338-T342 PolarHBondContact O-OG1 2.89Å; T342-F344 PolarHBondContact O-N 2.81Å; T342-W346 WeakPolarHBondContact O-CB 3.39Å; T342-W346 PolarHBondContact O-N 3.13Å
343	C	97.6	Very high	96.2	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-63.1	-46.8	-178.5	-67.4	0	0	0	0	111.9	G339 I340 W346 L347 A370 Y383	G339-C343 WeakPolarHBondContact O-CB 3.46Å; G339-C343 PolarHBondContact O-N 3.21Å; G339-C343 VanDerWaalsContact O-N 3.08Å; G339-C343 PolarHBondContact O-SG 2.89Å; I340-C343 PolarHBondContact O-N 3.16Å; C343-W346 PolarHBondContact O-N 2.97Å; C343-L347 WeakPolarHBondContact O-CG 3.39Å; C343-L347 PolarHBondContact O-N 3.05Å; C343-L347 VanDerWaalsContact O-N 3.08Å; C343-A370 WeakPolarHBondContact SG-CB 3.21Å; C343-Y383 HydrophobicContact CB-CD1 4.41Å; C343-Y383 HydrophobicContact CB-CD2 3.58Å; C343-Y383 HydrophobicContact CB-CE2 4.42Å; C343-Y383 HydrophobicContact CB-CG 3.59Å
344	F	97.5	Very high	96.2	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-63.5	-47.2	-178.8	174.3	-100.4	0	0	0	111.5	T122 W209 I340 T342 W346 L347 I348 Y383 L385 L390	T122-F344 HydrophobicContact CG2-CB 4.14Å; T122-F344 HydrophobicContact CG2-CD1 3.47Å; T122-F344 VanDerWaalsContact CG2-CD1 3.47Å; T122-F344 HydrophobicContact CG2-CD2 4.13Å; T122-F344 HydrophobicContact CG2-CE1 3.73Å; T122-F344 HydrophobicContact CG2-CE2 4.35Å; T122-F344 HydrophobicContact CG2-CG 3.64Å; T122-F344 HydrophobicContact CG2-CZ 4.14Å; W209-F344 AromaticContact CD2-CE1 3.6Å; W209-F344 HydrophobicContact CD2-CE1 3.6Å; W209-F344 HydrophobicContact CD2-CZ 4.26Å; W209-F344 AromaticContact CE2-CE1 3.58Å; W209-F344 AromaticContact CE3-CE1 3.89Å; W209-F344 HydrophobicContact CE3-CE1 3.89Å; W209-F344 HydrophobicContact CG-CE1 4.03Å; W209-F344 HydrophobicContact CG-CZ 4.21Å; W209-F344 HydrophobicContact CH2-CD1 4.45Å; W209-F344 HydrophobicContact CH2-CE1 4.18Å; W209-F344 HydrophobicContact CZ2-CD1 4.45Å; W209-F344 AromaticContact CZ2-CE1 3.89Å; W209-F344 HydrophobicContact CZ2-CE1 3.89Å; W209-F344 HydrophobicContact CZ3-CE1 4.18Å; W209-F344 AromaticContact NE1-CE1 3.96Å; I340-F344 WeakPolarHBondContact O-CB 3.48Å; I340-F344 PolarHBondContact O-N 2.9Å; T342-F344 PolarHBondContact O-N 2.81Å; F344-W346 VanDerWaalsContact C-N 3.34Å; F344-W346 PolarHBondContact O-N 3.33Å; F344-L347 PolarHBondContact O-N 2.86Å; F344-I348 HydrophobicContact CD1-CD1 4.2Å; F344-I348 HydrophobicContact CD1-CG1 4.48Å; F344-I348 HydrophobicContact CD2-CD1 4.34Å; F344-I348 HydrophobicContact CD2-CG1 4.32Å; F344-I348 HydrophobicContact CE1-CD1 3.41Å; F344-I348 VanDerWaalsContact CE1-CD1 3.41Å; F344-I348 HydrophobicContact CE1-CG1 4.15Å; F344-I348 HydrophobicContact CE2-CD1 3.59Å; F344-I348 HydrophobicContact CE2-CG1 3.98Å; F344-I348 HydrophobicContact CZ-CD1 3.08Å; F344-I348 HydrophobicContact CZ-CG1 3.92Å; F344-I348 WeakPolarHBondContact O-CB 3.31Å; F344-I348 WeakPolarHBondContact O-CG1 3.33Å; F344-I348 PolarHBondContact O-N 3.43Å; F344-Y383 HydrophobicContact CB-CE2 4.34Å; F344-Y383 HydrophobicContact CD2-CE1 4.47Å; F344-Y383 WeakPolarHBondContact CD2-OH 3.27Å; F344-L385 HydrophobicContact CD2-CD1 3.83Å; F344-L385 HydrophobicContact CE2-CD1 3.92Å; F344-L390 HydrophobicContact CE2-CD1 4.05Å; F344-L390 HydrophobicContact CZ-CD1 3.6Å
345	A	96.4	Very high	96.1	Very high	1 Å²	1	2 Å²	2	1%	0.008	1%	0.01	C	C	.	.	H	α-helix	trans	-61	-43.8	178.7	0	0	0	0	0	111.5	A207 Y243 A341 L347 I348 G349	A207-A345 HydrophobicContact CB-CB 3.75Å; Y243-A345 HydrophobicContact CD1-CB 3.22Å; Y243-A345 HydrophobicContact CD2-CB 4.16Å; Y243-A345 HydrophobicContact CE1-CB 3.71Å; Y243-A345 HydrophobicContact CG-CB 3.45Å; Y243-A345 VanDerWaalsContact CG-CB 3.45Å; A341-A345 WeakPolarHBondContact O-CB 3.35Å; A341-A345 PolarHBondContact O-N 2.57Å; A345-L347 PolarHBondContact O-N 3.01Å; A345-I348 PolarHBondContact O-N 3.42Å; A345-G349 PolarHBondContact O-N 3.5Å
346	W	97.3	Very high	96.1	Very high	1 Å²	1	2 Å²	2	0%	0.004	1%	0.01	C	C	.	.	H	α-helix	trans	-62.4	-45.2	179.8	-169.2	34.7	0	0	0	112.2	Q250 R252 P296 V309 T310 T342 C343 F344 G349 Q350	Q250-W346 HydrophobicContact CB-CZ2 4.05Å; Q250-W346 HydrophobicContact CG-CZ2 3.97Å; R252-W346 HydrophobicContact CG-CZ2 4.45Å; P296-W346 VanDerWaalsContact O-CD1 3.29Å; P296-W346 PolarHBondContact O-NE1 3.29Å; V309-W346 VanDerWaalsContact C-CH2 3.48Å; T310-W346 HydrophobicContact CG2-CD2 4.32Å; T310-W346 HydrophobicContact CG2-CE3 3.62Å; T310-W346 HydrophobicContact CG2-CZ3 3.78Å; T342-W346 WeakPolarHBondContact O-CB 3.39Å; T342-W346 PolarHBondContact O-N 3.13Å; C343-W346 PolarHBondContact O-N 2.97Å; F344-W346 VanDerWaalsContact C-N 3.34Å; F344-W346 PolarHBondContact O-N 3.33Å; W346-G349 PolarHBondContact O-N 3.15Å; W346-Q350 VanDerWaalsContact CE2-NE2 3.31Å; W346-Q350 WeakPolarHBondContact O-CG 3.24Å; W346-Q350 PolarHBondContact O-N 2.86Å; W346-Q350 VanDerWaalsContact O-N 3.13Å
347	L	97.5	Very high	95.9	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-72	-34.1	179.7	-66.9	170.3	0	0	0	112.8	C343 F344 A345 G349 Q350 A351 L366 Y383 L385	C343-L347 WeakPolarHBondContact O-CG 3.39Å; C343-L347 PolarHBondContact O-N 3.05Å; C343-L347 VanDerWaalsContact O-N 3.08Å; F344-L347 PolarHBondContact O-N 2.86Å; A345-L347 PolarHBondContact O-N 3.01Å; L347-G349 VanDerWaalsContact C-N 3.32Å; L347-Q350 PolarHBondContact O-N 2.86Å; L347-A351 WeakPolarHBondContact O-CB 3.46Å; L347-A351 PolarHBondContact O-N 2.95Å; L347-L366 HydrophobicContact CD2-CB 4.19Å; L347-Y383 HydrophobicContact CD1-CD1 3.47Å; L347-Y383 VanDerWaalsContact CD1-CD1 3.47Å; L347-Y383 HydrophobicContact CD1-CE1 4.24Å; L347-Y383 HydrophobicContact CD1-CG 4.21Å; L347-L385 HydrophobicContact CB-CB 4.13Å; L347-L385 HydrophobicContact CB-CD2 3.78Å; L347-L385 HydrophobicContact CB-CG 4.48Å; L347-L385 HydrophobicContact CD1-CB 4.01Å
348	I	96.2	Very high	95.7	Very high	1 Å²	1	2 Å²	2	1%	0.005	1%	0.01	C	C	.	.	H	α-helix	trans	-62.2	-42.2	171.4	-80.7	-154.6	0	0	0	111	A207 W209 M294 F344 A345 Q350 A351 H352 L385 I388	A207-I348 HydrophobicContact CB-CB 4.43Å; A207-I348 HydrophobicContact CB-CG2 4Å; W209-I348 HydrophobicContact CB-CD1 3.98Å; W209-I348 HydrophobicContact CG-CD1 4.37Å; M294-I348 HydrophobicContact CE-CG2 3.96Å; M294-I348 HydrophobicContact SD-CG2 3.89Å; F344-I348 HydrophobicContact CD1-CD1 4.2Å; F344-I348 HydrophobicContact CD1-CG1 4.48Å; F344-I348 HydrophobicContact CD2-CD1 4.34Å; F344-I348 HydrophobicContact CD2-CG1 4.32Å; F344-I348 HydrophobicContact CE1-CD1 3.41Å; F344-I348 VanDerWaalsContact CE1-CD1 3.41Å; F344-I348 HydrophobicContact CE1-CG1 4.15Å; F344-I348 HydrophobicContact CE2-CD1 3.59Å; F344-I348 HydrophobicContact CE2-CG1 3.98Å; F344-I348 HydrophobicContact CZ-CD1 3.08Å; F344-I348 HydrophobicContact CZ-CG1 3.92Å; F344-I348 WeakPolarHBondContact O-CB 3.31Å; F344-I348 WeakPolarHBondContact O-CG1 3.33Å; F344-I348 PolarHBondContact O-N 3.43Å; A345-I348 PolarHBondContact O-N 3.42Å; I348-Q350 VanDerWaalsContact C-N 3.33Å; I348-Q350 PolarHBondContact O-N 2.87Å; I348-A351 PolarHBondContact O-N 3.16Å; I348-H352 PolarHBondContact O-N 2.94Å; I348-H352 PolarHBondContact O-ND1 3.39Å; I348-L385 HydrophobicContact CG1-CD1 4.42Å; I348-L385 HydrophobicContact CG1-CD2 4.39Å; I348-I388 HydrophobicContact CD1-CG2 4.21Å; I348-I388 HydrophobicContact CG1-CG2 3.93Å
349	G	94.9	Very high	95.4	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-55.5	-49.7	174.2	0	0	0	0	0	111.9	M294 A345 W346 L347 H352 F353	M294-G349 VanDerWaalsContact SD-CA 3.55Å; A345-G349 PolarHBondContact O-N 3.5Å; W346-G349 PolarHBondContact O-N 3.15Å; L347-G349 VanDerWaalsContact C-N 3.32Å; G349-H352 PolarHBondContact O-N 3.48Å; G349-F353 WeakPolarHBondContact O-CD2 3.23Å; G349-F353 PolarHBondContact O-N 3.46Å
350	Q	95.8	Very high	95.2	Very high	3 Å²	3	4.7 Å²	4.7	1%	0.014	2%	0.021	C	C	.	.	H	α-helix	trans	-62.6	-45.5	177.6	-67.8	173.1	46.5	0	0	111.6	P296 F298 W346 L347 I348 H352 F353 L354	P296-Q350 HydrophobicContact CB-CG 3.99Å; F298-Q350 HydrophobicContact CE1-CG 4.26Å; W346-Q350 VanDerWaalsContact CE2-NE2 3.31Å; W346-Q350 WeakPolarHBondContact O-CG 3.24Å; W346-Q350 PolarHBondContact O-N 2.86Å; W346-Q350 VanDerWaalsContact O-N 3.13Å; L347-Q350 PolarHBondContact O-N 2.86Å; I348-Q350 VanDerWaalsContact C-N 3.33Å; I348-Q350 PolarHBondContact O-N 2.87Å; Q350-H352 VanDerWaalsContact C-N 3.29Å; Q350-H352 PolarHBondContact O-N 3.23Å; Q350-F353 PolarHBondContact O-N 3.12Å; Q350-F353 VanDerWaalsContact O-N 3.13Å; Q350-L354 WeakPolarHBondContact O-CG 3.14Å; Q350-L354 PolarHBondContact O-N 3.46Å
351	A	96.2	Very high	95	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-57.2	-43.3	178.9	0	0	0	0	0	112	L347 I348 F353 L354 G355 F356 I362 L366 L385 I388	L347-A351 WeakPolarHBondContact O-CB 3.46Å; L347-A351 PolarHBondContact O-N 2.95Å; I348-A351 PolarHBondContact O-N 3.16Å; A351-F353 PolarHBondContact O-N 3.34Å; A351-L354 PolarHBondContact O-N 2.81Å; A351-G355 PolarHBondContact O-N 3.44Å; A351-F356 HydrophobicContact CB-CB 4.22Å; A351-F356 HydrophobicContact CB-CD2 4.39Å; A351-F356 WeakPolarHBondContact O-CB 3.08Å; A351-F356 WeakPolarHBondContact O-CD2 3.46Å; A351-F356 PolarHBondContact O-N 3.1Å; A351-I362 HydrophobicContact CB-CG2 4.05Å; A351-L366 HydrophobicContact CB-CD1 3.69Å; A351-L385 HydrophobicContact CB-CD2 4.32Å; A351-I388 HydrophobicContact CB-CD1 4.29Å; A351-I388 HydrophobicContact CB-CG2 4.41Å
352	H	95.1	Very high	94.8	Very high	3 Å²	3	6.4 Å²	6.4	1%	0.014	3%	0.03	C	C	.	.	H	α-helix	trans	-63.8	-39.9	177.5	-80.6	85.8	0	0	0	112.9	I71 M294 I348 G349 Q350 L354 G355 F356	I71-H352 HydrophobicContact CD1-CB 3.97Å; I71-H352 HydrophobicContact CG1-CB 3.88Å; M294-H352 HydrophobicContact CE-CB 4.37Å; M294-H352 WeakPolarHBondContact CE-ND1 3.44Å; M294-H352 HydrophobicContact CG-CB 3.76Å; M294-H352 HydrophobicContact SD-CB 4.29Å; I348-H352 PolarHBondContact O-N 2.94Å; I348-H352 PolarHBondContact O-ND1 3.39Å; G349-H352 PolarHBondContact O-N 3.48Å; Q350-H352 VanDerWaalsContact C-N 3.29Å; Q350-H352 PolarHBondContact O-N 3.23Å; H352-L354 PolarHBondContact O-N 3.47Å; H352-G355 PolarHBondContact O-N 2.95Å; H352-F356 WeakPolarHBondContact CA-O 3.49Å
353	F	94.2	Very high	94.7	Very high	20 Å²	20	9.8 Å²	9.8	9%	0.088	5%	0.051	C	C	.	.	H	α-helix	trans	-68.7	-26	176.8	-85.5	-132.1	0	0	0	112.4	A67 I71 M294 P296 F298 Y300 G349 Q350 A351 G355	A67-F353 VanDerWaalsContact CB-O 3.3Å; A67-F353 WeakPolarHBondContact CB-O 3.08Å; I71-F353 HydrophobicContact CD1-CD2 3.64Å; I71-F353 HydrophobicContact CD1-CE2 3.7Å; M294-F353 HydrophobicContact CG-CE2 4.37Å; M294-F353 WeakPolarHBondContact O-CE2 3.1Å; P296-F353 HydrophobicContact CG-CD1 3.98Å; P296-F353 HydrophobicContact CG-CD2 4.03Å; P296-F353 HydrophobicContact CG-CE1 3.96Å; P296-F353 HydrophobicContact CG-CE2 4.05Å; P296-F353 HydrophobicContact CG-CG 4.02Å; P296-F353 HydrophobicContact CG-CZ 4.01Å; F298-F353 HydrophobicContact CD2-CD1 4.16Å; F298-F353 HydrophobicContact CD2-CE1 4.35Å; F298-F353 AromaticContact CE2-CD1 3.61Å; F298-F353 HydrophobicContact CE2-CD1 3.61Å; F298-F353 HydrophobicContact CE2-CE1 4.23Å; F298-F353 HydrophobicContact CE2-CG 4.4Å; F298-F353 HydrophobicContact CZ-CD1 4.24Å; F298-F353 WeakPolarHBondContact O-CE1 3.47Å; Y300-F353 HydrophobicContact CD2-CD1 4.22Å; G349-F353 WeakPolarHBondContact O-CD2 3.23Å; G349-F353 PolarHBondContact O-N 3.46Å; Q350-F353 PolarHBondContact O-N 3.12Å; Q350-F353 VanDerWaalsContact O-N 3.13Å; A351-F353 PolarHBondContact O-N 3.34Å; F353-G355 PolarHBondContact O-N 3.26Å
354	L	94.1	Very high	94.5	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.005	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-2.9	171.7	-63.7	166.4	0	0	0	113.3	F306 Q350 A351 H352 F356 L366 R448	F306-L354 HydrophobicContact CE1-CD1 3.76Å; F306-L354 HydrophobicContact CE1-CD2 4.2Å; F306-L354 HydrophobicContact CZ-CD1 4.34Å; F306-L354 HydrophobicContact CZ-CD2 3.95Å; Q350-L354 WeakPolarHBondContact O-CG 3.14Å; Q350-L354 PolarHBondContact O-N 3.46Å; A351-L354 PolarHBondContact O-N 2.81Å; H352-L354 PolarHBondContact O-N 3.47Å; L354-F356 HydrophobicContact CB-CD2 3.75Å; L354-F356 HydrophobicContact CB-CE2 3.81Å; L354-F356 HydrophobicContact CD1-CE2 4.41Å; L354-L366 HydrophobicContact CD1-CD1 4.17Å; L354-L366 HydrophobicContact CD1-CD2 4.03Å; L354-R448 HydrophobicContact CD2-CG 3.99Å
355	G	94.3	Very high	94.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	3.4	176.9	0	0	0	0	0	115.1	A351 H352 F353 Y450	A351-G355 PolarHBondContact O-N 3.44Å; H352-G355 PolarHBondContact O-N 2.95Å; F353-G355 PolarHBondContact O-N 3.26Å; G355-Y450 WeakPolarHBondContact O-CB 3.14Å
356	F	95.2	Very high	94.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.057	C	C	.	.			trans	-74.4	148.2	171.4	-56.9	-71.2	0	0	0	110.4	A351 H352 L354 N360 D361 I362 T363 Y364 I388 P449 Y450	A351-F356 HydrophobicContact CB-CB 4.22Å; A351-F356 HydrophobicContact CB-CD2 4.39Å; A351-F356 WeakPolarHBondContact O-CB 3.08Å; A351-F356 WeakPolarHBondContact O-CD2 3.46Å; A351-F356 PolarHBondContact O-N 3.1Å; H352-F356 WeakPolarHBondContact CA-O 3.49Å; L354-F356 HydrophobicContact CB-CD2 3.75Å; L354-F356 HydrophobicContact CB-CE2 3.81Å; L354-F356 HydrophobicContact CD1-CE2 4.41Å; F356-N360 WeakPolarHBondContact CA-O 3.19Å; F356-D361 WeakPolarHBondContact CD1-O 3.49Å; F356-I362 HydrophobicContact CB-CG2 3.83Å; F356-I362 HydrophobicContact CD1-CB 4.33Å; F356-I362 HydrophobicContact CD1-CG2 4.01Å; F356-I362 HydrophobicContact CD2-CG2 3.75Å; F356-I362 HydrophobicContact CE2-CG2 4.3Å; F356-I362 HydrophobicContact CG-CB 4.39Å; F356-I362 HydrophobicContact CG-CG2 3.59Å; F356-T363 HydrophobicContact CE1-CG2 4.23Å; F356-Y364 HydrophobicContact CE2-CE1 4.05Å; F356-Y364 HydrophobicContact CZ-CD1 4.35Å; F356-Y364 AromaticContact CZ-CE1 3.7Å; F356-Y364 HydrophobicContact CZ-CE1 3.7Å; F356-I388 HydrophobicContact CB-CD1 3.66Å; F356-P449 HydrophobicContact CE1-CG 3.65Å; F356-P449 HydrophobicContact CZ-CG 3.83Å; F356-Y450 AromaticContact CD1-CD2 3.54Å; F356-Y450 HydrophobicContact CD1-CD2 3.54Å; F356-Y450 AromaticContact CD1-CE2 3.45Å; F356-Y450 HydrophobicContact CD1-CE2 3.45Å; F356-Y450 VanDerWaalsContact CD1-CE2 3.45Å; F356-Y450 AromaticContact CE1-CD2 3.78Å; F356-Y450 HydrophobicContact CE1-CD2 3.78Å; F356-Y450 AromaticContact CE1-CE2 3.58Å; F356-Y450 HydrophobicContact CE1-CE2 3.58Å; F356-Y450 HydrophobicContact CG-CD2 4.48Å
357	T	93.7	Very high	94.4	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.006	6%	0.058	C	C	.	.	B	Isolated β-bridge	trans	-142.3	170.9	174.7	70.5	0	0	0	0	110.1	V61 K70 V74 Y359 N360 I388	V61-T357 HydrophobicContact CG1-CG2 3.82Å; K70-T357 HydrophobicContact CB-CG2 4.24Å; V74-T357 HydrophobicContact CG1-CG2 3.97Å; V74-T357 HydrophobicContact CG2-CG2 4.12Å; T357-Y359 PolarHBondContact O-N 3.4Å; T357-Y359 PolarHBondContact OG1-N 2.8Å; T357-N360 PolarHBondContact N-O 3.35Å; T357-N360 CarbonylContact O-C 3.52Å; T357-N360 PolarHBondContact O-N 3.16Å; T357-N360 PolarHBondContact OG1-N 3.2Å; T357-I388 VanDerWaalsContact C-CD1 3.4Å; T357-I388 WeakPolarHBondContact O-CD1 3.41Å
358	Q	90.4	Very high	94.3	Very high	5 Å²	5	11.1 Å²	11.1	2%	0.023	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-7.9	174.5	68	-85.8	17.7	0	0	114.6	V74 I391	V74-Q358 PolarHBondContact O-NE2 3.33Å; V74-Q358 VanDerWaalsContact O-NE2 3.17Å; Q358-I391 HydrophobicContact CB-CD1 3.84Å; Q358-I391 HydrophobicContact CB-CG1 4.33Å; Q358-I391 HydrophobicContact CG-CD1 3.31Å; Q358-I391 HydrophobicContact CG-CG1 4.15Å
359	Y	90.2	Very high	94.4	Very high	45 Å²	45	11 Å²	11	18%	0.176	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-21.9	174.1	-55.9	-78	0	0	0	113.5	Y57 V74 T357 I391	Y57-Y359 HydrophobicContact CD1-CD1 4.17Å; Y57-Y359 AromaticContact CD1-CD2 3.73Å; Y57-Y359 HydrophobicContact CD1-CD2 3.73Å; Y57-Y359 AromaticContact CD1-CE1 3.89Å; Y57-Y359 HydrophobicContact CD1-CE1 3.89Å; Y57-Y359 AromaticContact CD1-CE2 3.43Å; Y57-Y359 HydrophobicContact CD1-CE2 3.43Å; Y57-Y359 VanDerWaalsContact CD1-CE2 3.43Å; Y57-Y359 HydrophobicContact CD1-CG 4.08Å; Y57-Y359 AromaticContact CD1-CZ 3.5Å; Y57-Y359 VanDerWaalsContact CD1-CZ 3.5Å; Y57-Y359 AromaticContact CE1-CD2 3.83Å; Y57-Y359 HydrophobicContact CE1-CD2 3.83Å; Y57-Y359 AromaticContact CE1-CE2 3.29Å; Y57-Y359 HydrophobicContact CE1-CE2 3.29Å; Y57-Y359 AromaticContact CE1-CZ 3.68Å; V74-Y359 HydrophobicContact CB-CE2 4.36Å; V74-Y359 HydrophobicContact CG1-CD2 3.94Å; V74-Y359 HydrophobicContact CG1-CE2 4.1Å; T357-Y359 PolarHBondContact O-N 3.4Å; T357-Y359 PolarHBondContact OG1-N 2.8Å; Y359-I391 HydrophobicContact CD1-CD1 4.07Å; Y359-I391 HydrophobicContact CE1-CD1 3.6Å; Y359-I391 HydrophobicContact CE2-CD1 4.46Å
360	N	91.8	Very high	94.6	Very high	13 Å²	13	11 Å²	11	7%	0.07	6%	0.058	C	C	.	.	B	Isolated β-bridge	trans	-124.5	86.3	179	-65.8	-55	0	0	0	108.1	A58 F356 T357 Y450	A58-N360 PolarHBondContact O-ND2 3.49Å; F356-N360 WeakPolarHBondContact CA-O 3.19Å; T357-N360 PolarHBondContact N-O 3.35Å; T357-N360 CarbonylContact O-C 3.52Å; T357-N360 PolarHBondContact O-N 3.16Å; T357-N360 PolarHBondContact OG1-N 3.2Å; N360-Y450 HydrophobicContact CB-CD1 4.47Å; N360-Y450 HydrophobicContact CB-CD2 4.06Å; N360-Y450 HydrophobicContact CB-CE1 4.35Å; N360-Y450 HydrophobicContact CB-CE2 3.94Å; N360-Y450 HydrophobicContact CB-CG 4.33Å
361	D	93.3	Very high	94.7	Very high	36 Å²	36	10.9 Å²	10.9	19%	0.193	6%	0.057	C	C	.	.			trans	-66.5	161.7	-168.7	-157.4	11.7	0	0	0	113.6	F356 T363 T387 I388 S389 Y450	F356-D361 WeakPolarHBondContact CD1-O 3.49Å; D361-T363 PolarHBondContact O-N 3.19Å; D361-T387 WeakPolarHBondContact OD1-CA 3.26Å; D361-T387 PolarHBondContact OD1-OG1 3.31Å; D361-T387 WeakPolarHBondContact OD2-CB 3.32Å; D361-T387 PolarHBondContact OD2-OG1 3.47Å; D361-I388 WeakPolarHBondContact OD1-CG1 3.38Å; D361-I388 PolarHBondContact OD1-N 2.85Å; D361-S389 PolarHBondContact OD1-N 3.11Å; D361-Y450 WeakPolarHBondContact O-CE2 3.28Å; D361-Y450 PolarHBondContact O-OH 2.88Å
362	I	94	Very high	94.8	Very high	5 Å²	5	10.9 Å²	10.9	3%	0.026	6%	0.057	C	C	.	.			trans	-64.4	128.1	-179.8	52.6	159.6	0	0	0	111.8	K263 A351 F356 L366 L385 N386 I388	K263-I362 PolarHBondContact NZ-O 3.41Å; A351-I362 HydrophobicContact CB-CG2 4.05Å; F356-I362 HydrophobicContact CB-CG2 3.83Å; F356-I362 HydrophobicContact CD1-CB 4.33Å; F356-I362 HydrophobicContact CD1-CG2 4.01Å; F356-I362 HydrophobicContact CD2-CG2 3.75Å; F356-I362 HydrophobicContact CE2-CG2 4.3Å; F356-I362 HydrophobicContact CG-CB 4.39Å; F356-I362 HydrophobicContact CG-CG2 3.59Å; I362-L366 HydrophobicContact CG2-CD1 4.45Å; I362-L385 HydrophobicContact CD1-CG 4.14Å; I362-L385 WeakPolarHBondContact CD1-O 3.47Å; I362-N386 WeakPolarHBondContact CD1-O 3.5Å; I362-N386 WeakPolarHBondContact CG1-O 3.31Å; I362-I388 HydrophobicContact CG2-CD1 4.29Å; I362-I388 HydrophobicContact CG2-CG1 4.35Å; I362-I388 HydrophobicContact CG2-CG2 4.49Å
363	T	92.5	Very high	94.9	Very high	70 Å²	70	10.8 Å²	10.8	43%	0.429	6%	0.057	S	C	.	.	S	Bend	trans	-79.6	-30.6	-178.8	50.7	0	0	0	0	112.2	K263 F356 D361 P449 Y450	K263-T363 PolarHBondContact NZ-O 3.09Å; F356-T363 HydrophobicContact CE1-CG2 4.23Å; D361-T363 PolarHBondContact O-N 3.19Å; T363-P449 HydrophobicContact CG2-CG 4.1Å; T363-Y450 HydrophobicContact CG2-CE2 4.46Å
364	Y	93.4	Very high	95	Very high	8 Å²	8	10.9 Å²	10.9	3%	0.031	6%	0.058	C	C	.	.	S	Bend	trans	-126.4	154.8	175	56.2	-86.8	0	0	0	110.3	F356 L366 F445 E446 L447	F356-Y364 HydrophobicContact CE2-CE1 4.05Å; F356-Y364 HydrophobicContact CZ-CD1 4.35Å; F356-Y364 AromaticContact CZ-CE1 3.7Å; F356-Y364 HydrophobicContact CZ-CE1 3.7Å; Y364-L366 HydrophobicContact CD2-CD2 4.26Å; Y364-L366 HydrophobicContact CE2-CD2 3.56Å; Y364-L366 HydrophobicContact CE2-CG 4.32Å; Y364-F445 AromaticContact CD1-CD2 3.33Å; Y364-F445 HydrophobicContact CD1-CD2 3.33Å; Y364-F445 AromaticContact CD1-CE2 3.65Å; Y364-F445 HydrophobicContact CD1-CE2 3.65Å; Y364-F445 HydrophobicContact CD1-CG 4.12Å; Y364-F445 AromaticContact CD2-CD2 3.97Å; Y364-F445 HydrophobicContact CD2-CD2 3.97Å; Y364-F445 AromaticContact CD2-CE2 3.35Å; Y364-F445 HydrophobicContact CD2-CE2 3.35Å; Y364-F445 AromaticContact CD2-CZ 3.88Å; Y364-F445 HydrophobicContact CD2-CZ 3.88Å; Y364-F445 AromaticContact CE1-CD2 3.74Å; Y364-F445 HydrophobicContact CE1-CD2 3.74Å; Y364-F445 AromaticContact CE1-CE2 3.96Å; Y364-F445 HydrophobicContact CE1-CE2 3.96Å; Y364-F445 HydrophobicContact CE2-CD2 4.29Å; Y364-F445 AromaticContact CE2-CE2 3.65Å; Y364-F445 HydrophobicContact CE2-CE2 3.65Å; Y364-F445 HydrophobicContact CE2-CZ 4.47Å; Y364-F445 AromaticContact CG-CD2 3.49Å; Y364-F445 HydrophobicContact CG-CD2 3.49Å; Y364-F445 VanDerWaalsContact CG-CD2 3.49Å; Y364-F445 AromaticContact CG-CE2 3.36Å; Y364-F445 HydrophobicContact CG-CE2 3.36Å; Y364-F445 HydrophobicContact CG-CG 4.19Å; Y364-F445 AromaticContact CG-CZ 3.98Å; Y364-F445 HydrophobicContact CG-CZ 3.98Å; Y364-F445 AromaticContact CZ-CE2 3.97Å; Y364-E446 WeakPolarHBondContact CE1-O 3.41Å; Y364-L447 HydrophobicContact CE2-CD2 4.21Å; Y364-L447 WeakPolarHBondContact OH-CA 3.34Å; Y364-L447 PolarHBondContact OH-O 3.01Å
365	P	95.4	Very high	95.1	Very high	15 Å²	15	11.1 Å²	11.1	10%	0.097	6%	0.059	C	C	.	.			trans	-66.1	140.6	175.9	-19.6	32.8	0	0	0	112.1	P259 K263 Q384 L385	P259-P365 HydrophobicContact CB-CB 4.3Å; P259-P365 HydrophobicContact CB-CG 4.25Å; P259-P365 HydrophobicContact CG-CB 4.25Å; P259-P365 HydrophobicContact CG-CG 4.19Å; K263-P365 HydrophobicContact CD-CG 4.37Å; K263-P365 HydrophobicContact CG-CG 3.72Å; P365-Q384 HydrophobicContact CB-CG 3.75Å; P365-L385 VanDerWaalsContact CA-O 3.27Å; P365-L385 WeakPolarHBondContact CA-O 3.47Å
366	L	96.4	Very high	95.1	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.01	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	130	168.1	-68.9	171.1	0	0	0	108.9	F306 L347 A351 L354 I362 Y364 L385	F306-L366 HydrophobicContact CE1-CD2 4.3Å; L347-L366 HydrophobicContact CD2-CB 4.19Å; A351-L366 HydrophobicContact CB-CD1 3.69Å; L354-L366 HydrophobicContact CD1-CD1 4.17Å; L354-L366 HydrophobicContact CD1-CD2 4.03Å; I362-L366 HydrophobicContact CG2-CD1 4.45Å; Y364-L366 HydrophobicContact CD2-CD2 4.26Å; Y364-L366 HydrophobicContact CE2-CD2 3.56Å; Y364-L366 HydrophobicContact CE2-CG 4.32Å; L366-L385 HydrophobicContact CB-CB 4.3Å; L366-L385 HydrophobicContact CD1-CD2 4.45Å; L366-L385 PolarHBondContact N-O 2.99Å; L366-L385 WeakPolarHBondContact O-CB 3.28Å; L366-L385 PolarHBondContact O-N 3.25Å
367	C	97.3	Very high	95.2	Very high	5 Å²	5	19.6 Å²	19.6	3%	0.034	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143.5	179.7	-68.1	0	0	0	0	110.8	L257 P259 F260 Y383	L257-C367 HydrophobicContact CB-CB 3.75Å; L257-C367 HydrophobicContact CD1-CB 4.46Å; P259-C367 VanDerWaalsContact CA-SG 3.58Å; F260-C367 HydrophobicContact CD2-CB 4.27Å; F260-C367 HydrophobicContact CE2-CB 3.77Å; F260-C367 HydrophobicContact CZ-CB 4.24Å; C367-Y383 CarbonylContact C-O 3.57Å; C367-Y383 VanDerWaalsContact CA-O 3.26Å; C367-Y383 WeakPolarHBondContact CA-O 3.33Å
368	G	96.5	Very high	95.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.6	177.2	0	0	0	0	0	110.4	Y383	G368-Y383 PolarHBondContact N-O 3.35Å; G368-Y383 PolarHBondContact O-N 3.36Å
369	Q	98	Very high	95.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.1	-177.6	-55.2	164.1	-1	0	0	108.7	Y134 L257 F260 L308 V309 T310 F381 F434	Y134-Q369 PolarHBondContact OH-NE2 3.44Å; L257-Q369 HydrophobicContact CD1-CG 3.79Å; F260-Q369 HydrophobicContact CZ-CG 4.34Å; L308-Q369 WeakPolarHBondContact O-CB 3.29Å; L308-Q369 PolarHBondContact O-OE1 3.22Å; V309-Q369 WeakPolarHBondContact CA-O 3.46Å; V309-Q369 HydrophobicContact CG2-CB 4.12Å; T310-Q369 PolarHBondContact N-O 3.09Å; Q369-F381 CarbonylContact C-O 3.58Å; Q369-F381 VanDerWaalsContact CA-O 3.29Å; Q369-F381 WeakPolarHBondContact CA-O 3.44Å; Q369-F434 HydrophobicContact CB-CD2 3.54Å; Q369-F434 HydrophobicContact CB-CE2 3.86Å; Q369-F434 HydrophobicContact CB-CG 4.43Å; Q369-F434 VanDerWaalsContact CD-CD2 3.43Å; Q369-F434 HydrophobicContact CG-CD2 3.6Å; Q369-F434 HydrophobicContact CG-CE2 3.94Å; Q369-F434 VanDerWaalsContact OE1-CD2 3.29Å; Q369-F434 PolarHBondContact OE1-O 2.83Å
370	A	98.2	Very high	96.2	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.1	174.7	0	0	0	0	0	112.2	T310 C343 L372 F381	T310-A370 HydrophobicContact CG2-CB 3.65Å; T310-A370 CarbonylContact O-C 3.18Å; T310-A370 WeakPolarHBondContact O-CA 3.33Å; C343-A370 WeakPolarHBondContact SG-CB 3.21Å; A370-L372 HydrophobicContact CB-CD1 3.92Å; A370-F381 HydrophobicContact CB-CB 4.19Å; A370-F381 PolarHBondContact N-O 3.42Å; A370-F381 PolarHBondContact O-N 2.82Å
371	I	98.5	Very high	96.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.3	172.9	-52.3	177.9	0	0	0	108.3	F176 V309 T310 T311 R312 W378 F380 F434 F435	F176-I371 HydrophobicContact CE1-CB 4.4Å; F176-I371 HydrophobicContact CE1-CG2 3.93Å; F176-I371 HydrophobicContact CZ-CG2 4.24Å; V309-I371 HydrophobicContact CG1-CD1 3.86Å; V309-I371 HydrophobicContact CG1-CG1 3.95Å; T310-I371 PolarHBondContact O-N 3.4Å; T311-I371 CarbonylContact C-O 3.09Å; T311-I371 VanDerWaalsContact CA-O 3.3Å; T311-I371 WeakPolarHBondContact CA-O 3.49Å; T311-I371 HydrophobicContact CG2-CB 4.4Å; R312-I371 PolarHBondContact N-O 3.07Å; I371-W378 HydrophobicContact CG2-CE3 3.51Å; I371-W378 HydrophobicContact CG2-CZ3 3.49Å; I371-W378 VanDerWaalsContact CG2-CZ3 3.49Å; I371-F380 HydrophobicContact CD1-CE1 4.4Å; I371-F380 HydrophobicContact CG1-CD1 4.13Å; I371-F380 HydrophobicContact CG1-CE1 4.35Å; I371-F380 HydrophobicContact CG2-CD1 4.07Å; I371-F380 HydrophobicContact CG2-CE1 3.86Å; I371-F434 HydrophobicContact CD1-CD1 4.26Å; I371-F434 HydrophobicContact CG1-CD1 4.25Å; I371-F435 HydrophobicContact CD1-CE2 4.41Å
372	L	98	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.6	-179.3	-92.5	72.1	0	0	0	109.3	R312 F314 I335 A338 A370 Y379 F381	R312-L372 HydrophobicContact CB-CD1 3.91Å; R312-L372 HydrophobicContact CB-CG 4Å; R312-L372 HydrophobicContact CG-CG 4.27Å; R312-L372 VanDerWaalsContact O-CA 3.22Å; R312-L372 WeakPolarHBondContact O-CA 3.49Å; F314-L372 HydrophobicContact CD1-CB 3.9Å; F314-L372 HydrophobicContact CE1-CB 4.27Å; I335-L372 HydrophobicContact CG2-CD2 4.26Å; A338-L372 HydrophobicContact CB-CD2 4.35Å; A370-L372 HydrophobicContact CB-CD1 3.92Å; L372-Y379 PolarHBondContact N-O 3.46Å; L372-Y379 PolarHBondContact O-N 3.41Å; L372-F381 HydrophobicContact CB-CE2 4.05Å; L372-F381 HydrophobicContact CD1-CD2 4.06Å; L372-F381 HydrophobicContact CD1-CE2 4.11Å; L372-F381 HydrophobicContact CD2-CE2 3.97Å; L372-F381 HydrophobicContact CG-CE2 4.27Å
373	S	97.8	Very high	96.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	162.2	179.6	-163.9	0	0	0	0	113.7	T172 R312 S313 F314 L375 K377 W378	T172-S373 WeakPolarHBondContact CG2-O 3.46Å; R312-S373 PolarHBondContact O-N 2.96Å; S313-S373 VanDerWaalsContact CA-O 3.28Å; S313-S373 WeakPolarHBondContact CA-O 3.39Å; F314-S373 VanDerWaalsContact CE1-N 3.34Å; F314-S373 PolarHBondContact N-O 3.29Å; F314-S373 VanDerWaalsContact N-O 3.15Å; S373-L375 WeakPolarHBondContact OG-CA 3.4Å; S373-L375 PolarHBondContact OG-N 3.25Å; S373-K377 WeakPolarHBondContact CA-O 3.34Å; S373-K377 PolarHBondContact OG-O 2.84Å; S373-W378 PolarHBondContact OG-NE1 2.94Å
374	D	95.7	Very high	97.2	Very high	23 Å²	23	11.4 Å²	11.4	12%	0.123	5%	0.05	C	C	.	.	S	Bend	trans	-116.4	21.2	159.8	70.9	-20.9	0	0	0	111.1	V168 F314 Y318 R376 K377	V168-D374 HydrophobicContact CG1-CB 4.01Å; F314-D374 HydrophobicContact CD2-CB 4.2Å; F314-D374 HydrophobicContact CE2-CB 3.65Å; F314-D374 HydrophobicContact CZ-CB 4.03Å; Y318-D374 HydrophobicContact CE2-CB 3.92Å; Y318-D374 PolarHBondContact OH-OD2 2.81Å; D374-R376 PolarHBondContact O-N 2.86Å; D374-R376 PolarHBondContact OD1-N 3.41Å; D374-K377 PolarHBondContact N-O 3.42Å; D374-K377 PolarHBondContact OD1-N 3.32Å
375	L	96.1	Very high	97.4	Very high	5 Å²	5	11 Å²	11	3%	0.026	5%	0.048	C	C	.	.	S	Bend	trans	71.3	-12.9	-169.8	-54.4	178.3	0	0	0	116.4	L154 L158 T171 T172 F175 S373 W378 L410	L154-L375 HydrophobicContact CD1-CB 4.2Å; L154-L375 HydrophobicContact CD1-CD1 4.35Å; L154-L375 HydrophobicContact CD1-CD2 4.23Å; L154-L375 HydrophobicContact CD1-CG 4.5Å; L158-L375 HydrophobicContact CD2-CB 4.44Å; L158-L375 HydrophobicContact CD2-CD1 4.07Å; T171-L375 HydrophobicContact CG2-CD1 3.76Å; T172-L375 HydrophobicContact CG2-CD2 4.01Å; T172-L375 HydrophobicContact CG2-CG 4.21Å; F175-L375 HydrophobicContact CB-CD1 4.44Å; F175-L375 HydrophobicContact CB-CD2 3.7Å; F175-L375 HydrophobicContact CD1-CD2 3.39Å; F175-L375 HydrophobicContact CE1-CD2 4.23Å; F175-L375 HydrophobicContact CG-CD2 3.66Å; S373-L375 WeakPolarHBondContact OG-CA 3.4Å; S373-L375 PolarHBondContact OG-N 3.25Å; L375-W378 PolarHBondContact O-NE1 3.44Å; L375-L410 WeakPolarHBondContact O-CD2 3.3Å
376	R	94.9	Very high	97.4	Very high	112 Å²	112	10.3 Å²	10.3	42%	0.423	4%	0.044	S	C	.	.	S	Bend	trans	-110.7	-44.7	179.3	-166.4	175.4	-176.2	-170.1	0.7	112.8	D374 L410 F411 D412	D374-R376 PolarHBondContact O-N 2.86Å; D374-R376 PolarHBondContact OD1-N 3.41Å; R376-L410 PolarHBondContact O-N 3.45Å; R376-F411 HydrophobicContact CB-CZ 4.5Å; R376-F411 HydrophobicContact CG-CE2 4.43Å; R376-F411 HydrophobicContact CG-CZ 4.34Å; R376-D412 PolarHBondContact NH2-O 3.31Å
377	K	96.6	Very high	97.3	Very high	66 Å²	66	10.3 Å²	10.3	29%	0.287	4%	0.044	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.8	172.1	-62.1	-179.1	-165.5	176.3	0	108.5	F314 E331 S373 D374	F314-K377 HydrophobicContact CZ-CB 3.99Å; E331-K377 VanDerWaalsContact CD-NZ 3.34Å; E331-K377 IonicContact OE1-NZ 2.9Å; E331-K377 PolarHBondContact OE1-NZ 3.12Å; E331-K377 IonicContact OE2-NZ 3.77Å; E331-K377 PolarHBondContact OE2-NZ 3.03Å; S373-K377 WeakPolarHBondContact CA-O 3.34Å; S373-K377 PolarHBondContact OG-O 2.84Å; D374-K377 PolarHBondContact N-O 3.42Å; D374-K377 PolarHBondContact OD1-N 3.32Å
378	W	98.2	Very high	97.1	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	4%	0.042	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.1	-178.9	-71.5	70.6	0	0	0	110.2	F150 F175 F176 L179 I371 S373 L375 F380 V408 V427	F150-W378 HydrophobicContact CZ-CH2 4.43Å; F150-W378 HydrophobicContact CZ-CZ2 4.24Å; F175-W378 HydrophobicContact CD1-CH2 4.26Å; F175-W378 HydrophobicContact CD1-CZ2 4.36Å; F175-W378 AromaticContact CE1-CH2 3.76Å; F175-W378 HydrophobicContact CE1-CH2 3.76Å; F175-W378 AromaticContact CE1-CZ2 3.86Å; F175-W378 HydrophobicContact CE1-CZ2 3.86Å; F176-W378 HydrophobicContact CD1-CH2 4.43Å; F176-W378 AromaticContact CE1-CH2 3.72Å; F176-W378 HydrophobicContact CE1-CH2 3.72Å; F176-W378 AromaticContact CE1-CZ3 3.68Å; F176-W378 HydrophobicContact CE1-CZ3 3.68Å; F176-W378 HydrophobicContact CZ-CH2 4.44Å; F176-W378 HydrophobicContact CZ-CZ3 4.37Å; L179-W378 HydrophobicContact CD2-CH2 4.25Å; L179-W378 HydrophobicContact CD2-CZ3 4.35Å; I371-W378 HydrophobicContact CG2-CE3 3.51Å; I371-W378 HydrophobicContact CG2-CZ3 3.49Å; I371-W378 VanDerWaalsContact CG2-CZ3 3.49Å; S373-W378 PolarHBondContact OG-NE1 2.94Å; L375-W378 PolarHBondContact O-NE1 3.44Å; W378-F380 HydrophobicContact CB-CE2 3.87Å; W378-F380 HydrophobicContact CB-CZ 4.07Å; W378-F380 HydrophobicContact CE3-CE1 4.13Å; W378-F380 AromaticContact CE3-CZ 3.95Å; W378-F380 HydrophobicContact CE3-CZ 3.95Å; W378-V408 HydrophobicContact CB-CB 4.46Å; W378-V408 PolarHBondContact N-O 3.09Å; W378-V408 PolarHBondContact O-N 3.35Å; W378-V427 HydrophobicContact CB-CG1 4.28Å; W378-V427 HydrophobicContact CB-CG2 4.48Å; W378-V427 HydrophobicContact CD2-CG1 3.43Å; W378-V427 VanDerWaalsContact CD2-CG1 3.43Å; W378-V427 HydrophobicContact CE3-CG1 3.77Å; W378-V427 HydrophobicContact CG-CG1 3.63Å; W378-V427 HydrophobicContact CG-CG2 4.33Å; W378-V427 HydrophobicContact CZ2-CG1 4.35Å; W378-V427 HydrophobicContact CZ3-CG1 4.34Å
379	Y	98.5	Very high	96.9	Very high	3 Å²	3	11.5 Å²	11.5	1%	0.012	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136.4	172.9	-75.6	-100.6	0	0	0	109.3	F314 H332 I335 L372 F381 K405 P407	F314-Y379 AromaticContact CE1-CD2 3.87Å; F314-Y379 HydrophobicContact CE1-CD2 3.87Å; F314-Y379 HydrophobicContact CE1-CE2 4.44Å; F314-Y379 HydrophobicContact CZ-CD2 4.18Å; F314-Y379 HydrophobicContact CZ-CE2 4.36Å; H332-Y379 AromaticContact CE1-CE1 3.67Å; H332-Y379 AromaticContact ND1-CE1 3.45Å; H332-Y379 WeakPolarHBondContact ND1-CE1 3.31Å; H332-Y379 AromaticContact ND1-CZ 3.67Å; H332-Y379 PolarHBondContact ND1-OH 2.78Å; I335-Y379 HydrophobicContact CB-CE2 4.38Å; I335-Y379 HydrophobicContact CD1-CD2 4.34Å; I335-Y379 HydrophobicContact CD1-CE2 3.6Å; I335-Y379 HydrophobicContact CG2-CD1 3.93Å; I335-Y379 HydrophobicContact CG2-CD2 3.65Å; I335-Y379 HydrophobicContact CG2-CE1 4.09Å; I335-Y379 HydrophobicContact CG2-CE2 3.82Å; I335-Y379 HydrophobicContact CG2-CG 3.69Å; L372-Y379 PolarHBondContact N-O 3.46Å; L372-Y379 PolarHBondContact O-N 3.41Å; Y379-F381 HydrophobicContact CD1-CZ 4.3Å; Y379-F381 HydrophobicContact CG-CE2 4.44Å; Y379-K405 WeakPolarHBondContact CA-O 3.45Å; Y379-P407 HydrophobicContact CE2-CB 3.86Å
380	F	98.6	Very high	96.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.5	-174.4	-69	-67.8	0	0	0	108.4	L130 I371 W378 F404 K405 V408 V427 H430 F434	L130-F380 HydrophobicContact CD2-CB 4.26Å; I371-F380 HydrophobicContact CD1-CE1 4.4Å; I371-F380 HydrophobicContact CG1-CD1 4.13Å; I371-F380 HydrophobicContact CG1-CE1 4.35Å; I371-F380 HydrophobicContact CG2-CD1 4.07Å; I371-F380 HydrophobicContact CG2-CE1 3.86Å; W378-F380 HydrophobicContact CB-CE2 3.87Å; W378-F380 HydrophobicContact CB-CZ 4.07Å; W378-F380 HydrophobicContact CE3-CE1 4.13Å; W378-F380 AromaticContact CE3-CZ 3.95Å; W378-F380 HydrophobicContact CE3-CZ 3.95Å; F380-F404 CarbonylContact O-C 3.35Å; F380-F404 WeakPolarHBondContact O-CA 3.48Å; F380-K405 HydrophobicContact CB-CB 4.36Å; F380-K405 PolarHBondContact N-O 3.17Å; F380-K405 PolarHBondContact O-N 3.06Å; F380-V408 HydrophobicContact CD2-CG2 4.4Å; F380-V408 HydrophobicContact CE2-CB 4.5Å; F380-V408 HydrophobicContact CE2-CG2 4.35Å; F380-V427 HydrophobicContact CZ-CG1 4.08Å; F380-H430 HydrophobicContact CD1-CB 3.99Å; F380-H430 HydrophobicContact CD2-CB 3.99Å; F380-H430 HydrophobicContact CE1-CB 3.59Å; F380-H430 HydrophobicContact CE2-CB 3.61Å; F380-H430 HydrophobicContact CG-CB 4.15Å; F380-H430 HydrophobicContact CZ-CB 3.38Å; F380-F434 HydrophobicContact CB-CE1 3.5Å; F380-F434 HydrophobicContact CB-CZ 3.76Å; F380-F434 AromaticContact CD1-CD1 3.74Å; F380-F434 HydrophobicContact CD1-CD1 3.74Å; F380-F434 AromaticContact CD1-CE1 3.27Å; F380-F434 HydrophobicContact CD1-CE1 3.27Å; F380-F434 HydrophobicContact CD1-CZ 4.3Å; F380-F434 HydrophobicContact CE1-CD1 4.34Å; F380-F434 HydrophobicContact CE1-CE1 4.22Å; F380-F434 AromaticContact CG-CE1 3.68Å; F380-F434 HydrophobicContact CG-CE1 3.68Å; F380-F434 HydrophobicContact CG-CZ 4.43Å
381	F	98.6	Very high	96.2	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.4	-177.9	-62.7	-91.7	0	0	0	110.1	L336 Q369 A370 L372 Y379 W403 F404	L336-F381 HydrophobicContact CD2-CE1 3.72Å; L336-F381 HydrophobicContact CD2-CZ 4.01Å; Q369-F381 CarbonylContact C-O 3.58Å; Q369-F381 VanDerWaalsContact CA-O 3.29Å; Q369-F381 WeakPolarHBondContact CA-O 3.44Å; A370-F381 HydrophobicContact CB-CB 4.19Å; A370-F381 PolarHBondContact N-O 3.42Å; A370-F381 PolarHBondContact O-N 2.82Å; L372-F381 HydrophobicContact CB-CE2 4.05Å; L372-F381 HydrophobicContact CD1-CD2 4.06Å; L372-F381 HydrophobicContact CD1-CE2 4.11Å; L372-F381 HydrophobicContact CD2-CE2 3.97Å; L372-F381 HydrophobicContact CG-CE2 4.27Å; Y379-F381 HydrophobicContact CD1-CZ 4.3Å; Y379-F381 HydrophobicContact CG-CE2 4.44Å; F381-W403 WeakPolarHBondContact CA-O 3.04Å; F381-F404 HydrophobicContact CD1-CB 3.67Å; F381-F404 HydrophobicContact CE1-CB 3.7Å
382	A	98.3	Very high	95.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.3	164.5	0	0	0	0	0	107.2	P131 Y134 F260 W403 F434	P131-A382 HydrophobicContact CG-CB 3.94Å; Y134-A382 HydrophobicContact CE2-CB 4Å; F260-A382 HydrophobicContact CD2-CB 4.39Å; F260-A382 HydrophobicContact CE1-CB 4.41Å; F260-A382 HydrophobicContact CE2-CB 3.79Å; F260-A382 HydrophobicContact CZ-CB 3.81Å; A382-W403 HydrophobicContact CB-CB 4.25Å; A382-W403 PolarHBondContact N-O 2.88Å; A382-W403 PolarHBondContact O-N 3.34Å; A382-F434 HydrophobicContact CB-CE2 4.35Å
383	Y	98.3	Very high	94	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.9	-173.9	-163.8	-76.6	0	0	0	110.2	T124 I340 C343 F344 L347 C367 G368 L385 N400 I401 C402	T124-Y383 HydrophobicContact CG2-CE2 3.71Å; T124-Y383 PolarHBondContact OG1-OH 2.99Å; I340-Y383 HydrophobicContact CG2-CE2 4.43Å; C343-Y383 HydrophobicContact CB-CD1 4.41Å; C343-Y383 HydrophobicContact CB-CD2 3.58Å; C343-Y383 HydrophobicContact CB-CE2 4.42Å; C343-Y383 HydrophobicContact CB-CG 3.59Å; F344-Y383 HydrophobicContact CB-CE2 4.34Å; F344-Y383 HydrophobicContact CD2-CE1 4.47Å; F344-Y383 WeakPolarHBondContact CD2-OH 3.27Å; L347-Y383 HydrophobicContact CD1-CD1 3.47Å; L347-Y383 VanDerWaalsContact CD1-CD1 3.47Å; L347-Y383 HydrophobicContact CD1-CE1 4.24Å; L347-Y383 HydrophobicContact CD1-CG 4.21Å; C367-Y383 CarbonylContact C-O 3.57Å; C367-Y383 VanDerWaalsContact CA-O 3.26Å; C367-Y383 WeakPolarHBondContact CA-O 3.33Å; G368-Y383 PolarHBondContact N-O 3.35Å; G368-Y383 PolarHBondContact O-N 3.36Å; Y383-L385 HydrophobicContact CE1-CB 4.26Å; Y383-L385 HydrophobicContact CE1-CD1 4.24Å; Y383-N400 HydrophobicContact CE1-CB 4.03Å; Y383-N400 WeakPolarHBondContact OH-CB 3.3Å; Y383-I401 CarbonylContact C-O 3.44Å; Y383-I401 WeakPolarHBondContact CA-O 2.87Å; Y383-C402 HydrophobicContact CD2-CB 3.62Å; Y383-C402 HydrophobicContact CE2-CB 3.84Å
384	Q	97.5	Very high	92.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	111	173.4	-177.2	171.4	-44.3	0	0	109.6	F260 V261 P365 N386 N400 I401 W403	F260-Q384 HydrophobicContact CD2-CB 4.27Å; V261-Q384 PolarHBondContact O-NE2 3.45Å; V261-Q384 PolarHBondContact O-OE1 3.17Å; P365-Q384 HydrophobicContact CB-CG 3.75Å; Q384-N386 WeakPolarHBondContact CG-OD1 3.21Å; Q384-N386 PolarHBondContact NE2-OD1 3.5Å; Q384-N386 PolarHBondContact O-N 2.61Å; Q384-N400 WeakPolarHBondContact O-CA 3.49Å; Q384-I401 PolarHBondContact N-O 2.82Å; Q384-I401 PolarHBondContact O-N 2.8Å; Q384-W403 HydrophobicContact CB-CH2 4.32Å; Q384-W403 HydrophobicContact CB-CZ3 3.79Å
385	L	97.1	Very high	91.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	111.9	171.3	-170.4	73.6	0	0	0	108.1	F344 L347 I348 A351 I362 P365 L366 Y383 I388	F344-L385 HydrophobicContact CD2-CD1 3.83Å; F344-L385 HydrophobicContact CE2-CD1 3.92Å; L347-L385 HydrophobicContact CB-CB 4.13Å; L347-L385 HydrophobicContact CB-CD2 3.78Å; L347-L385 HydrophobicContact CB-CG 4.48Å; L347-L385 HydrophobicContact CD1-CB 4.01Å; I348-L385 HydrophobicContact CG1-CD1 4.42Å; I348-L385 HydrophobicContact CG1-CD2 4.39Å; A351-L385 HydrophobicContact CB-CD2 4.32Å; I362-L385 HydrophobicContact CD1-CG 4.14Å; I362-L385 WeakPolarHBondContact CD1-O 3.47Å; P365-L385 VanDerWaalsContact CA-O 3.27Å; P365-L385 WeakPolarHBondContact CA-O 3.47Å; L366-L385 HydrophobicContact CB-CB 4.3Å; L366-L385 HydrophobicContact CD1-CD2 4.45Å; L366-L385 PolarHBondContact N-O 2.99Å; L366-L385 WeakPolarHBondContact O-CB 3.28Å; L366-L385 PolarHBondContact O-N 3.25Å; Y383-L385 HydrophobicContact CE1-CB 4.26Å; Y383-L385 HydrophobicContact CE1-CD1 4.24Å; L385-I388 HydrophobicContact CD1-CG2 4.12Å; L385-I388 HydrophobicContact CD2-CG2 3.61Å; L385-I388 HydrophobicContact CG-CG2 4.07Å
386	N	95.7	Very high	89.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.174	C	C	.	.			trans	-102.7	-24.3	178.5	-69.6	-46	0	0	0	112.6	A266 I362 Q384 A398 P399 N400	A266-N386 VanDerWaalsContact CB-ND2 3.3Å; A266-N386 WeakPolarHBondContact CB-ND2 3.45Å; I362-N386 WeakPolarHBondContact CD1-O 3.5Å; I362-N386 WeakPolarHBondContact CG1-O 3.31Å; Q384-N386 WeakPolarHBondContact CG-OD1 3.21Å; Q384-N386 PolarHBondContact NE2-OD1 3.5Å; Q384-N386 PolarHBondContact O-N 2.61Å; N386-A398 HydrophobicContact CB-CB 4.2Å; N386-P399 PolarHBondContact ND2-O 2.77Å; N386-N400 PolarHBondContact N-OD1 2.97Å
387	T	93.9	Very high	88.3	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	17%	0.166	C	C	.	.			trans	-151	145.8	175.8	-175.1	0	0	0	0	112.8	D361 S389 L390 V397 A398 N400	D361-T387 WeakPolarHBondContact OD1-CA 3.26Å; D361-T387 PolarHBondContact OD1-OG1 3.31Å; D361-T387 WeakPolarHBondContact OD2-CB 3.32Å; D361-T387 PolarHBondContact OD2-OG1 3.47Å; T387-S389 PolarHBondContact OG1-N 2.93Å; T387-S389 VanDerWaalsContact OG1-N 3.09Å; T387-L390 HydrophobicContact CG2-CD2 4.13Å; T387-V397 VanDerWaalsContact CB-CG1 3.46Å; T387-V397 HydrophobicContact CG2-CB 4.3Å; T387-V397 HydrophobicContact CG2-CG1 3.87Å; T387-V397 WeakPolarHBondContact OG1-CG1 3.41Å; T387-A398 WeakPolarHBondContact CG2-O 3.37Å; T387-N400 PolarHBondContact N-OD1 3.17Å; T387-N400 PolarHBondContact O-ND2 3.21Å; T387-N400 VanDerWaalsContact O-ND2 3.1Å; T387-N400 PolarHBondContact O-OD1 3.34Å
388	I	94.4	Very high	87.8	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	16%	0.158	C	C	.	.			trans	-115	-3.5	165.4	62.9	172.6	0	0	0	112.3	I348 A351 F356 T357 D361 I362 L385 L390	I348-I388 HydrophobicContact CD1-CG2 4.21Å; I348-I388 HydrophobicContact CG1-CG2 3.93Å; A351-I388 HydrophobicContact CB-CD1 4.29Å; A351-I388 HydrophobicContact CB-CG2 4.41Å; F356-I388 HydrophobicContact CB-CD1 3.66Å; T357-I388 VanDerWaalsContact C-CD1 3.4Å; T357-I388 WeakPolarHBondContact O-CD1 3.41Å; D361-I388 WeakPolarHBondContact OD1-CG1 3.38Å; D361-I388 PolarHBondContact OD1-N 2.85Å; I362-I388 HydrophobicContact CG2-CD1 4.29Å; I362-I388 HydrophobicContact CG2-CG1 4.35Å; I362-I388 HydrophobicContact CG2-CG2 4.49Å; L385-I388 HydrophobicContact CD1-CG2 4.12Å; L385-I388 HydrophobicContact CD2-CG2 3.61Å; L385-I388 HydrophobicContact CG-CG2 4.07Å; I388-L390 PolarHBondContact O-N 2.69Å
389	S	92.3	Very high	87.5	Confident	29 Å²	29	25.3 Å²	25.3	20%	0.203	16%	0.161	C	C	.	.			trans	-78.5	67.6	177	177.9	0	0	0	0	111.2	D361 T387	D361-S389 PolarHBondContact OD1-N 3.11Å; T387-S389 PolarHBondContact OG1-N 2.93Å; T387-S389 VanDerWaalsContact OG1-N 3.09Å
390	L	92.6	Very high	87.4	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	16%	0.16	C	C	.	.			trans	-88.3	-3.2	-173.4	-57.9	-175.3	0	0	0	114.2	N123 V210 R211 G212 F344 T387 I388	N123-L390 HydrophobicContact CB-CD2 3.61Å; V210-L390 CarbonylContact O-C 3.58Å; V210-L390 WeakPolarHBondContact O-CB 3.47Å; R211-L390 WeakPolarHBondContact CD-O 3.12Å; R211-L390 PolarHBondContact NH1-O 2.8Å; G212-L390 PolarHBondContact N-O 2.71Å; F344-L390 HydrophobicContact CE2-CD1 4.05Å; F344-L390 HydrophobicContact CZ-CD1 3.6Å; T387-L390 HydrophobicContact CG2-CD2 4.13Å; I388-L390 PolarHBondContact O-N 2.69Å
391	I	89.2	Confident	87.3	Confident	6 Å²	6	25.2 Å²	25.2	3%	0.031	16%	0.16	C	C	.	.	S	Bend	trans	-71.9	-33.2	-176.7	-66.2	165.4	0	0	0	112.4	R54 V210 G212 E238 Q358 Y359	R54-I391 PolarHBondContact NH2-O 2.85Å; V210-I391 HydrophobicContact CB-CD1 4.47Å; V210-I391 HydrophobicContact CB-CG1 3.87Å; V210-I391 HydrophobicContact CG1-CG1 3.92Å; G212-I391 WeakPolarHBondContact CA-O 2.79Å; E238-I391 HydrophobicContact CG-CG2 4.03Å; E238-I391 VanDerWaalsContact OE1-CG2 3.32Å; E238-I391 WeakPolarHBondContact OE1-CG2 3.49Å; Q358-I391 HydrophobicContact CB-CD1 3.84Å; Q358-I391 HydrophobicContact CB-CG1 4.33Å; Q358-I391 HydrophobicContact CG-CD1 3.31Å; Q358-I391 HydrophobicContact CG-CG1 4.15Å; Y359-I391 HydrophobicContact CD1-CD1 4.07Å; Y359-I391 HydrophobicContact CE1-CD1 3.6Å; Y359-I391 HydrophobicContact CE2-CD1 4.46Å
392	D	82	Confident	87.3	Confident	31 Å²	31	25.2 Å²	25.2	17%	0.166	16%	0.16	C	C	.	.			trans	-100.9	92.9	177.2	-163.4	-9.9	0	0	0	110.3	R54 A394 Q395	R54-D392 IonicContact NH1-OD2 2.89Å; D392-A394 PolarHBondContact O-N 3.22Å; D392-A394 PolarHBondContact OD1-N 3.12Å; D392-A394 VanDerWaalsContact OD1-N 3.12Å; D392-Q395 HydrophobicContact CB-CB 4.41Å; D392-Q395 HydrophobicContact CB-CG 4.41Å; D392-Q395 PolarHBondContact O-N 2.97Å; D392-Q395 WeakPolarHBondContact OD2-CG 3.36Å; D392-Q395 PolarHBondContact OD2-NE2 2.88Å
393	S	68.2	Low	87.3	Confident	51 Å²	51	26 Å²	26	36%	0.357	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.7	178.1	55.1	0	0	0	0	113.4	G213	G213-S393 WeakPolarHBondContact CA-OG 3.23Å
394	A	65	Low	87.3	Confident	85 Å²	85	26.8 Å²	26.8	70%	0.702	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-15.1	-178.6	0	0	0	0	0	113.3	D392	D392-A394 PolarHBondContact O-N 3.22Å; D392-A394 PolarHBondContact OD1-N 3.12Å; D392-A394 VanDerWaalsContact OD1-N 3.12Å
395	Q	66.2	Low	87.3	Confident	117 Å²	117	30.3 Å²	30.3	55%	0.547	18%	0.182	S	C	.	.	S	Bend	trans	-79.3	129.7	176.9	-82.4	-168.7	29.3	0	0	111.3	D392 V397	D392-Q395 HydrophobicContact CB-CB 4.41Å; D392-Q395 HydrophobicContact CB-CG 4.41Å; D392-Q395 PolarHBondContact O-N 2.97Å; D392-Q395 WeakPolarHBondContact OD2-CG 3.36Å; D392-Q395 PolarHBondContact OD2-NE2 2.88Å; Q395-V397 VanDerWaalsContact C-N 3.3Å; Q395-V397 HydrophobicContact CB-CG2 4.13Å; Q395-V397 PolarHBondContact O-N 3.35Å
396	P	58	Low	87.2	Confident	137 Å²	137	31 Å²	31	89%	0.89	19%	0.19	S	C	*	.			trans	-73.2	89	175.4	29.7	-31.7	0	0	0	108.8
397	V	74.4	Confident	87.3	Confident	43 Å²	43	34.6 Å²	34.6	26%	0.261	21%	0.213	S	C	.	.			trans	-104.5	141	170.5	-163.7	0	0	0	0	108.2	T387 Q395	T387-V397 VanDerWaalsContact CB-CG1 3.46Å; T387-V397 HydrophobicContact CG2-CB 4.3Å; T387-V397 HydrophobicContact CG2-CG1 3.87Å; T387-V397 WeakPolarHBondContact OG1-CG1 3.41Å; Q395-V397 VanDerWaalsContact C-N 3.3Å; Q395-V397 HydrophobicContact CB-CG2 4.13Å; Q395-V397 PolarHBondContact O-N 3.35Å
398	A	86.5	Confident	87.4	Confident	15 Å²	15	35.4 Å²	35.4	12%	0.124	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-52	125.7	176.6	0	0	0	0	0	109.6	A266 A267 N386 T387	A266-A398 HydrophobicContact CB-CB 4.16Å; A267-A398 HydrophobicContact CB-CB 4.07Å; N386-A398 HydrophobicContact CB-CB 4.2Å; T387-A398 WeakPolarHBondContact CG2-O 3.37Å
399	P	92.5	Very high	87.6	Confident	8 Å²	8	39.8 Å²	39.8	5%	0.052	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.5	153.4	179.7	27.8	-34.6	0	0	0	110.1	H125 A266 N269 N386	H125-P399 HydrophobicContact CB-CB 4.46Å; A266-P399 WeakPolarHBondContact O-CD 3.47Å; N269-P399 HydrophobicContact CB-CG 4.09Å; N386-P399 PolarHBondContact ND2-O 2.77Å
400	N	96	Very high	87.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	151.5	165.9	-61.8	-37.8	0	0	0	108.7	T122 N123 T124 H125 Y383 Q384 N386 T387	T122-N400 PolarHBondContact O-ND2 2.85Å; N123-N400 PolarHBondContact O-N 2.8Å; T124-N400 CarbonylContact C-O 3.56Å; T124-N400 WeakPolarHBondContact CA-O 3.01Å; H125-N400 PolarHBondContact N-O 3.06Å; Y383-N400 HydrophobicContact CE1-CB 4.03Å; Y383-N400 WeakPolarHBondContact OH-CB 3.3Å; Q384-N400 WeakPolarHBondContact O-CA 3.49Å; N386-N400 PolarHBondContact N-OD1 2.97Å; T387-N400 PolarHBondContact N-OD1 3.17Å; T387-N400 PolarHBondContact O-ND2 3.21Å; T387-N400 VanDerWaalsContact O-ND2 3.1Å; T387-N400 PolarHBondContact O-OD1 3.34Å
401	I	97.2	Very high	88	Confident	1 Å²	1	39 Å²	39	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.6	-177.4	-53	173.8	0	0	0	109.8	H125 I127 V261 A266 Y383 Q384 W403	H125-I401 CarbonylContact O-C 3.53Å; H125-I401 WeakPolarHBondContact O-CA 3.38Å; I127-I401 HydrophobicContact CD1-CG2 3.68Å; I127-I401 HydrophobicContact CG1-CG2 4.21Å; V261-I401 HydrophobicContact CG2-CD1 3.84Å; A266-I401 HydrophobicContact CB-CD1 3.52Å; A266-I401 HydrophobicContact CB-CG1 4.38Å; Y383-I401 CarbonylContact C-O 3.44Å; Y383-I401 WeakPolarHBondContact CA-O 2.87Å; Q384-I401 PolarHBondContact N-O 2.82Å; Q384-I401 PolarHBondContact O-N 2.8Å; I401-W403 HydrophobicContact CB-CE3 4.29Å; I401-W403 HydrophobicContact CB-CH2 3.63Å; I401-W403 HydrophobicContact CB-CZ2 4.23Å; I401-W403 HydrophobicContact CB-CZ3 3.67Å; I401-W403 HydrophobicContact CD1-CH2 3.92Å; I401-W403 HydrophobicContact CD1-CZ2 4.25Å; I401-W403 HydrophobicContact CG1-CH2 4.38Å; I401-W403 HydrophobicContact CG2-CD2 3.84Å; I401-W403 HydrophobicContact CG2-CE3 3.75Å; I401-W403 HydrophobicContact CG2-CH2 3.4Å; I401-W403 HydrophobicContact CG2-CZ2 3.5Å; I401-W403 VanDerWaalsContact CG2-CZ2 3.5Å; I401-W403 HydrophobicContact CG2-CZ3 3.53Å
402	C	97.9	Very high	88.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	110.3	173.7	-175.2	0	0	0	0	108.9	T124 H125 V126 I127 I340 Y383	T124-C402 HydrophobicContact CG2-CB 3.47Å; T124-C402 VanDerWaalsContact CG2-CB 3.47Å; H125-C402 PolarHBondContact O-N 2.84Å; V126-C402 CarbonylContact C-O 3.32Å; V126-C402 VanDerWaalsContact CA-O 3.29Å; V126-C402 WeakPolarHBondContact CA-O 3.45Å; V126-C402 HydrophobicContact CG2-CB 4.4Å; I127-C402 PolarHBondContact N-O 2.95Å; I340-C402 HydrophobicContact CG1-CB 4.26Å; Y383-C402 HydrophobicContact CD2-CB 3.62Å; Y383-C402 HydrophobicContact CE2-CB 3.84Å
403	W	98.3	Very high	88.8	Confident	18 Å²	18	42.9 Å²	42.9	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	141.8	166.3	-68.2	-91.3	0	0	0	109.1	I127 G129 P131 F260 V261 F381 A382 Q384 I401	I127-W403 HydrophobicContact CB-CG 4.38Å; I127-W403 HydrophobicContact CD1-CZ2 4.33Å; I127-W403 WeakPolarHBondContact O-CA 3.45Å; G129-W403 WeakPolarHBondContact O-CB 3.28Å; P131-W403 HydrophobicContact CG-CB 4.19Å; P131-W403 HydrophobicContact CG-CD2 3.71Å; P131-W403 HydrophobicContact CG-CE3 4Å; P131-W403 HydrophobicContact CG-CG 3.78Å; F260-W403 HydrophobicContact CB-CH2 3.96Å; F260-W403 HydrophobicContact CB-CZ3 4.01Å; F260-W403 HydrophobicContact CD2-CE3 4.17Å; F260-W403 AromaticContact CD2-CZ3 3.81Å; F260-W403 HydrophobicContact CD2-CZ3 3.81Å; F260-W403 HydrophobicContact CG-CZ3 4.3Å; V261-W403 HydrophobicContact CG1-CH2 4.07Å; V261-W403 HydrophobicContact CG1-CZ2 3.76Å; V261-W403 HydrophobicContact CG2-CH2 3.78Å; V261-W403 HydrophobicContact CG2-CZ2 4.16Å; F381-W403 WeakPolarHBondContact CA-O 3.04Å; A382-W403 HydrophobicContact CB-CB 4.25Å; A382-W403 PolarHBondContact N-O 2.88Å; A382-W403 PolarHBondContact O-N 3.34Å; Q384-W403 HydrophobicContact CB-CH2 4.32Å; Q384-W403 HydrophobicContact CB-CZ3 3.79Å; I401-W403 HydrophobicContact CB-CE3 4.29Å; I401-W403 HydrophobicContact CB-CH2 3.63Å; I401-W403 HydrophobicContact CB-CZ2 4.23Å; I401-W403 HydrophobicContact CB-CZ3 3.67Å; I401-W403 HydrophobicContact CD1-CH2 3.92Å; I401-W403 HydrophobicContact CD1-CZ2 4.25Å; I401-W403 HydrophobicContact CG1-CH2 4.38Å; I401-W403 HydrophobicContact CG2-CD2 3.84Å; I401-W403 HydrophobicContact CG2-CE3 3.75Å; I401-W403 HydrophobicContact CG2-CH2 3.4Å; I401-W403 HydrophobicContact CG2-CZ2 3.5Å; I401-W403 VanDerWaalsContact CG2-CZ2 3.5Å; I401-W403 HydrophobicContact CG2-CZ3 3.53Å
404	F	98.1	Very high	89.9	Confident	16 Å²	16	42.8 Å²	42.8	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	154.1	174.3	77.3	-84.1	0	0	0	112.2	V126 I127 D128 G129 H332 L336 F380 F381	V126-F404 HydrophobicContact CG1-CD1 3.58Å; V126-F404 HydrophobicContact CG1-CE1 3.62Å; I127-F404 VanDerWaalsContact O-CD1 3.27Å; I127-F404 WeakPolarHBondContact O-CD1 3.47Å; I127-F404 PolarHBondContact O-N 3.47Å; D128-F404 HydrophobicContact CB-CE1 4Å; D128-F404 HydrophobicContact CB-CZ 3.92Å; G129-F404 CarbonylContact C-O 3.52Å; G129-F404 VanDerWaalsContact CA-O 3.3Å; G129-F404 WeakPolarHBondContact CA-O 3.39Å; G129-F404 PolarHBondContact N-O 2.92Å; H332-F404 AromaticContact CE1-CE2 3.75Å; H332-F404 AromaticContact NE2-CE2 3.75Å; L336-F404 HydrophobicContact CD1-CE1 4.27Å; L336-F404 HydrophobicContact CD1-CE2 4.39Å; L336-F404 HydrophobicContact CD1-CZ 4.1Å; L336-F404 HydrophobicContact CD2-CB 4.05Å; L336-F404 HydrophobicContact CD2-CD1 3.91Å; L336-F404 HydrophobicContact CD2-CD2 3.47Å; L336-F404 VanDerWaalsContact CD2-CD2 3.47Å; L336-F404 HydrophobicContact CD2-CE1 4.21Å; L336-F404 HydrophobicContact CD2-CE2 3.81Å; L336-F404 HydrophobicContact CD2-CG 3.51Å; L336-F404 HydrophobicContact CD2-CZ 4.16Å; F380-F404 CarbonylContact O-C 3.35Å; F380-F404 WeakPolarHBondContact O-CA 3.48Å; F381-F404 HydrophobicContact CD1-CB 3.67Å; F381-F404 HydrophobicContact CE1-CB 3.7Å
405	K	97.8	Very high	91.1	Very high	73 Å²	73	40.4 Å²	40.4	32%	0.317	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	119.9	165.7	177.9	171	-173.5	173.8	0	109.3	L130 Y379 F380 V408 H430	L130-K405 HydrophobicContact CD1-CB 4.31Å; L130-K405 HydrophobicContact CD1-CD 4.33Å; L130-K405 HydrophobicContact CD2-CB 4.06Å; L130-K405 HydrophobicContact CG-CB 3.78Å; L130-K405 HydrophobicContact CG-CD 4.38Å; Y379-K405 WeakPolarHBondContact CA-O 3.45Å; F380-K405 HydrophobicContact CB-CB 4.36Å; F380-K405 PolarHBondContact N-O 3.17Å; F380-K405 PolarHBondContact O-N 3.06Å; K405-V408 HydrophobicContact CG-CG2 4.12Å; K405-H430 WeakPolarHBondContact CD-NE2 3.43Å; K405-H430 VanDerWaalsContact CE-NE2 3.33Å; K405-H430 WeakPolarHBondContact CE-NE2 3.4Å; K405-H430 PolarHBondContact NZ-CE1 2.75Å; K405-H430 PolarHBondContact NZ-NE2 2.97Å
406	G	95.5	Very high	91.8	Very high	16 Å²	16	40.8 Å²	40.8	17%	0.165	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	165.9	178	0	0	0	0	0	111.6	H332	H332-G406 PolarHBondContact CE1-O 2.82Å
407	P	96.6	Very high	92.9	Very high	76 Å²	76	42 Å²	42	49%	0.494	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-74	131.9	-1.9	28.5	-32.5	0	0	0	112.2	Y379	Y379-P407 HydrophobicContact CE2-CB 3.86Å
408	V	97.4	Very high	93.4	Very high	18 Å²	18	41 Å²	41	11%	0.109	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118	167.8	-173.7	0	0	0	0	108.4	W378 F380 K405 V427	W378-V408 HydrophobicContact CB-CB 4.46Å; W378-V408 PolarHBondContact N-O 3.09Å; W378-V408 PolarHBondContact O-N 3.35Å; F380-V408 HydrophobicContact CD2-CG2 4.4Å; F380-V408 HydrophobicContact CE2-CB 4.5Å; F380-V408 HydrophobicContact CE2-CG2 4.35Å; K405-V408 HydrophobicContact CG-CG2 4.12Å; V408-V427 HydrophobicContact CB-CG2 4.44Å; V408-V427 HydrophobicContact CG1-CG2 3.71Å
409	K	97.3	Very high	93.6	Very high	94 Å²	94	46.6 Å²	46.6	41%	0.409	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129	176.3	-165.3	179.3	-170.8	-175.3	0	110	F411 D412 N424	K409-F411 VanDerWaalsContact CE-O 3.24Å; K409-F411 WeakPolarHBondContact CE-O 3.47Å; K409-D412 WeakPolarHBondContact CD-OD1 3.31Å; K409-D412 WeakPolarHBondContact CE-OD1 3.35Å; K409-D412 IonicContact NZ-OD1 2.93Å; K409-D412 PolarHBondContact NZ-OD1 2.63Å; K409-N424 WeakPolarHBondContact O-CB 3.42Å; K409-N424 PolarHBondContact O-ND2 3.39Å
410	L	97.7	Very high	93.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.26	C	S	.	.			trans	-83	-44.8	179.6	179.3	63.7	0	0	0	112.6	F150 L154 L375 R376 F423 N424 V427	F150-L410 HydrophobicContact CE1-CD1 4.29Å; F150-L410 HydrophobicContact CE1-CD2 4.08Å; F150-L410 HydrophobicContact CZ-CD2 4.36Å; L154-L410 HydrophobicContact CD2-CD2 3.52Å; L375-L410 WeakPolarHBondContact O-CD2 3.3Å; R376-L410 PolarHBondContact O-N 3.45Å; L410-F423 HydrophobicContact CD1-CD2 4.46Å; L410-F423 HydrophobicContact CD1-CE1 4.26Å; L410-F423 HydrophobicContact CD1-CE2 3.83Å; L410-F423 HydrophobicContact CD1-CZ 3.72Å; L410-F423 HydrophobicContact CD2-CE2 4.34Å; L410-F423 HydrophobicContact CG-CE2 4.04Å; L410-F423 HydrophobicContact CG-CZ 4.42Å; L410-F423 CarbonylContact O-C 3.58Å; L410-F423 WeakPolarHBondContact O-CA 3.45Å; L410-N424 WeakPolarHBondContact O-CB 3.48Å; L410-N424 PolarHBondContact O-N 2.73Å; L410-V427 HydrophobicContact CB-CG2 4.17Å; L410-V427 HydrophobicContact CD1-CB 3.58Å; L410-V427 HydrophobicContact CD1-CG1 3.87Å; L410-V427 HydrophobicContact CD1-CG2 3.72Å
411	F	96.9	Very high	93.5	Very high	14 Å²	14	53 Å²	53	6%	0.061	29%	0.285	C	S	.	.			trans	-152.8	159.6	179.4	62.1	-94.6	0	0	0	110.9	L154 L158 R376 K409 F414 F420 F423	L154-F411 HydrophobicContact CD2-CD1 4.47Å; L154-F411 HydrophobicContact CD2-CE1 4.33Å; L158-F411 HydrophobicContact CD1-CE1 4.03Å; L158-F411 HydrophobicContact CD1-CZ 3.79Å; R376-F411 HydrophobicContact CB-CZ 4.5Å; R376-F411 HydrophobicContact CG-CE2 4.43Å; R376-F411 HydrophobicContact CG-CZ 4.34Å; K409-F411 VanDerWaalsContact CE-O 3.24Å; K409-F411 WeakPolarHBondContact CE-O 3.47Å; F411-F414 HydrophobicContact CD2-CB 4.33Å; F411-F414 HydrophobicContact CE2-CB 3.8Å; F411-F414 HydrophobicContact CZ-CB 4.34Å; F411-F420 HydrophobicContact CB-CB 4.48Å; F411-F420 HydrophobicContact CB-CD1 4.15Å; F411-F420 AromaticContact CD1-CD1 3.89Å; F411-F420 HydrophobicContact CD1-CD1 3.89Å; F411-F420 HydrophobicContact CD1-CE1 4.08Å; F411-F420 HydrophobicContact CD2-CD1 4.27Å; F411-F420 HydrophobicContact CE1-CD1 4.38Å; F411-F420 HydrophobicContact CE1-CE1 4.18Å; F411-F420 AromaticContact CG-CD1 3.85Å; F411-F420 HydrophobicContact CG-CD1 3.85Å; F411-F420 HydrophobicContact CG-CE1 4.45Å; F411-F423 HydrophobicContact CB-CD2 4.48Å
412	D	94	Very high	93.3	Very high	50 Å²	50	58.7 Å²	58.7	27%	0.267	32%	0.316	S	S	.	.	S	Bend	trans	-85.2	-53.9	178	-76.7	-20.3	0	0	0	111.9	R376 K409 E421 N422	R376-D412 PolarHBondContact NH2-O 3.31Å; K409-D412 WeakPolarHBondContact CD-OD1 3.31Å; K409-D412 WeakPolarHBondContact CE-OD1 3.35Å; K409-D412 IonicContact NZ-OD1 2.93Å; K409-D412 PolarHBondContact NZ-OD1 2.63Å; D412-E421 PolarHBondContact N-O 3.03Å; D412-N422 HydrophobicContact CB-CB 4.34Å; D412-N422 WeakPolarHBondContact OD2-CB 3.41Å; D412-N422 PolarHBondContact OD2-ND2 3.03Å
413	V	92.8	Very high	93.3	Very high	68 Å²	68	60.5 Å²	60.5	41%	0.412	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.2	-177.8	-177.2	0	0	0	0	109.1	E421	V413-E421 HydrophobicContact CB-CB 4.19Å; V413-E421 HydrophobicContact CB-CG 4.26Å; V413-E421 PolarHBondContact O-N 2.81Å
414	F	92.6	Very high	93.2	Very high	49 Å²	49	62 Å²	62	22%	0.215	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.1	168.2	176.7	-116.6	0	0	0	108	L158 F411 F420	L158-F414 HydrophobicContact CB-CD1 3.8Å; L158-F414 HydrophobicContact CB-CE1 3.53Å; L158-F414 HydrophobicContact CB-CZ 4.05Å; L158-F414 HydrophobicContact CD1-CB 4.35Å; L158-F414 HydrophobicContact CD1-CD1 4.03Å; L158-F414 HydrophobicContact CD1-CD2 4.24Å; L158-F414 HydrophobicContact CD1-CE1 4.36Å; L158-F414 HydrophobicContact CD1-CG 3.95Å; F411-F414 HydrophobicContact CD2-CB 4.33Å; F411-F414 HydrophobicContact CE2-CB 3.8Å; F411-F414 HydrophobicContact CZ-CB 4.34Å; F414-F420 HydrophobicContact CB-CD1 4.44Å; F414-F420 HydrophobicContact CB-CE1 4.48Å; F414-F420 AromaticContact CD2-CD1 3.71Å; F414-F420 HydrophobicContact CD2-CD1 3.71Å; F414-F420 AromaticContact CD2-CE1 3.42Å; F414-F420 HydrophobicContact CD2-CE1 3.42Å; F414-F420 VanDerWaalsContact CD2-CE1 3.42Å; F414-F420 HydrophobicContact CD2-CE2 4.38Å; F414-F420 HydrophobicContact CD2-CG 4.29Å; F414-F420 AromaticContact CD2-CZ 3.79Å; F414-F420 HydrophobicContact CD2-CZ 3.79Å; F414-F420 HydrophobicContact CE2-CD1 4.48Å; F414-F420 AromaticContact CE2-CE1 3.91Å; F414-F420 HydrophobicContact CE2-CE1 3.91Å; F414-F420 HydrophobicContact CE2-CE2 4.25Å; F414-F420 AromaticContact CE2-CZ 3.78Å; F414-F420 HydrophobicContact CE2-CZ 3.78Å; F414-F420 HydrophobicContact CG-CD1 4.49Å; F414-F420 HydrophobicContact CG-CE1 4.21Å
415	S	89.1	Confident	93.1	Very high	35 Å²	35	63.7 Å²	63.7	25%	0.245	34%	0.342	C	S	.	.			trans	-81.3	159.4	-176.7	80.1	0	0	0	0	111.6	E417 G418 E419	S415-E417 PolarHBondContact O-N 2.94Å; S415-E417 VanDerWaalsContact O-N 3.17Å; S415-E417 PolarHBondContact OG-N 2.72Å; S415-G418 PolarHBondContact O-N 3.34Å; S415-G418 VanDerWaalsContact O-N 3.1Å; S415-E419 PolarHBondContact N-O 2.89Å; S415-E419 PolarHBondContact OG-N 2.95Å; S415-E419 VanDerWaalsContact OG-N 3.12Å
416	S	81.2	Confident	93.1	Very high	126 Å²	126	63.3 Å²	63.3	88%	0.881	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.6	172.4	50.7	0	0	0	0	113.6	G418	S416-G418 VanDerWaalsContact C-N 3.31Å
417	E	82	Confident	93.2	Very high	161 Å²	161	62.6 Å²	62.6	75%	0.752	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2	177.9	-64.5	171.3	-175.1	0	0	112.2	S415	S415-E417 PolarHBondContact O-N 2.94Å; S415-E417 VanDerWaalsContact O-N 3.17Å; S415-E417 PolarHBondContact OG-N 2.72Å
418	G	85.1	Confident	93.2	Very high	23 Å²	23	59 Å²	59	24%	0.237	31%	0.311	C	S	.	.	S	Bend	trans	87.6	15.2	178.7	0	0	0	0	0	114.4	S155 S415 S416	S155-G418 PolarHBondContact OG-O 3.23Å; S415-G418 PolarHBondContact O-N 3.34Å; S415-G418 VanDerWaalsContact O-N 3.1Å; S416-G418 VanDerWaalsContact C-N 3.31Å
419	E	89.5	Confident	93.3	Very high	132 Å²	132	60.8 Å²	60.8	62%	0.617	32%	0.317	S	S	*	.			trans	-97.3	148.7	179.8	-57.6	-164.7	155	0	0	112.1	S415	S415-E419 PolarHBondContact N-O 2.89Å; S415-E419 PolarHBondContact OG-N 2.95Å; S415-E419 VanDerWaalsContact OG-N 3.12Å
420	F	94.1	Very high	93.3	Very high	30 Å²	30	56.5 Å²	56.5	13%	0.132	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.2	178.6	-61.8	-84.8	0	0	0	111.3	M151 L154 S155 L158 F411 F414 F423	M151-F420 HydrophobicContact CB-CE2 4.34Å; M151-F420 HydrophobicContact CE-CD2 3.63Å; M151-F420 HydrophobicContact CE-CE2 4.21Å; L154-F420 HydrophobicContact CB-CZ 4.14Å; L154-F420 HydrophobicContact CD2-CE1 3.64Å; L154-F420 HydrophobicContact CD2-CZ 3.65Å; L154-F420 HydrophobicContact CG-CE1 4.02Å; L154-F420 HydrophobicContact CG-CZ 3.78Å; S155-F420 WeakPolarHBondContact OG-CE2 3.41Å; S155-F420 VanDerWaalsContact OG-CZ 3.28Å; S155-F420 WeakPolarHBondContact OG-CZ 3.49Å; L158-F420 HydrophobicContact CD1-CE1 3.86Å; L158-F420 HydrophobicContact CD1-CZ 4.39Å; F411-F420 HydrophobicContact CB-CB 4.48Å; F411-F420 HydrophobicContact CB-CD1 4.15Å; F411-F420 AromaticContact CD1-CD1 3.89Å; F411-F420 HydrophobicContact CD1-CD1 3.89Å; F411-F420 HydrophobicContact CD1-CE1 4.08Å; F411-F420 HydrophobicContact CD2-CD1 4.27Å; F411-F420 HydrophobicContact CE1-CD1 4.38Å; F411-F420 HydrophobicContact CE1-CE1 4.18Å; F411-F420 AromaticContact CG-CD1 3.85Å; F411-F420 HydrophobicContact CG-CD1 3.85Å; F411-F420 HydrophobicContact CG-CE1 4.45Å; F414-F420 HydrophobicContact CB-CD1 4.44Å; F414-F420 HydrophobicContact CB-CE1 4.48Å; F414-F420 AromaticContact CD2-CD1 3.71Å; F414-F420 HydrophobicContact CD2-CD1 3.71Å; F414-F420 AromaticContact CD2-CE1 3.42Å; F414-F420 HydrophobicContact CD2-CE1 3.42Å; F414-F420 VanDerWaalsContact CD2-CE1 3.42Å; F414-F420 HydrophobicContact CD2-CE2 4.38Å; F414-F420 HydrophobicContact CD2-CG 4.29Å; F414-F420 AromaticContact CD2-CZ 3.79Å; F414-F420 HydrophobicContact CD2-CZ 3.79Å; F414-F420 HydrophobicContact CE2-CD1 4.48Å; F414-F420 AromaticContact CE2-CE1 3.91Å; F414-F420 HydrophobicContact CE2-CE1 3.91Å; F414-F420 HydrophobicContact CE2-CE2 4.25Å; F414-F420 AromaticContact CE2-CZ 3.78Å; F414-F420 HydrophobicContact CE2-CZ 3.78Å; F414-F420 HydrophobicContact CG-CD1 4.49Å; F414-F420 HydrophobicContact CG-CE1 4.21Å; F420-F423 HydrophobicContact CB-CB 4.15Å; F420-F423 HydrophobicContact CB-CD2 3.93Å; F420-F423 HydrophobicContact CB-CG 4.5Å; F420-F423 HydrophobicContact CD1-CD2 4.22Å; F420-F423 HydrophobicContact CD2-CD2 4.24Å; F420-F423 AromaticContact CG-CD2 3.89Å; F420-F423 HydrophobicContact CG-CD2 3.89Å; F420-F423 HydrophobicContact CG-CE2 4.49Å
421	E	93.4	Very high	93.3	Very high	112 Å²	112	56.6 Å²	56.6	52%	0.523	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.5	169.6	-66.4	-174.7	-178.8	0	0	111.1	D412 V413 F423	D412-E421 PolarHBondContact N-O 3.03Å; V413-E421 HydrophobicContact CB-CB 4.19Å; V413-E421 HydrophobicContact CB-CG 4.26Å; V413-E421 PolarHBondContact O-N 2.81Å; E421-F423 PolarHBondContact O-N 2.62Å
422	N	93.2	Very high	93.3	Very high	122 Å²	122	55.9 Å²	55.9	65%	0.652	30%	0.296	S	S	*	.	S	Bend	trans	51.4	48.5	178	-63.1	-32.7	0	0	0	113.8	D412 N424	D412-N422 HydrophobicContact CB-CB 4.34Å; D412-N422 WeakPolarHBondContact OD2-CB 3.41Å; D412-N422 PolarHBondContact OD2-ND2 3.03Å; N422-N424 PolarHBondContact O-N 3.02Å
423	F	95.9	Very high	93.5	Very high	37 Å²	37	55.2 Å²	55.2	16%	0.162	29%	0.29	C	S	.	.			trans	-64.3	128.9	178.4	-169.1	-86.6	0	0	0	112	F150 M151 L154 L410 F411 F420 E421 D425 I428	F150-F423 AromaticContact CD1-CZ 3.89Å; F150-F423 HydrophobicContact CD1-CZ 3.89Å; F150-F423 HydrophobicContact CE1-CE2 4.42Å; F150-F423 AromaticContact CE1-CZ 3.87Å; F150-F423 HydrophobicContact CE1-CZ 3.87Å; M151-F423 HydrophobicContact CG-CE1 4.32Å; M151-F423 HydrophobicContact CG-CE2 4.08Å; M151-F423 HydrophobicContact CG-CZ 3.89Å; L154-F423 HydrophobicContact CD2-CE2 4.18Å; L410-F423 HydrophobicContact CD1-CD2 4.46Å; L410-F423 HydrophobicContact CD1-CE1 4.26Å; L410-F423 HydrophobicContact CD1-CE2 3.83Å; L410-F423 HydrophobicContact CD1-CZ 3.72Å; L410-F423 HydrophobicContact CD2-CE2 4.34Å; L410-F423 HydrophobicContact CG-CE2 4.04Å; L410-F423 HydrophobicContact CG-CZ 4.42Å; L410-F423 CarbonylContact O-C 3.58Å; L410-F423 WeakPolarHBondContact O-CA 3.45Å; F411-F423 HydrophobicContact CB-CD2 4.48Å; F420-F423 HydrophobicContact CB-CB 4.15Å; F420-F423 HydrophobicContact CB-CD2 3.93Å; F420-F423 HydrophobicContact CB-CG 4.5Å; F420-F423 HydrophobicContact CD1-CD2 4.22Å; F420-F423 HydrophobicContact CD2-CD2 4.24Å; F420-F423 AromaticContact CG-CD2 3.89Å; F420-F423 HydrophobicContact CG-CD2 3.89Å; F420-F423 HydrophobicContact CG-CE2 4.49Å; E421-F423 PolarHBondContact O-N 2.62Å; F423-D425 VanDerWaalsContact CD1-OD1 3.32Å; F423-D425 WeakPolarHBondContact CD1-OD1 3.41Å; F423-I428 HydrophobicContact CE1-CD1 3.74Å; F423-I428 HydrophobicContact CE1-CG1 4.37Å; F423-I428 HydrophobicContact CZ-CD1 3.99Å; F423-I428 HydrophobicContact CZ-CG1 4.49Å
424	N	97.1	Very high	93.7	Very high	51 Å²	51	52 Å²	52	27%	0.273	27%	0.27	S	S	.	.			trans	-102.6	103.2	-174.1	-176.9	4.5	0	0	0	112.2	K409 L410 N422 E426 V427	K409-N424 WeakPolarHBondContact O-CB 3.42Å; K409-N424 PolarHBondContact O-ND2 3.39Å; L410-N424 WeakPolarHBondContact O-CB 3.48Å; L410-N424 PolarHBondContact O-N 2.73Å; N422-N424 PolarHBondContact O-N 3.02Å; N424-E426 PolarHBondContact O-N 3.5Å; N424-E426 VanDerWaalsContact O-N 3.15Å; N424-E426 VanDerWaalsContact OD1-CB 3.31Å; N424-E426 WeakPolarHBondContact OD1-CB 2.88Å; N424-E426 PolarHBondContact OD1-N 3.23Å; N424-E426 VanDerWaalsContact OD1-N 3.11Å; N424-V427 PolarHBondContact O-N 3.37Å
425	D	96.9	Very high	94	Very high	50 Å²	50	49.6 Å²	49.6	27%	0.267	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.1	-179.1	-68.5	-9.4	0	0	0	114	K147 F423 V427 I428 K429	K147-D425 WeakPolarHBondContact CD-OD1 3.26Å; K147-D425 WeakPolarHBondContact CE-OD1 3.33Å; K147-D425 IonicContact NZ-OD1 2.86Å; K147-D425 PolarHBondContact NZ-OD1 3.42Å; K147-D425 IonicContact NZ-OD2 3.11Å; K147-D425 PolarHBondContact NZ-OD2 3.1Å; F423-D425 VanDerWaalsContact CD1-OD1 3.32Å; F423-D425 WeakPolarHBondContact CD1-OD1 3.41Å; D425-V427 PolarHBondContact O-N 3Å; D425-I428 PolarHBondContact O-N 3Å; D425-I428 VanDerWaalsContact O-N 3.16Å; D425-K429 PolarHBondContact O-N 2.85Å; D425-K429 VanDerWaalsContact O-N 3.11Å
426	E	96.5	Very high	94.3	Very high	66 Å²	66	48 Å²	48	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-29.5	178.1	-68.3	-58.5	129.8	0	0	112.6	N424 K429 H430	N424-E426 PolarHBondContact O-N 3.5Å; N424-E426 VanDerWaalsContact O-N 3.15Å; N424-E426 VanDerWaalsContact OD1-CB 3.31Å; N424-E426 WeakPolarHBondContact OD1-CB 2.88Å; N424-E426 PolarHBondContact OD1-N 3.23Å; N424-E426 VanDerWaalsContact OD1-N 3.11Å; E426-K429 PolarHBondContact O-N 3.08Å; E426-K429 WeakPolarHBondContact OE1-CD 3.45Å; E426-K429 WeakPolarHBondContact OE1-CE 2.92Å; E426-K429 IonicContact OE1-NZ 2.69Å; E426-K429 PolarHBondContact OE1-NZ 3.49Å; E426-H430 PolarHBondContact O-CD2 3.49Å; E426-H430 PolarHBondContact O-N 3.48Å
427	V	97.7	Very high	94.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-45.3	175.8	177	0	0	0	0	110.3	W378 F380 V408 L410 N424 D425 K429 H430 C431	W378-V427 HydrophobicContact CB-CG1 4.28Å; W378-V427 HydrophobicContact CB-CG2 4.48Å; W378-V427 HydrophobicContact CD2-CG1 3.43Å; W378-V427 VanDerWaalsContact CD2-CG1 3.43Å; W378-V427 HydrophobicContact CE3-CG1 3.77Å; W378-V427 HydrophobicContact CG-CG1 3.63Å; W378-V427 HydrophobicContact CG-CG2 4.33Å; W378-V427 HydrophobicContact CZ2-CG1 4.35Å; W378-V427 HydrophobicContact CZ3-CG1 4.34Å; F380-V427 HydrophobicContact CZ-CG1 4.08Å; V408-V427 HydrophobicContact CB-CG2 4.44Å; V408-V427 HydrophobicContact CG1-CG2 3.71Å; L410-V427 HydrophobicContact CB-CG2 4.17Å; L410-V427 HydrophobicContact CD1-CB 3.58Å; L410-V427 HydrophobicContact CD1-CG1 3.87Å; L410-V427 HydrophobicContact CD1-CG2 3.72Å; N424-V427 PolarHBondContact O-N 3.37Å; D425-V427 PolarHBondContact O-N 3Å; V427-K429 VanDerWaalsContact C-N 3.35Å; V427-K429 PolarHBondContact O-N 3.23Å; V427-H430 PolarHBondContact O-N 3.31Å; V427-C431 PolarHBondContact O-N 3.39Å; V427-C431 PolarHBondContact O-SG 3.24Å
428	I	98	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-43.6	178	-56.3	179.7	0	0	0	110	T143 F146 K147 F150 F423 D425 H430 C431 L432	T143-I428 HydrophobicContact CG2-CB 4.07Å; T143-I428 HydrophobicContact CG2-CG2 3.9Å; F146-I428 HydrophobicContact CD1-CG2 4.08Å; K147-I428 HydrophobicContact CB-CD1 3.94Å; K147-I428 HydrophobicContact CG-CD1 3.93Å; F150-I428 HydrophobicContact CB-CD1 4.05Å; F150-I428 HydrophobicContact CD1-CD1 3.83Å; F150-I428 HydrophobicContact CD1-CG1 3.96Å; F150-I428 HydrophobicContact CD2-CD1 4.48Å; F150-I428 HydrophobicContact CD2-CG1 4.08Å; F150-I428 HydrophobicContact CE1-CD1 4.41Å; F150-I428 HydrophobicContact CE1-CG1 4.11Å; F150-I428 HydrophobicContact CE2-CG1 4.22Å; F150-I428 HydrophobicContact CG-CD1 3.87Å; F150-I428 HydrophobicContact CG-CG1 3.94Å; F150-I428 HydrophobicContact CZ-CG1 4.24Å; F423-I428 HydrophobicContact CE1-CD1 3.74Å; F423-I428 HydrophobicContact CE1-CG1 4.37Å; F423-I428 HydrophobicContact CZ-CD1 3.99Å; F423-I428 HydrophobicContact CZ-CG1 4.49Å; D425-I428 PolarHBondContact O-N 3Å; D425-I428 VanDerWaalsContact O-N 3.16Å; I428-H430 VanDerWaalsContact C-N 3.3Å; I428-H430 PolarHBondContact O-N 2.76Å; I428-C431 PolarHBondContact O-N 2.74Å; I428-L432 HydrophobicContact CG2-CD1 4.09Å; I428-L432 HydrophobicContact CG2-CG 4.36Å; I428-L432 WeakPolarHBondContact O-CG 3.07Å; I428-L432 PolarHBondContact O-N 3.01Å
429	K	97.8	Very high	95.7	Very high	56 Å²	56	37.6 Å²	37.6	24%	0.243	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-44.1	175.9	-67.3	177.8	-171	172.6	0	111.6	V139 T143 D425 E426 V427 L432 R433	V139-K429 HydrophobicContact CG2-CB 3.91Å; V139-K429 HydrophobicContact CG2-CG 4.11Å; T143-K429 HydrophobicContact CG2-CG 3.93Å; T143-K429 WeakPolarHBondContact OG1-CG 3.48Å; D425-K429 PolarHBondContact O-N 2.85Å; D425-K429 VanDerWaalsContact O-N 3.11Å; E426-K429 PolarHBondContact O-N 3.08Å; E426-K429 WeakPolarHBondContact OE1-CD 3.45Å; E426-K429 WeakPolarHBondContact OE1-CE 2.92Å; E426-K429 IonicContact OE1-NZ 2.69Å; E426-K429 PolarHBondContact OE1-NZ 3.49Å; V427-K429 VanDerWaalsContact C-N 3.35Å; V427-K429 PolarHBondContact O-N 3.23Å; K429-L432 PolarHBondContact O-N 2.84Å; K429-R433 VanDerWaalsContact O-CB 3.31Å; K429-R433 WeakPolarHBondContact O-CB 3.08Å; K429-R433 WeakPolarHBondContact O-CG 3.09Å; K429-R433 PolarHBondContact O-N 3.16Å
430	H	97.8	Very high	95.8	Very high	5 Å²	5	33 Å²	33	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-45.2	177.4	-77.2	-54.9	0	0	0	112	F380 K405 E426 V427 I428 L432 R433 F434	F380-H430 HydrophobicContact CD1-CB 3.99Å; F380-H430 HydrophobicContact CD2-CB 3.99Å; F380-H430 HydrophobicContact CE1-CB 3.59Å; F380-H430 HydrophobicContact CE2-CB 3.61Å; F380-H430 HydrophobicContact CG-CB 4.15Å; F380-H430 HydrophobicContact CZ-CB 3.38Å; K405-H430 WeakPolarHBondContact CD-NE2 3.43Å; K405-H430 VanDerWaalsContact CE-NE2 3.33Å; K405-H430 WeakPolarHBondContact CE-NE2 3.4Å; K405-H430 PolarHBondContact NZ-CE1 2.75Å; K405-H430 PolarHBondContact NZ-NE2 2.97Å; E426-H430 PolarHBondContact O-CD2 3.49Å; E426-H430 PolarHBondContact O-N 3.48Å; V427-H430 PolarHBondContact O-N 3.31Å; I428-H430 VanDerWaalsContact C-N 3.3Å; I428-H430 PolarHBondContact O-N 2.76Å; H430-L432 PolarHBondContact O-N 3.27Å; H430-R433 PolarHBondContact O-N 3.43Å; H430-F434 WeakPolarHBondContact O-CD1 3.45Å; H430-F434 PolarHBondContact O-N 3.27Å; H430-F434 VanDerWaalsContact O-N 3.1Å
431	C	98	Very high	95.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-54.7	-52.2	173.2	-66.6	0	0	0	0	111.2	L179 I183 V427 I428 R433 F434 F435	L179-C431 HydrophobicContact CD2-CB 4.46Å; I183-C431 HydrophobicContact CD1-CB 4.47Å; V427-C431 PolarHBondContact O-N 3.39Å; V427-C431 PolarHBondContact O-SG 3.24Å; I428-C431 PolarHBondContact O-N 2.74Å; C431-R433 VanDerWaalsContact C-N 3.34Å; C431-R433 PolarHBondContact O-N 3.39Å; C431-F434 PolarHBondContact O-N 2.75Å; C431-F435 VanDerWaalsContact O-CD2 3.26Å; C431-F435 WeakPolarHBondContact O-CD2 3.24Å; C431-F435 PolarHBondContact O-N 3.4Å
432	L	97.7	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.2	-40.9	179.6	-68.1	175.3	0	0	0	112.6	V139 E142 F146 I183 F187 I428 K429 H430 F434 F435 F436	V139-L432 HydrophobicContact CB-CB 4.28Å; V139-L432 HydrophobicContact CG1-CB 4.4Å; V139-L432 HydrophobicContact CG2-CB 4.34Å; E142-L432 HydrophobicContact CB-CD1 4.05Å; F146-L432 HydrophobicContact CD1-CD2 4.19Å; F146-L432 HydrophobicContact CG-CD2 4.49Å; I183-L432 HydrophobicContact CD1-CD2 4.12Å; I183-L432 HydrophobicContact CG1-CD2 3.96Å; I183-L432 HydrophobicContact CG2-CD2 4.18Å; F187-L432 HydrophobicContact CD2-CD2 4.19Å; F187-L432 HydrophobicContact CE2-CD2 3.6Å; F187-L432 HydrophobicContact CZ-CD2 4.34Å; I428-L432 HydrophobicContact CG2-CD1 4.09Å; I428-L432 HydrophobicContact CG2-CG 4.36Å; I428-L432 WeakPolarHBondContact O-CG 3.07Å; I428-L432 PolarHBondContact O-N 3.01Å; K429-L432 PolarHBondContact O-N 2.84Å; H430-L432 PolarHBondContact O-N 3.27Å; L432-F434 VanDerWaalsContact C-N 3.32Å; L432-F434 PolarHBondContact O-N 3.12Å; L432-F435 PolarHBondContact O-N 3.23Å; L432-F436 HydrophobicContact CB-CE2 4.28Å; L432-F436 HydrophobicContact CD2-CZ 4.08Å; L432-F436 WeakPolarHBondContact O-CB 3.16Å; L432-F436 VanDerWaalsContact O-CG 3.24Å; L432-F436 WeakPolarHBondContact O-CG 3.15Å; L432-F436 PolarHBondContact O-N 3.36Å
433	R	97.4	Very high	94.7	Very high	35 Å²	35	34.7 Å²	34.7	13%	0.132	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-38.9	176.7	-82.1	171.1	173.8	160.3	-6.9	113.2	Y134 L137 V139 K429 H430 C431 A437	Y134-R433 HydrophobicContact CD1-CB 3.97Å; Y134-R433 PolarHBondContact O-NE 2.84Å; Y134-R433 VanDerWaalsContact O-NE 3.16Å; L137-R433 HydrophobicContact CB-CG 4.06Å; L137-R433 PolarHBondContact O-NE 2.98Å; L137-R433 VanDerWaalsContact O-NE 3.11Å; V139-R433 HydrophobicContact CG1-CG 4.06Å; V139-R433 HydrophobicContact CG2-CG 3.98Å; K429-R433 VanDerWaalsContact O-CB 3.31Å; K429-R433 WeakPolarHBondContact O-CB 3.08Å; K429-R433 WeakPolarHBondContact O-CG 3.09Å; K429-R433 PolarHBondContact O-N 3.16Å; H430-R433 PolarHBondContact O-N 3.43Å; C431-R433 VanDerWaalsContact C-N 3.34Å; C431-R433 PolarHBondContact O-N 3.39Å; R433-A437 PolarHBondContact O-N 2.8Å
434	F	97.7	Very high	94.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.1	-47.5	174.8	-79.6	114.6	0	0	0	111.5	L130 Y134 V309 Q369 I371 F380 A382 H430 C431 L432 F436 A437	L130-F434 HydrophobicContact CD1-CE1 4.33Å; L130-F434 HydrophobicContact CD1-CZ 4.15Å; L130-F434 HydrophobicContact CD2-CZ 3.94Å; Y134-F434 AromaticContact CE1-CD2 3.93Å; Y134-F434 HydrophobicContact CE1-CD2 3.93Å; Y134-F434 HydrophobicContact CE1-CE2 4.17Å; Y134-F434 HydrophobicContact CE2-CE2 4.26Å; Y134-F434 AromaticContact CZ-CD2 3.78Å; Y134-F434 AromaticContact CZ-CE2 3.67Å; Y134-F434 WeakPolarHBondContact OH-CD2 3.19Å; Y134-F434 WeakPolarHBondContact OH-CE2 3.27Å; V309-F434 HydrophobicContact CG2-CB 3.71Å; Q369-F434 HydrophobicContact CB-CD2 3.54Å; Q369-F434 HydrophobicContact CB-CE2 3.86Å; Q369-F434 HydrophobicContact CB-CG 4.43Å; Q369-F434 VanDerWaalsContact CD-CD2 3.43Å; Q369-F434 HydrophobicContact CG-CD2 3.6Å; Q369-F434 HydrophobicContact CG-CE2 3.94Å; Q369-F434 VanDerWaalsContact OE1-CD2 3.29Å; Q369-F434 PolarHBondContact OE1-O 2.83Å; I371-F434 HydrophobicContact CD1-CD1 4.26Å; I371-F434 HydrophobicContact CG1-CD1 4.25Å; F380-F434 HydrophobicContact CB-CE1 3.5Å; F380-F434 HydrophobicContact CB-CZ 3.76Å; F380-F434 AromaticContact CD1-CD1 3.74Å; F380-F434 HydrophobicContact CD1-CD1 3.74Å; F380-F434 AromaticContact CD1-CE1 3.27Å; F380-F434 HydrophobicContact CD1-CE1 3.27Å; F380-F434 HydrophobicContact CD1-CZ 4.3Å; F380-F434 HydrophobicContact CE1-CD1 4.34Å; F380-F434 HydrophobicContact CE1-CE1 4.22Å; F380-F434 AromaticContact CG-CE1 3.68Å; F380-F434 HydrophobicContact CG-CE1 3.68Å; F380-F434 HydrophobicContact CG-CZ 4.43Å; A382-F434 HydrophobicContact CB-CE2 4.35Å; H430-F434 WeakPolarHBondContact O-CD1 3.45Å; H430-F434 PolarHBondContact O-N 3.27Å; H430-F434 VanDerWaalsContact O-N 3.1Å; C431-F434 PolarHBondContact O-N 2.75Å; L432-F434 VanDerWaalsContact C-N 3.32Å; L432-F434 PolarHBondContact O-N 3.12Å; F434-F436 VanDerWaalsContact C-N 3.26Å; F434-F436 PolarHBondContact O-N 3.23Å; F434-A437 VanDerWaalsContact O-CB 3.3Å; F434-A437 WeakPolarHBondContact O-CB 2.96Å; F434-A437 PolarHBondContact O-N 2.92Å
435	F	97.2	Very high	93.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-26.7	178.5	-80.1	-106.5	0	0	0	113.6	I183 H193 L194 V251 V309 I371 C431 L432	I183-F435 HydrophobicContact CB-CD1 4.11Å; I183-F435 HydrophobicContact CB-CE1 4.34Å; I183-F435 HydrophobicContact CB-CG 4.42Å; I183-F435 HydrophobicContact CD1-CD1 4.26Å; I183-F435 HydrophobicContact CD1-CD2 3.66Å; I183-F435 HydrophobicContact CD1-CE1 4.34Å; I183-F435 HydrophobicContact CD1-CE2 3.76Å; I183-F435 HydrophobicContact CD1-CG 3.92Å; I183-F435 HydrophobicContact CD1-CZ 4.1Å; I183-F435 HydrophobicContact CG2-CB 3.74Å; I183-F435 HydrophobicContact CG2-CD1 3.63Å; I183-F435 HydrophobicContact CG2-CE1 4.35Å; I183-F435 HydrophobicContact CG2-CG 3.73Å; H193-F435 PolarHBondContact NE2-O 2.68Å; L194-F435 HydrophobicContact CD2-CD1 4.48Å; V251-F435 HydrophobicContact CG1-CE1 4.5Å; V251-F435 HydrophobicContact CG2-CE1 3.76Å; V251-F435 HydrophobicContact CG2-CZ 4.03Å; V309-F435 HydrophobicContact CB-CE2 4.4Å; V309-F435 HydrophobicContact CG1-CE2 4.19Å; V309-F435 HydrophobicContact CG2-CD2 4.23Å; V309-F435 HydrophobicContact CG2-CE2 4.34Å; I371-F435 HydrophobicContact CD1-CE2 4.41Å; C431-F435 VanDerWaalsContact O-CD2 3.26Å; C431-F435 WeakPolarHBondContact O-CD2 3.24Å; C431-F435 PolarHBondContact O-N 3.4Å; L432-F435 PolarHBondContact O-N 3.23Å
436	F	96.3	Very high	93.6	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.009	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	8.9	179.1	-62.8	-8.3	0	0	0	113.6	V139 E142 I183 F187 R191 L194 L432 F434	V139-F436 HydrophobicContact CG1-CD2 3.75Å; V139-F436 HydrophobicContact CG1-CE2 4.21Å; E142-F436 HydrophobicContact CB-CE2 3.93Å; E142-F436 HydrophobicContact CB-CZ 4.33Å; E142-F436 HydrophobicContact CG-CE2 3.77Å; E142-F436 HydrophobicContact CG-CZ 4.2Å; I183-F436 HydrophobicContact CG2-CE1 4.34Å; F187-F436 HydrophobicContact CB-CE1 3.82Å; F187-F436 HydrophobicContact CB-CZ 3.98Å; F187-F436 AromaticContact CD1-CZ 3.9Å; F187-F436 HydrophobicContact CD1-CZ 3.9Å; F187-F436 AromaticContact CD2-CE1 3.86Å; F187-F436 HydrophobicContact CD2-CE1 3.86Å; F187-F436 AromaticContact CD2-CZ 3.57Å; F187-F436 HydrophobicContact CD2-CZ 3.57Å; F187-F436 HydrophobicContact CE1-CZ 4.28Å; F187-F436 AromaticContact CE2-CZ 4Å; F187-F436 HydrophobicContact CE2-CZ 4Å; F187-F436 AromaticContact CG-CE1 3.84Å; F187-F436 HydrophobicContact CG-CE1 3.84Å; F187-F436 AromaticContact CG-CZ 3.52Å; F187-F436 HydrophobicContact CG-CZ 3.52Å; F187-F436 HydrophobicContact CZ-CZ 4.33Å; R191-F436 HydrophobicContact CG-CD1 3.96Å; R191-F436 HydrophobicContact CG-CE1 3.99Å; L194-F436 HydrophobicContact CD1-CD1 4.22Å; L194-F436 HydrophobicContact CD1-CE1 3.99Å; L432-F436 HydrophobicContact CB-CE2 4.28Å; L432-F436 HydrophobicContact CD2-CZ 4.08Å; L432-F436 WeakPolarHBondContact O-CB 3.16Å; L432-F436 VanDerWaalsContact O-CG 3.24Å; L432-F436 WeakPolarHBondContact O-CG 3.15Å; L432-F436 PolarHBondContact O-N 3.36Å; F434-F436 VanDerWaalsContact C-N 3.26Å; F434-F436 PolarHBondContact O-N 3.23Å
437	A	94.8	Very high	93.4	Very high	2 Å²	2	44.4 Å²	44.4	2%	0.017	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-60.4	148	178.4	0	0	0	0	0	112.3	F133 Y134 L257 R433 F434	F133-A437 HydrophobicContact CE1-CB 3.93Å; F133-A437 HydrophobicContact CZ-CB 4.4Å; Y134-A437 HydrophobicContact CE1-CB 4.45Å; L257-A437 HydrophobicContact CD2-CB 3.58Å; R433-A437 PolarHBondContact O-N 2.8Å; F434-A437 VanDerWaalsContact O-CB 3.3Å; F434-A437 WeakPolarHBondContact O-CB 2.96Å; F434-A437 PolarHBondContact O-N 2.92Å
438	D	90.4	Very high	93.1	Very high	75 Å²	75	48.4 Å²	48.4	40%	0.401	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-74.2	132.1	-173.7	-75.7	-20.7	0	0	0	111.6	F133 R258	F133-D438 HydrophobicContact CE2-CB 4.13Å; F133-D438 WeakPolarHBondContact CE2-OD2 3.32Å; F133-D438 HydrophobicContact CZ-CB 4.05Å; R258-D438 HydrophobicContact CG-CB 4.28Å; R258-D438 PolarHBondContact N-O 3.04Å; R258-D438 VanDerWaalsContact N-O 3.12Å
439	L	93.3	Very high	92.8	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.073	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-94.9	151.8	171.8	-54.8	-173.6	0	0	0	111.4	H193 T253 F255 P256 L257 R258 L308 E441	H193-L439 HydrophobicContact CB-CD1 3.45Å; H193-L439 VanDerWaalsContact CB-CD1 3.45Å; H193-L439 HydrophobicContact CB-CG 4.34Å; T253-L439 HydrophobicContact CG2-CD1 4.11Å; F255-L439 HydrophobicContact CB-CB 4.26Å; F255-L439 HydrophobicContact CB-CD1 4.46Å; P256-L439 WeakPolarHBondContact O-CA 3.14Å; L257-L439 HydrophobicContact CD2-CD2 3.85Å; L257-L439 HydrophobicContact CG-CD2 4.16Å; R258-L439 PolarHBondContact NE-O 3.48Å; R258-L439 PolarHBondContact NH2-O 3.24Å; L308-L439 HydrophobicContact CD1-CD2 4.34Å; L439-E441 PolarHBondContact O-N 2.75Å
440	E	91.8	Very high	92.6	Very high	36 Å²	36	49.7 Å²	49.7	17%	0.168	24%	0.238	C	C	.	.			trans	-93.1	77.8	172.1	-163.9	69.3	-123.8	0	0	109.9	P256 R258 K442 P443	P256-E440 HydrophobicContact CG-CB 4.4Å; P256-E440 PolarHBondContact O-N 2.79Å; R258-E440 WeakPolarHBondContact CD-OE2 3.39Å; R258-E440 HydrophobicContact CG-CB 4.13Å; R258-E440 WeakPolarHBondContact CG-OE2 3.28Å; R258-E440 IonicContact CZ-OE1 2.62Å; R258-E440 IonicContact CZ-OE2 3.61Å; R258-E440 IonicContact NE-OE2 2.73Å; R258-E440 IonicContact NH1-OE1 3.81Å; R258-E440 PolarHBondContact NH1-OE1 3.44Å; R258-E440 IonicContact NH1-OE2 3.48Å; R258-E440 PolarHBondContact NH1-OE2 2.97Å; E440-K442 PolarHBondContact O-N 3.12Å; E440-P443 HydrophobicContact CG-CB 4.07Å; E440-P443 WeakPolarHBondContact O-CD 3.47Å
441	E	85.9	Confident	92.3	Very high	96 Å²	96	50.5 Å²	50.5	45%	0.449	24%	0.242	S	C	.	.	S	Bend	trans	-65.9	-22.2	-177.6	-63.2	-175.1	178.3	0	0	114	F255 L439	F255-E441 HydrophobicContact CD2-CB 4.22Å; F255-E441 HydrophobicContact CD2-CG 3.9Å; F255-E441 WeakPolarHBondContact CE1-O 3.47Å; F255-E441 HydrophobicContact CE2-CB 4.3Å; F255-E441 HydrophobicContact CE2-CG 4.21Å; F255-E441 HydrophobicContact CG-CB 4.39Å; F255-E441 HydrophobicContact CG-CG 4.37Å; L439-E441 PolarHBondContact O-N 2.75Å
442	K	86	Confident	91.7	Very high	170 Å²	170	56.5 Å²	56.5	74%	0.739	27%	0.268	S	S	*	.	S	Bend	trans	-131.3	69.7	-178.6	-65.7	-178.4	-175.5	172.7	0	110.2	E440 N444	E440-K442 PolarHBondContact O-N 3.12Å; K442-N444 PolarHBondContact O-N 3.09Å
443	P	84.6	Confident	90.8	Very high	33 Å²	33	61.8 Å²	61.8	21%	0.214	29%	0.293	C	S	.	.			trans	-64.4	133.5	-178.7	26	-30.6	0	0	0	110	E440 F445 L447	E440-P443 HydrophobicContact CG-CB 4.07Å; E440-P443 WeakPolarHBondContact O-CD 3.47Å; P443-F445 HydrophobicContact CB-CD1 4.15Å; P443-F445 HydrophobicContact CB-CD2 3.85Å; P443-F445 HydrophobicContact CB-CE1 3.87Å; P443-F445 HydrophobicContact CB-CE2 3.54Å; P443-F445 HydrophobicContact CB-CG 4.15Å; P443-F445 HydrophobicContact CB-CZ 3.56Å; P443-F445 PolarHBondContact O-N 3.14Å; P443-F445 VanDerWaalsContact O-N 3.15Å; P443-L447 HydrophobicContact CB-CD2 4.43Å; P443-L447 HydrophobicContact CG-CD1 4.32Å; P443-L447 HydrophobicContact CG-CD2 4.04Å; P443-L447 HydrophobicContact CG-CG 4.12Å
444	N	88.6	Confident	89.4	Confident	167 Å²	167	69.3 Å²	69.3	89%	0.893	33%	0.327	S	S	*	.	S	Bend	trans	-77.6	14	173.7	-68.9	-28.5	0	0	0	112.6	K442	K442-N444 PolarHBondContact O-N 3.09Å
445	F	88.6	Confident	87.8	Confident	71 Å²	71	70.3 Å²	70.3	31%	0.311	33%	0.334	S	S	.	.	S	Bend	trans	-133.5	153.3	-176.7	48.2	-98.2	0	0	0	110.3	Y364 P443 L447	Y364-F445 AromaticContact CD1-CD2 3.33Å; Y364-F445 HydrophobicContact CD1-CD2 3.33Å; Y364-F445 AromaticContact CD1-CE2 3.65Å; Y364-F445 HydrophobicContact CD1-CE2 3.65Å; Y364-F445 HydrophobicContact CD1-CG 4.12Å; Y364-F445 AromaticContact CD2-CD2 3.97Å; Y364-F445 HydrophobicContact CD2-CD2 3.97Å; Y364-F445 AromaticContact CD2-CE2 3.35Å; Y364-F445 HydrophobicContact CD2-CE2 3.35Å; Y364-F445 AromaticContact CD2-CZ 3.88Å; Y364-F445 HydrophobicContact CD2-CZ 3.88Å; Y364-F445 AromaticContact CE1-CD2 3.74Å; Y364-F445 HydrophobicContact CE1-CD2 3.74Å; Y364-F445 AromaticContact CE1-CE2 3.96Å; Y364-F445 HydrophobicContact CE1-CE2 3.96Å; Y364-F445 HydrophobicContact CE2-CD2 4.29Å; Y364-F445 AromaticContact CE2-CE2 3.65Å; Y364-F445 HydrophobicContact CE2-CE2 3.65Å; Y364-F445 HydrophobicContact CE2-CZ 4.47Å; Y364-F445 AromaticContact CG-CD2 3.49Å; Y364-F445 HydrophobicContact CG-CD2 3.49Å; Y364-F445 VanDerWaalsContact CG-CD2 3.49Å; Y364-F445 AromaticContact CG-CE2 3.36Å; Y364-F445 HydrophobicContact CG-CE2 3.36Å; Y364-F445 HydrophobicContact CG-CG 4.19Å; Y364-F445 AromaticContact CG-CZ 3.98Å; Y364-F445 HydrophobicContact CG-CZ 3.98Å; Y364-F445 AromaticContact CZ-CE2 3.97Å; P443-F445 HydrophobicContact CB-CD1 4.15Å; P443-F445 HydrophobicContact CB-CD2 3.85Å; P443-F445 HydrophobicContact CB-CE1 3.87Å; P443-F445 HydrophobicContact CB-CE2 3.54Å; P443-F445 HydrophobicContact CB-CG 4.15Å; P443-F445 HydrophobicContact CB-CZ 3.56Å; P443-F445 PolarHBondContact O-N 3.14Å; P443-F445 VanDerWaalsContact O-N 3.15Å; F445-L447 HydrophobicContact CD2-CD2 4.27Å; F445-L447 HydrophobicContact CE2-CD2 3.82Å; F445-L447 PolarHBondContact O-N 2.97Å
446	E	90.1	Very high	85.8	Confident	133 Å²	133	77.6 Å²	77.6	62%	0.621	36%	0.363	S	S	*	.			trans	-73.9	121.4	175.9	-176.3	168.7	-150.4	0	0	110	Y364 R448 P449	Y364-E446 WeakPolarHBondContact CE1-O 3.41Å; E446-R448 VanDerWaalsContact C-N 3.26Å; E446-R448 PolarHBondContact O-N 2.86Å; E446-P449 HydrophobicContact CG-CB 4.41Å; E446-P449 WeakPolarHBondContact O-CD 3.4Å
447	L	91.1	Very high	83.3	Confident	36 Å²	36	81.8 Å²	81.8	19%	0.188	39%	0.39	C	S	.	.	S	Bend	trans	-66.3	-29.1	-178.4	-68.6	174.1	0	0	0	112.8	P256 F306 Y364 P443 F445	P256-L447 HydrophobicContact CG-CD2 4.14Å; F306-L447 HydrophobicContact CE1-CD2 4.46Å; F306-L447 HydrophobicContact CE2-CD1 4.24Å; F306-L447 HydrophobicContact CZ-CD1 4Å; F306-L447 HydrophobicContact CZ-CD2 3.93Å; F306-L447 HydrophobicContact CZ-CG 4.42Å; Y364-L447 HydrophobicContact CE2-CD2 4.21Å; Y364-L447 WeakPolarHBondContact OH-CA 3.34Å; Y364-L447 PolarHBondContact OH-O 3.01Å; P443-L447 HydrophobicContact CB-CD2 4.43Å; P443-L447 HydrophobicContact CG-CD1 4.32Å; P443-L447 HydrophobicContact CG-CD2 4.04Å; P443-L447 HydrophobicContact CG-CG 4.12Å; F445-L447 HydrophobicContact CD2-CD2 4.27Å; F445-L447 HydrophobicContact CE2-CD2 3.82Å; F445-L447 PolarHBondContact O-N 2.97Å
448	R	92.3	Very high	80.5	Confident	84 Å²	84	86.4 Å²	86.4	32%	0.317	41%	0.414	S	S	.	.			trans	-131.6	58.4	-171.1	-61.3	179.6	-168.6	124.6	-10.4	112.1	E305 L354 E446 Y450 L451	E305-R448 IonicContact OE1-CZ 3.61Å; E305-R448 IonicContact OE1-NE 2.93Å; E305-R448 IonicContact OE1-NH2 3.29Å; E305-R448 PolarHBondContact OE1-NH2 3.19Å; E305-R448 IonicContact OE2-CZ 2.78Å; E305-R448 VanDerWaalsContact OE2-CZ 3.3Å; E305-R448 IonicContact OE2-NE 3.21Å; E305-R448 PolarHBondContact OE2-NE 3.09Å; E305-R448 IonicContact OE2-NH2 3.97Å; E305-R448 PolarHBondContact OE2-NH2 3.47Å; L354-R448 HydrophobicContact CD2-CG 3.99Å; E446-R448 VanDerWaalsContact C-N 3.26Å; E446-R448 PolarHBondContact O-N 2.86Å; R448-Y450 PolarHBondContact O-N 2.78Å; R448-Y450 VanDerWaalsContact O-N 3.1Å; R448-L451 HydrophobicContact CB-CB 4.23Å; R448-L451 HydrophobicContact CB-CD1 4.01Å; R448-L451 HydrophobicContact CB-CG 4.32Å; R448-L451 HydrophobicContact CG-CD1 4.08Å; R448-L451 PolarHBondContact O-N 3.23Å
449	P	92.2	Very high	77.8	Confident	39 Å²	39	92.7 Å²	92.7	25%	0.253	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.5	-169.6	30	-36.5	0	0	0	114.1	F356 T363 E446	F356-P449 HydrophobicContact CE1-CG 3.65Å; F356-P449 HydrophobicContact CZ-CG 3.83Å; T363-P449 HydrophobicContact CG2-CG 4.1Å; E446-P449 HydrophobicContact CG-CB 4.41Å; E446-P449 WeakPolarHBondContact O-CD 3.4Å
450	Y	92.1	Very high	74.6	Confident	45 Å²	45	101.6 Å²	101.6	18%	0.176	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	0.9	-177.8	-58.5	-58.2	0	0	0	113.8	K62 K70 G355 F356 N360 D361 T363 R448	K62-Y450 HydrophobicContact CD-CD1 4.4Å; K62-Y450 HydrophobicContact CG-CD1 4.19Å; K70-Y450 WeakPolarHBondContact CE-O 3.47Å; K70-Y450 PolarHBondContact NZ-O 3.23Å; G355-Y450 WeakPolarHBondContact O-CB 3.14Å; F356-Y450 AromaticContact CD1-CD2 3.54Å; F356-Y450 HydrophobicContact CD1-CD2 3.54Å; F356-Y450 AromaticContact CD1-CE2 3.45Å; F356-Y450 HydrophobicContact CD1-CE2 3.45Å; F356-Y450 VanDerWaalsContact CD1-CE2 3.45Å; F356-Y450 AromaticContact CE1-CD2 3.78Å; F356-Y450 HydrophobicContact CE1-CD2 3.78Å; F356-Y450 AromaticContact CE1-CE2 3.58Å; F356-Y450 HydrophobicContact CE1-CE2 3.58Å; F356-Y450 HydrophobicContact CG-CD2 4.48Å; N360-Y450 HydrophobicContact CB-CD1 4.47Å; N360-Y450 HydrophobicContact CB-CD2 4.06Å; N360-Y450 HydrophobicContact CB-CE1 4.35Å; N360-Y450 HydrophobicContact CB-CE2 3.94Å; N360-Y450 HydrophobicContact CB-CG 4.33Å; D361-Y450 WeakPolarHBondContact O-CE2 3.28Å; D361-Y450 PolarHBondContact O-OH 2.88Å; T363-Y450 HydrophobicContact CG2-CE2 4.46Å; R448-Y450 PolarHBondContact O-N 2.78Å; R448-Y450 VanDerWaalsContact O-N 3.1Å
451	L	91.7	Very high	71.4	Confident	22 Å²	22	108.2 Å²	108.2	12%	0.115	50%	0.502	C	S	.	.			trans	-99.1	128.6	177.9	-63.3	179	0	0	0	110.1	A67 K70 Y300 R448	A67-L451 HydrophobicContact CB-CD1 4.33Å; A67-L451 HydrophobicContact CB-CD2 3.99Å; A67-L451 VanDerWaalsContact N-CD2 3.32Å; K70-L451 HydrophobicContact CD-CD2 4.09Å; Y300-L451 HydrophobicContact CE2-CD1 4.46Å; R448-L451 HydrophobicContact CB-CB 4.23Å; R448-L451 HydrophobicContact CB-CD1 4.01Å; R448-L451 HydrophobicContact CB-CG 4.32Å; R448-L451 HydrophobicContact CG-CD1 4.08Å; R448-L451 PolarHBondContact O-N 3.23Å
452	K	87	Confident	68.8	Low	126 Å²	126	115.9 Å²	115.9	55%	0.548	53%	0.527	S	S	.	.	S	Bend	trans	-91.1	-29.5	179.9	-62.4	178.1	-179.3	172.7	0	111.6	D63 P65	D63-K452 VanDerWaalsContact CA-NZ 3.35Å; D63-K452 WeakPolarHBondContact O-CE 3.45Å; D63-K452 PolarHBondContact O-NZ 2.92Å; D63-K452 IonicContact OD1-NZ 3.62Å; D63-K452 PolarHBondContact OD1-NZ 3.41Å; P65-K452 HydrophobicContact CB-CB 4.25Å; P65-K452 PolarHBondContact O-N 3.13Å; P65-K452 VanDerWaalsContact O-N 3.08Å
453	E	78.7	Confident	66.2	Low	112 Å²	112	117.6 Å²	117.6	52%	0.523	56%	0.558	S	S	.	*	S	Bend	trans	-111	141	178.7	-68.9	-177.7	-176.6	0	0	110.4	P65 T66	P65-E453 HydrophobicContact CB-CB 4.49Å; P65-E453 HydrophobicContact CB-CG 3.99Å; P65-E453 PolarHBondContact O-N 2.82Å; T66-E453 HydrophobicContact CG2-CB 4.39Å
454	K	67.3	Low	65.2	Low	193 Å²	193	121.8 Å²	121.8	84%	0.839	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-68.9	142.7	169.7	-71.4	-172.8	176.6	-175.7	0	108.6
455	A	63.6	Low	64	Low	20 Å²	20	119.4 Å²	119.4	17%	0.165	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-50	146.1	172.5	0	0	0	0	0	110.3	Y300	Y300-A455 HydrophobicContact CD1-CB 4.24Å; Y300-A455 HydrophobicContact CE1-CB 3.69Å; Y300-A455 HydrophobicContact CE2-CB 4.09Å
456	Y	55.2	Low	62.6	Low	154 Å²	154	122.1 Å²	122.1	60%	0.604	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-46.4	134	-177.6	-61.5	-82.5	0	0	0	109.5	Y300 L458	Y300-Y456 HydrophobicContact CD1-CD2 4.42Å; Y456-L458 PolarHBondContact O-N 3.22Å
457	P	44	Very low	61	Low	89 Å²	89	121.5 Å²	121.5	58%	0.578	57%	0.569	S	S	*	*			trans	-66.7	91.5	164.3	27.3	-28.5	0	0	0	106.1	F459	P457-F459 PolarHBondContact O-N 3.2Å
458	L	37	Very low	59.1	Low	100 Å²	100	126.8 Å²	126.8	52%	0.524	59%	0.593	S	S	.	*	S	Bend	trans	-70.6	58.4	170.9	-85	163	0	0	0	108.9	Y456	Y456-L458 PolarHBondContact O-N 3.22Å
459	F	32.5	Very low	56.9	Low	206 Å²	206	129.7 Å²	129.7	90%	0.904	61%	0.611	S	S	*	*			trans	-171.3	63.4	162.2	-92.6	-69.7	0	0	0	107	P457	P457-F459 PolarHBondContact O-N 3.2Å
460	R	27	Very low	54.4	Low	201 Å²	201	136.1 Å²	136.1	76%	0.758	64%	0.637	S	S	*	*	S	Bend	trans	-112.5	114.8	154.9	-87	-170.5	-178.5	-179.7	1.6	107.8
461	E	25	Very low	51.5	Low	176 Å²	176	143.2 Å²	143.2	82%	0.822	67%	0.672	S	S	*	*	S	Bend	trans	71.4	62.8	156.4	-57	177	-169.9	0	0	117
462	W	30.7	Very low	48.2	Very low	257 Å²	257	153.3 Å²	153.3	97%	0.973	72%	0.719	S	S	*	*			trans	-130.2	65.7	143.9	-67.9	78.2	0	0	0	108.3
463	C	30.3	Very low	44.7	Very low	205 Å²	205	155.7 Å²	155.7	100%	1.385	73%	0.734	S	S	*	*			trans	-140.1	0	165.2	-80.6	0	0	0	0	108.1

Retrieved 463 of 463 residues in 605.1 ms (Link to these results)

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