X5D307_HUMAN Loading...

Neuroligin 3 isoform D

AlphaFold DB , UniProt , Accession X5D307, Species HUMAN (Homo sapiens, Human), Gene NLGN3, Length 490 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	35.7	Very low	36.1	Very low	239 Å²	239	161.5 Å²	161.5	100%	1.177	88%	0.883	S	S	*	*				0	112.8	0	-165.7	164.8	170	0	0	106.9
2	W	33.3	Very low	36.3	Very low	222 Å²	222	162.2 Å²	162.2	84%	0.841	88%	0.883	S	S	*	*			trans	-70.3	147.4	-176.3	-78.2	39.8	0	0	0	111.4
3	L	33.1	Very low	36.2	Very low	175 Å²	175	158.2 Å²	158.2	92%	0.916	87%	0.874	S	S	*	*			trans	-159.1	128.2	147.8	-103.3	149.2	0	0	0	110.8
4	R	37.2	Very low	36.7	Very low	215 Å²	215	155.9 Å²	155.9	81%	0.811	87%	0.871	S	S	*	*			trans	-83.1	147.8	179.3	-69.8	176.4	169.9	-169.9	-2.9	111.2
5	L	39	Very low	37.2	Very low	184 Å²	184	158.5 Å²	158.5	96%	0.963	87%	0.869	S	S	*	*			trans	-145.4	135.2	149.8	-81	171	0	0	0	109.4
6	G	33.5	Very low	37.5	Very low	73 Å²	73	155.9 Å²	155.9	75%	0.753	86%	0.862	S	S	*	*			trans	-86.4	179.6	-168	0	0	0	0	0	116.3
7	P	40.6	Very low	38.5	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-92.7	161.4	-171.4	36.4	-32.6	0	0	0	113.7
8	P	40.5	Very low	39.3	Very low	130 Å²	130	151.6 Å²	151.6	84%	0.844	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-85.8	153.8	-178.7	33.8	-32.2	0	0	0	113.5
9	S	34.5	Very low	39.7	Very low	122 Å²	122	146.7 Å²	146.7	85%	0.853	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.2	137.9	176.8	45	0	0	0	0	112.4
10	L	36.2	Very low	40.3	Very low	170 Å²	170	150 Å²	150	89%	0.89	83%	0.832	S	S	*	*			trans	-115.5	127.1	170.2	-94.1	153.1	0	0	0	109.3
11	S	33.6	Very low	41	Very low	120 Å²	120	146.4 Å²	146.4	84%	0.839	82%	0.817	S	S	*	*			trans	-85.3	135.7	177.3	51.8	0	0	0	0	111.2
12	L	38	Very low	41.9	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	79%	0.789	S	S	*	*			trans	-116.7	129.1	169.1	-93.2	119.4	0	0	0	109.4
13	S	35	Very low	43.1	Very low	110 Å²	110	134.1 Å²	134.1	77%	0.769	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-78.4	153.1	173.8	73.7	0	0	0	0	111.6
14	P	44.1	Very low	44.3	Very low	127 Å²	127	130.6 Å²	130.6	83%	0.825	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-86.3	135.3	178	31.8	-29.5	0	0	0	112
15	K	43.5	Very low	45.5	Very low	194 Å²	194	123.9 Å²	123.9	84%	0.843	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-88.1	151.5	164.1	-78.4	-175.2	178.9	179.3	0	110.3
16	P	43	Very low	46.5	Very low	117 Å²	117	120.4 Å²	120.4	76%	0.76	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-77.9	136.8	-165.4	30.3	-33.1	0	0	0	113.3	V18	P16-V18 VanDerWaalsContact C-N 3.32Å; P16-V18 PolarHBondContact O-N 3.36Å
17	T	53.3	Low	47.7	Very low	129 Å²	129	125.4 Å²	125.4	79%	0.791	72%	0.72	S	S	*	*			trans	-85.8	18.7	-177	38	0	0	0	0	114.5
18	V	52.6	Low	48.6	Very low	106 Å²	106	125.9 Å²	125.9	64%	0.642	71%	0.71	S	S	*	*	H	α-helix	trans	-83.5	-30	-169.1	-178.2	0	0	0	0	113.3	P16	P16-V18 VanDerWaalsContact C-N 3.32Å; P16-V18 PolarHBondContact O-N 3.36Å
19	G	47.5	Very low	49.3	Very low	58 Å²	58	125 Å²	125	60%	0.598	70%	0.697	S	S	*	*	H	α-helix	trans	-74.6	-25.7	-176.4	0	0	0	0	0	115.7
20	R	51.5	Low	50.4	Low	213 Å²	213	121.9 Å²	121.9	80%	0.804	68%	0.675	S	S	*	*	H	α-helix	trans	-76.8	-30.8	-178.9	-86.7	-178.6	165.4	-178.5	-5	113	L24	R20-L24 WeakPolarHBondContact O-CD1 3.34Å; R20-L24 PolarHBondContact O-N 3.18Å
21	S	55	Low	51.3	Low	75 Å²	75	118 Å²	118	52%	0.524	66%	0.655	S	S	.	*	H	α-helix	trans	-73.7	-36.7	-177.3	-163.9	0	0	0	0	112.1	L24 T25	S21-L24 PolarHBondContact O-N 3.13Å; S21-T25 WeakPolarHBondContact O-CG2 3.27Å; S21-T25 PolarHBondContact O-N 3.35Å; S21-T25 VanDerWaalsContact O-N 3.11Å; S21-T25 PolarHBondContact O-OG1 3.18Å
22	L	55.7	Low	52.1	Low	114 Å²	114	115.2 Å²	115.2	60%	0.597	64%	0.639	S	S	*	*	H	α-helix	trans	-69.2	-38	177.1	-124.2	88.3	0	0	0	113.3	T25 L26	L22-T25 WeakPolarHBondContact CA-OG1 3.39Å; L22-T25 PolarHBondContact O-OG1 2.85Å; L22-L26 WeakPolarHBondContact O-CB 3.31Å; L22-L26 WeakPolarHBondContact O-CD1 3.3Å; L22-L26 WeakPolarHBondContact O-CG 3.35Å; L22-L26 PolarHBondContact O-N 3.29Å; L22-L26 VanDerWaalsContact O-N 3.08Å
23	C	57.8	Low	52.5	Low	88 Å²	88	113 Å²	113	60%	0.595	63%	0.628	S	S	*	*	H	α-helix	trans	-67.7	-39.4	175.9	-88.3	0	0	0	0	111.9	L26 W27	C23-L26 PolarHBondContact O-N 3.29Å; C23-W27 WeakPolarHBondContact O-CB 3.48Å; C23-W27 PolarHBondContact O-N 3.04Å
24	L	58.2	Low	53.1	Low	102 Å²	102	118 Å²	118	53%	0.534	63%	0.63	S	S	.	*	H	α-helix	trans	-65.5	-42.4	177.2	-82.9	158	0	0	0	111.4	R20 S21 W27 F28	R20-L24 WeakPolarHBondContact O-CD1 3.34Å; R20-L24 PolarHBondContact O-N 3.18Å; S21-L24 PolarHBondContact O-N 3.13Å; L24-W27 PolarHBondContact O-N 2.97Å; L24-F28 HydrophobicContact CD2-CE2 4.4Å; L24-F28 WeakPolarHBondContact O-CD2 2.98Å; L24-F28 PolarHBondContact O-N 3.27Å
25	T	62.9	Low	53	Low	74 Å²	74	116.1 Å²	116.1	45%	0.454	63%	0.625	S	S	.	*	H	α-helix	trans	-67.6	-36.4	177.3	52.3	0	0	0	0	112.8	S21 L22 F28 L29	S21-T25 WeakPolarHBondContact O-CG2 3.27Å; S21-T25 PolarHBondContact O-N 3.35Å; S21-T25 VanDerWaalsContact O-N 3.11Å; S21-T25 PolarHBondContact O-OG1 3.18Å; L22-T25 WeakPolarHBondContact CA-OG1 3.39Å; L22-T25 PolarHBondContact O-OG1 2.85Å; T25-F28 PolarHBondContact O-N 3.48Å; T25-L29 WeakPolarHBondContact O-CB 3.13Å; T25-L29 PolarHBondContact O-N 2.96Å
26	L	58.6	Low	53.3	Low	111 Å²	111	111.3 Å²	111.3	58%	0.581	62%	0.616	S	S	*	*	H	α-helix	trans	-68.9	-32.7	172.7	-74.4	165.1	0	0	0	112.7	L22 C23 S30	L22-L26 WeakPolarHBondContact O-CB 3.31Å; L22-L26 WeakPolarHBondContact O-CD1 3.3Å; L22-L26 WeakPolarHBondContact O-CG 3.35Å; L22-L26 PolarHBondContact O-N 3.29Å; L22-L26 VanDerWaalsContact O-N 3.08Å; C23-L26 PolarHBondContact O-N 3.29Å; L26-S30 WeakPolarHBondContact O-CB 3.32Å; L26-S30 PolarHBondContact O-N 3.09Å; L26-S30 PolarHBondContact O-OG 2.99Å
27	W	60.4	Low	53.5	Low	177 Å²	177	111.5 Å²	111.5	67%	0.67	62%	0.615	S	S	*	*	H	α-helix	trans	-70.6	-41.3	174.2	-136.1	71.9	0	0	0	111.7	C23 L24 S30 L31	C23-W27 WeakPolarHBondContact O-CB 3.48Å; C23-W27 PolarHBondContact O-N 3.04Å; L24-W27 PolarHBondContact O-N 2.97Å; W27-S30 WeakPolarHBondContact CA-OG 3.12Å; W27-S30 PolarHBondContact O-N 3.34Å; W27-S30 PolarHBondContact O-OG 3.09Å; W27-L31 HydrophobicContact CD2-CD1 4.38Å; W27-L31 HydrophobicContact CE3-CD1 3.89Å; W27-L31 HydrophobicContact CH2-CD1 4.34Å; W27-L31 HydrophobicContact CZ3-CD1 3.87Å; W27-L31 WeakPolarHBondContact O-CB 3.49Å; W27-L31 PolarHBondContact O-N 3.02Å
28	F	58.7	Low	53.4	Low	138 Å²	138	114.5 Å²	114.5	61%	0.605	62%	0.62	S	S	*	*	H	α-helix	trans	-67.6	-37.8	172.7	-83.9	-71.7	0	0	0	112.7	L24 T25 L31 A32	L24-F28 HydrophobicContact CD2-CE2 4.4Å; L24-F28 WeakPolarHBondContact O-CD2 2.98Å; L24-F28 PolarHBondContact O-N 3.27Å; T25-F28 PolarHBondContact O-N 3.48Å; F28-L31 PolarHBondContact O-N 2.78Å; F28-A32 WeakPolarHBondContact O-CB 3.39Å; F28-A32 PolarHBondContact O-N 2.66Å
29	L	55.8	Low	53.8	Low	112 Å²	112	112.5 Å²	112.5	59%	0.586	62%	0.615	S	S	*	*	H	α-helix	trans	-66.2	-37.7	174.1	-113.9	86.5	0	0	0	112.2	T25 A32 L33	T25-L29 WeakPolarHBondContact O-CB 3.13Å; T25-L29 PolarHBondContact O-N 2.96Å; L29-A32 PolarHBondContact O-N 3.41Å; L29-L33 WeakPolarHBondContact O-CB 3.48Å; L29-L33 WeakPolarHBondContact O-CD1 3.23Å; L29-L33 PolarHBondContact O-N 3.36Å
30	S	57.7	Low	55.1	Low	55 Å²	55	115.7 Å²	115.7	39%	0.385	63%	0.625	S	S	.	*	H	α-helix	trans	-75	-31.7	176.5	53.2	0	0	0	0	113.2	L26 W27 R34	L26-S30 WeakPolarHBondContact O-CB 3.32Å; L26-S30 PolarHBondContact O-N 3.09Å; L26-S30 PolarHBondContact O-OG 2.99Å; W27-S30 WeakPolarHBondContact CA-OG 3.12Å; W27-S30 PolarHBondContact O-N 3.34Å; W27-S30 PolarHBondContact O-OG 3.09Å; S30-R34 WeakPolarHBondContact O-CB 3.48Å; S30-R34 VanDerWaalsContact O-CG 3.31Å; S30-R34 WeakPolarHBondContact O-CG 3.49Å; S30-R34 PolarHBondContact O-N 3.33Å; S30-R34 VanDerWaalsContact O-N 3.08Å
31	L	54.1	Low	56.8	Low	89 Å²	89	107.9 Å²	107.9	47%	0.466	61%	0.606	S	S	.	*	H	α-helix	trans	-67.3	-41.3	167.7	-115	83.3	0	0	0	111.7	W27 F28 R34 A35	W27-L31 HydrophobicContact CD2-CD1 4.38Å; W27-L31 HydrophobicContact CE3-CD1 3.89Å; W27-L31 HydrophobicContact CH2-CD1 4.34Å; W27-L31 HydrophobicContact CZ3-CD1 3.87Å; W27-L31 WeakPolarHBondContact O-CB 3.49Å; W27-L31 PolarHBondContact O-N 3.02Å; F28-L31 PolarHBondContact O-N 2.78Å; L31-R34 PolarHBondContact O-N 3.25Å; L31-A35 PolarHBondContact O-N 3.43Å
32	A	51.4	Low	58.7	Low	62 Å²	62	105 Å²	105	51%	0.512	59%	0.585	S	S	.	*	H	α-helix	trans	-69.6	-35.5	178	0	0	0	0	0	112.3	F28 L29 A35	F28-A32 WeakPolarHBondContact O-CB 3.39Å; F28-A32 PolarHBondContact O-N 2.66Å; L29-A32 PolarHBondContact O-N 3.41Å; A32-A35 PolarHBondContact O-N 2.81Å
33	L	46	Very low	60.7	Low	123 Å²	123	103 Å²	103	64%	0.644	58%	0.578	S	S	*	*	H	α-helix	trans	-69	-34.4	172.4	-105.1	78.1	0	0	0	112.3	L29 A35 S36	L29-L33 WeakPolarHBondContact O-CB 3.48Å; L29-L33 WeakPolarHBondContact O-CD1 3.23Å; L29-L33 PolarHBondContact O-N 3.36Å; L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.77Å; L33-S36 PolarHBondContact O-OG 3.35Å
34	R	46.7	Very low	62.5	Low	214 Å²	214	99.3 Å²	99.3	81%	0.808	55%	0.553	S	S	*	*	H	α-helix	trans	-72	-18.3	175.5	-78.2	-180	179.1	-166.5	-0.3	113.8	S30 L31 S36	S30-R34 WeakPolarHBondContact O-CB 3.48Å; S30-R34 VanDerWaalsContact O-CG 3.31Å; S30-R34 WeakPolarHBondContact O-CG 3.49Å; S30-R34 PolarHBondContact O-N 3.33Å; S30-R34 VanDerWaalsContact O-N 3.08Å; L31-R34 PolarHBondContact O-N 3.25Å; R34-S36 VanDerWaalsContact C-N 3.33Å; R34-S36 PolarHBondContact O-N 2.77Å
35	A	43	Very low	64.4	Low	87 Å²	87	98.5 Å²	98.5	72%	0.719	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	5.5	-179	0	0	0	0	0	114.5	L31 A32 L33	L31-A35 PolarHBondContact O-N 3.43Å; A32-A35 PolarHBondContact O-N 2.81Å; L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.77Å
36	S	49.5	Very low	66.1	Low	93 Å²	93	95.7 Å²	95.7	65%	0.65	53%	0.531	S	S	*	.	S	Bend	trans	-127.6	14.5	-171.2	73.7	0	0	0	0	117.2	L33 R34	L33-S36 PolarHBondContact O-OG 3.35Å; R34-S36 VanDerWaalsContact C-N 3.33Å; R34-S36 PolarHBondContact O-N 2.77Å
37	T	46.3	Very low	67.9	Low	122 Å²	122	96.1 Å²	96.1	75%	0.748	53%	0.53	S	S	*	.			trans	-113	22.7	178.3	63.2	0	0	0	0	114.1	A39	T37-A39 PolarHBondContact O-N 3.18Å
38	Q	51.6	Low	69.7	Low	191 Å²	191	89 Å²	89	89%	0.893	50%	0.504	S	S	*	.	S	Bend	trans	-84.3	107.7	167	-155.8	157.6	14.2	0	0	107.2
39	A	61.4	Low	71.6	Confident	65 Å²	65	83.1 Å²	83.1	54%	0.537	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-49.6	135.9	174.1	0	0	0	0	0	108.8	T37 A41	T37-A39 PolarHBondContact O-N 3.18Å; A39-A41 PolarHBondContact O-N 2.96Å
40	P	75.1	Confident	73.6	Confident	125 Å²	125	82.5 Å²	82.5	81%	0.812	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-56.5	133.2	-177.7	20.1	-29.5	0	0	0	109.9
41	A	87.2	Confident	75.5	Confident	49 Å²	49	79.9 Å²	79.9	41%	0.405	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-55.8	130.7	-179.8	0	0	0	0	0	110.2	A39 T43 R52	A39-A41 PolarHBondContact O-N 2.96Å; A41-T43 PolarHBondContact O-N 3.09Å; A41-T43 PolarHBondContact O-OG1 2.71Å; A41-R52 HydrophobicContact CB-CG 3.8Å
42	P	94.9	Very high	77.7	Confident	14 Å²	14	80.3 Å²	80.3	9%	0.091	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-61	127.8	-173.5	27.2	-35.7	0	0	0	109.4	R52 G53 D67	P42-R52 WeakPolarHBondContact O-CA 3.39Å; P42-G53 PolarHBondContact O-N 3.2Å; P42-D67 HydrophobicContact CB-CB 4.22Å; P42-D67 HydrophobicContact CG-CB 4.06Å
43	T	96.8	Very high	79.9	Confident	71 Å²	71	77.4 Å²	77.4	44%	0.436	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.2	-177.4	-58.3	0	0	0	0	108.9	A41 L51	A41-T43 PolarHBondContact O-N 3.09Å; A41-T43 PolarHBondContact O-OG1 2.71Å; T43-L51 CarbonylContact C-O 3.58Å; T43-L51 VanDerWaalsContact CA-O 3.23Å; T43-L51 WeakPolarHBondContact CA-O 3.47Å; T43-L51 WeakPolarHBondContact CG2-O 3.37Å
44	V	97.3	Very high	82.3	Confident	11 Å²	11	73.1 Å²	73.1	7%	0.067	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.7	-177.8	67	0	0	0	0	109.9	K50 L51 Y69 F234 F235	V44-K50 CarbonylContact O-C 3.4Å; V44-K50 WeakPolarHBondContact O-CA 3.44Å; V44-L51 HydrophobicContact CG1-CB 3.83Å; V44-L51 HydrophobicContact CG1-CD1 4.29Å; V44-L51 PolarHBondContact N-O 3.05Å; V44-L51 PolarHBondContact O-N 3.09Å; V44-Y69 HydrophobicContact CB-CE1 4.15Å; V44-Y69 HydrophobicContact CG1-CD1 3.99Å; V44-Y69 HydrophobicContact CG1-CE1 3.45Å; V44-Y69 VanDerWaalsContact CG1-CE1 3.45Å; V44-F234 HydrophobicContact CG2-CB 3.77Å; V44-F234 WeakPolarHBondContact CG2-O 3.48Å; V44-F235 HydrophobicContact CB-CE1 4.47Å; V44-F235 HydrophobicContact CG1-CD1 4.14Å; V44-F235 HydrophobicContact CG1-CE1 3.56Å; V44-F235 HydrophobicContact CG1-CE2 4.38Å; V44-F235 HydrophobicContact CG1-CZ 3.69Å; V44-F235 HydrophobicContact CG2-CD1 4.34Å; V44-F235 HydrophobicContact CG2-CD2 4.33Å; V44-F235 HydrophobicContact CG2-CE1 4.44Å; V44-F235 HydrophobicContact CG2-CE2 4.41Å; V44-F235 HydrophobicContact CG2-CG 4.3Å; V44-F235 HydrophobicContact CG2-CZ 4.47Å
45	N	97.1	Very high	84.7	Confident	86 Å²	86	69.1 Å²	69.1	46%	0.46	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.9	173	-61.4	-29.5	0	0	0	108.4	K50 F234	N45-K50 VanDerWaalsContact OD1-CD 3.24Å; N45-K50 WeakPolarHBondContact OD1-CD 3.26Å; N45-K50 VanDerWaalsContact OD1-CE 3.27Å; N45-K50 WeakPolarHBondContact OD1-CE 3.23Å; N45-K50 WeakPolarHBondContact OD1-CG 3.49Å; N45-F234 WeakPolarHBondContact O-CB 3.4Å; N45-F234 WeakPolarHBondContact O-CD1 3.49Å; N45-F234 WeakPolarHBondContact O-CD2 3.48Å; N45-F234 WeakPolarHBondContact O-CG 3.39Å
46	T	97.9	Very high	87.2	Confident	14 Å²	14	67 Å²	67	9%	0.086	37%	0.373	C	S	.	.			trans	-110.5	175.7	169.1	68.4	0	0	0	0	109.3	F48 G49 L51 W227 N231 F235	T46-F48 PolarHBondContact O-N 3.23Å; T46-F48 PolarHBondContact OG1-N 3.42Å; T46-G49 PolarHBondContact N-O 3.11Å; T46-G49 PolarHBondContact O-N 3.36Å; T46-G49 PolarHBondContact OG1-N 3.3Å; T46-G49 VanDerWaalsContact OG1-N 3.13Å; T46-G49 PolarHBondContact OG1-O 3.24Å; T46-L51 HydrophobicContact CG2-CD1 3.6Å; T46-L51 HydrophobicContact CG2-CG 4.29Å; T46-W227 HydrophobicContact CG2-CZ2 4.12Å; T46-N231 WeakPolarHBondContact CB-OD1 3.16Å; T46-F235 HydrophobicContact CG2-CE2 4.01Å; T46-F235 HydrophobicContact CG2-CZ 4.15Å
47	H	97.9	Very high	89.3	Confident	120 Å²	120	67.5 Å²	67.5	56%	0.556	38%	0.375	S	S	*	.	S	Bend	trans	-60.2	-25	170.5	-75.8	-64.9	0	0	0	113.1	E230 N231 F234	H47-E230 PolarHBondContact CD2-O 3.11Å; H47-E230 VanDerWaalsContact CD2-O 3.3Å; H47-E230 PolarHBondContact NE2-O 3.39Å; H47-N231 WeakPolarHBondContact CB-OD1 3.39Å; H47-N231 PolarHBondContact CD2-OD1 3.03Å; H47-N231 PolarHBondContact N-OD1 3.35Å; H47-F234 AromaticContact CD2-CE2 3.63Å; H47-F234 AromaticContact CE1-CZ 3.92Å; H47-F234 AromaticContact NE2-CE2 3.61Å; H47-F234 AromaticContact NE2-CZ 3.79Å
48	F	97.9	Very high	91.5	Very high	28 Å²	28	63 Å²	63	12%	0.123	35%	0.346	C	S	.	.	S	Bend	trans	-96.9	-21.5	-175.2	-60.3	-81.2	0	0	0	113.9	T46 P89 P90 S92 W93 W227	T46-F48 PolarHBondContact O-N 3.23Å; T46-F48 PolarHBondContact OG1-N 3.42Å; F48-P89 HydrophobicContact CE1-CB 4.36Å; F48-P89 HydrophobicContact CZ-CB 4.43Å; F48-P90 HydrophobicContact CD1-CG 3.81Å; F48-P90 WeakPolarHBondContact CD1-O 3.48Å; F48-P90 HydrophobicContact CD2-CG 3.96Å; F48-P90 HydrophobicContact CE1-CG 3.77Å; F48-P90 WeakPolarHBondContact CE1-O 3.34Å; F48-P90 HydrophobicContact CE2-CG 3.92Å; F48-P90 HydrophobicContact CG-CG 3.91Å; F48-P90 HydrophobicContact CZ-CG 3.84Å; F48-S92 CarbonylContact O-C 3.55Å; F48-S92 WeakPolarHBondContact O-CA 3.42Å; F48-S92 VanDerWaalsContact O-CB 3.31Å; F48-S92 WeakPolarHBondContact O-CB 3.4Å; F48-W93 HydrophobicContact CB-CE3 4.17Å; F48-W93 HydrophobicContact CB-CH2 3.82Å; F48-W93 HydrophobicContact CB-CZ3 3.57Å; F48-W93 PolarHBondContact O-N 3.3Å; F48-W227 AromaticContact CD2-NE1 3.69Å; F48-W227 AromaticContact CE2-CD1 3.65Å; F48-W227 AromaticContact CE2-NE1 3.8Å
49	G	97.6	Very high	93.3	Very high	15 Å²	15	58.7 Å²	58.7	16%	0.155	33%	0.334	C	S	.	.			trans	156.7	-178.1	179.8	0	0	0	0	0	113.1	T46	T46-G49 PolarHBondContact N-O 3.11Å; T46-G49 PolarHBondContact O-N 3.36Å; T46-G49 PolarHBondContact OG1-N 3.3Å; T46-G49 VanDerWaalsContact OG1-N 3.13Å; T46-G49 PolarHBondContact OG1-O 3.24Å
50	K	98.4	Very high	94.4	Very high	99 Å²	99	57.9 Å²	57.9	43%	0.43	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	139.2	-179.3	-49.1	-164.6	173.9	178.2	0	111.2	V44 N45 W93 I96 R97	V44-K50 CarbonylContact O-C 3.4Å; V44-K50 WeakPolarHBondContact O-CA 3.44Å; N45-K50 VanDerWaalsContact OD1-CD 3.24Å; N45-K50 WeakPolarHBondContact OD1-CD 3.26Å; N45-K50 VanDerWaalsContact OD1-CE 3.27Å; N45-K50 WeakPolarHBondContact OD1-CE 3.23Å; N45-K50 WeakPolarHBondContact OD1-CG 3.49Å; K50-W93 PolarHBondContact O-NE1 3.5Å; K50-I96 HydrophobicContact CB-CB 4.46Å; K50-I96 HydrophobicContact CB-CG1 4.05Å; K50-I96 HydrophobicContact CD-CG1 4.26Å; K50-R97 PolarHBondContact O-N 3.38Å
51	L	98.4	Very high	94.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.5	175.2	-63.4	166.7	0	0	0	110	T43 V44 T46 Y69 V72 W93 R97 A99 F235	T43-L51 CarbonylContact C-O 3.58Å; T43-L51 VanDerWaalsContact CA-O 3.23Å; T43-L51 WeakPolarHBondContact CA-O 3.47Å; T43-L51 WeakPolarHBondContact CG2-O 3.37Å; V44-L51 HydrophobicContact CG1-CB 3.83Å; V44-L51 HydrophobicContact CG1-CD1 4.29Å; V44-L51 PolarHBondContact N-O 3.05Å; V44-L51 PolarHBondContact O-N 3.09Å; T46-L51 HydrophobicContact CG2-CD1 3.6Å; T46-L51 HydrophobicContact CG2-CG 4.29Å; L51-Y69 HydrophobicContact CB-CD1 4.2Å; L51-V72 HydrophobicContact CD1-CB 4.43Å; L51-V72 HydrophobicContact CD1-CG1 3.62Å; L51-V72 HydrophobicContact CD1-CG2 3.92Å; L51-V72 HydrophobicContact CD2-CG1 4.39Å; L51-W93 HydrophobicContact CD2-CH2 4.16Å; L51-W93 HydrophobicContact CD2-CZ2 3.54Å; L51-W93 HydrophobicContact CG-CZ2 3.96Å; L51-R97 CarbonylContact C-O 3.49Å; L51-R97 WeakPolarHBondContact CA-O 3.38Å; L51-R97 HydrophobicContact CD2-CB 4.18Å; L51-R97 HydrophobicContact CD2-CG 4.39Å; L51-A99 HydrophobicContact CD2-CB 4.25Å; L51-F235 HydrophobicContact CD1-CZ 3.94Å
52	R	98.3	Very high	94.9	Very high	98 Å²	98	66.6 Å²	66.6	37%	0.37	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.3	168.6	177.3	-177.7	-64.6	162.9	-0.8	109.4	A41 P42 I96 R97 A99	A41-R52 HydrophobicContact CB-CG 3.8Å; P42-R52 WeakPolarHBondContact O-CA 3.39Å; R52-I96 HydrophobicContact CB-CG2 3.64Å; R52-R97 PolarHBondContact N-O 2.95Å; R52-A99 PolarHBondContact O-N 3.27Å
53	G	98	Very high	94.8	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.01	36%	0.355	C	S	.	.			trans	-92.5	-166	173.5	0	0	0	0	0	112.7	P42 Q68	P42-G53 PolarHBondContact O-N 3.2Å; G53-Q68 CarbonylContact C-O 3.5Å; G53-Q68 WeakPolarHBondContact CA-O 3.47Å
54	A	97.5	Very high	94.6	Very high	32 Å²	32	64.6 Å²	64.6	26%	0.264	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.2	175.2	0	0	0	0	0	110.4	Q68 T100	A54-Q68 PolarHBondContact N-O 3.23Å; A54-Q68 PolarHBondContact O-N 2.86Å; A54-T100 HydrophobicContact CB-CG2 4.19Å
55	R	96.2	Very high	94.5	Very high	130 Å²	130	66.2 Å²	66.2	49%	0.491	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.1	170.9	-176.5	161.2	-67.5	-172.9	-3	109.3	P65 D67	R55-P65 HydrophobicContact CG-CB 4.09Å; R55-D67 WeakPolarHBondContact CA-OD1 3.42Å; R55-D67 VanDerWaalsContact CB-OD1 3.25Å; R55-D67 WeakPolarHBondContact CB-OD1 3.28Å; R55-D67 WeakPolarHBondContact CG-OD1 3.38Å; R55-D67 IonicContact CZ-OD1 3.51Å; R55-D67 IonicContact CZ-OD2 2.7Å; R55-D67 IonicContact NE-OD1 2.65Å; R55-D67 PolarHBondContact NE-OD1 3.23Å; R55-D67 IonicContact NE-OD2 3.33Å; R55-D67 IonicContact NH2-OD1 3.06Å; R55-D67 PolarHBondContact NH2-OD1 2.94Å; R55-D67 IonicContact NH2-OD2 3.93Å; R55-D67 PolarHBondContact NH2-OD2 2.91Å
56	V	95.1	Very high	94.5	Very high	43 Å²	43	62.1 Å²	62.1	26%	0.261	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.9	-175.3	-178.3	0	0	0	0	109.8	P65 V66 Q68	V56-P65 WeakPolarHBondContact O-CA 3.26Å; V56-P65 WeakPolarHBondContact O-CB 3.35Å; V56-V66 PolarHBondContact N-O 2.85Å; V56-V66 PolarHBondContact O-N 2.98Å; V56-Q68 HydrophobicContact CB-CG 4.38Å; V56-Q68 HydrophobicContact CG2-CB 4.45Å; V56-Q68 HydrophobicContact CG2-CG 4.01Å
57	P	94.3	Very high	94.5	Very high	104 Å²	104	62.3 Å²	62.3	68%	0.675	33%	0.326	S	S	*	.			trans	-72.9	146.7	171.1	31.6	-33.4	0	0	0	110.4
58	L	93.4	Very high	94.5	Very high	27 Å²	27	57.6 Å²	57.6	14%	0.141	30%	0.304	C	S	.	.			trans	-93.6	151.2	176.6	-67.2	-179.8	0	0	0	111.5	S60 L63 V66	L58-S60 PolarHBondContact O-N 3.19Å; L58-L63 HydrophobicContact CB-CB 4.29Å; L58-L63 HydrophobicContact CD1-CB 3.83Å; L58-L63 HydrophobicContact CD1-CD1 4.09Å; L58-V66 HydrophobicContact CD1-CG2 4.17Å
59	P	87.6	Confident	94.5	Very high	100 Å²	100	57 Å²	57	65%	0.649	30%	0.301	S	S	*	.	S	Bend	trans	-75.9	48.5	176	33.1	-35.6	0	0	0	111.5	S490	P59-S490 VanDerWaalsContact CB-OG 3.27Å; P59-S490 WeakPolarHBondContact CB-OG 3.21Å; P59-S490 WeakPolarHBondContact CG-OG 3.13Å
60	S	86.3	Confident	94.6	Very high	48 Å²	48	56.7 Å²	56.7	34%	0.336	30%	0.296	S	S	.	.			trans	-149.3	133.9	176.8	172.7	0	0	0	0	108.5	L58 I62 L63	L58-S60 PolarHBondContact O-N 3.19Å; S60-I62 PolarHBondContact O-N 3.38Å; S60-I62 PolarHBondContact OG-N 3.32Å; S60-L63 PolarHBondContact OG-N 3.4Å
61	E	84.8	Confident	94.6	Very high	207 Å²	207	52.3 Å²	52.3	97%	0.967	28%	0.279	S	S	*	.	S	Bend	trans	-74.2	-14.2	176.9	-62.1	-174.8	170.9	0	0	112.8
62	I	88	Confident	94.6	Very high	151 Å²	151	52.3 Å²	52.3	77%	0.774	28%	0.279	S	S	*	.	S	Bend	trans	-94.9	-30.5	-176.9	-56.6	172.7	0	0	0	111.2	S60	S60-I62 PolarHBondContact O-N 3.38Å; S60-I62 PolarHBondContact OG-N 3.32Å
63	L	92.2	Very high	94.6	Very high	38 Å²	38	48 Å²	48	20%	0.199	26%	0.264	C	S	.	.	S	Bend	trans	-89.2	126.2	-176	-63.2	179	0	0	0	110.7	L58 S60 I183 Y187	L58-L63 HydrophobicContact CB-CB 4.29Å; L58-L63 HydrophobicContact CD1-CB 3.83Å; L58-L63 HydrophobicContact CD1-CD1 4.09Å; S60-L63 PolarHBondContact OG-N 3.4Å; L63-I183 HydrophobicContact CD1-CG2 4.24Å; L63-Y187 HydrophobicContact CD2-CD2 4.24Å
64	G	92.1	Very high	94.6	Very high	5 Å²	5	48 Å²	48	5%	0.052	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-63.6	157.9	173.1	0	0	0	0	0	112.8	E151 S186	G64-E151 VanDerWaalsContact CA-OE1 3.27Å; G64-E151 WeakPolarHBondContact CA-OE1 3.2Å; G64-E151 PolarHBondContact N-OE1 2.9Å; G64-S186 PolarHBondContact N-OG 2.9Å; G64-S186 PolarHBondContact O-OG 2.94Å
65	P	94.9	Very high	94.7	Very high	45 Å²	45	46.6 Å²	46.6	29%	0.292	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-66.1	162.9	177.2	27.1	-30.4	0	0	0	111.7	R55 V56 T150	R55-P65 HydrophobicContact CG-CB 4.09Å; V56-P65 WeakPolarHBondContact O-CA 3.26Å; V56-P65 WeakPolarHBondContact O-CB 3.35Å; P65-T150 WeakPolarHBondContact CD-OG1 3.16Å; P65-T150 HydrophobicContact CG-CG2 4.33Å; P65-T150 WeakPolarHBondContact CG-OG1 3.31Å; P65-T150 WeakPolarHBondContact O-CB 3.21Å; P65-T150 VanDerWaalsContact O-CG2 3.23Å; P65-T150 WeakPolarHBondContact O-CG2 3.13Å; P65-T150 PolarHBondContact O-N 3.4Å; P65-T150 PolarHBondContact O-OG1 2.88Å
66	V	97.1	Very high	94.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.4	-178.9	175.8	0	0	0	0	109.5	V56 L58 Q68 Y147 V148 S182	V56-V66 PolarHBondContact N-O 2.85Å; V56-V66 PolarHBondContact O-N 2.98Å; L58-V66 HydrophobicContact CD1-CG2 4.17Å; V66-Q68 HydrophobicContact CG1-CG 4.22Å; V66-Y147 HydrophobicContact CG1-CD1 4.45Å; V66-V148 CarbonylContact C-O 3.5Å; V66-V148 WeakPolarHBondContact CA-O 3.4Å; V66-V148 WeakPolarHBondContact CG1-O 3.41Å; V66-S182 WeakPolarHBondContact CG2-O 3.37Å
67	D	97.9	Very high	94.9	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.091	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.2	168.1	-71.3	-23.2	0	0	0	108.9	P42 R55 Y69 V148	P42-D67 HydrophobicContact CB-CB 4.22Å; P42-D67 HydrophobicContact CG-CB 4.06Å; R55-D67 WeakPolarHBondContact CA-OD1 3.42Å; R55-D67 VanDerWaalsContact CB-OD1 3.25Å; R55-D67 WeakPolarHBondContact CB-OD1 3.28Å; R55-D67 WeakPolarHBondContact CG-OD1 3.38Å; R55-D67 IonicContact CZ-OD1 3.51Å; R55-D67 IonicContact CZ-OD2 2.7Å; R55-D67 IonicContact NE-OD1 2.65Å; R55-D67 PolarHBondContact NE-OD1 3.23Å; R55-D67 IonicContact NE-OD2 3.33Å; R55-D67 IonicContact NH2-OD1 3.06Å; R55-D67 PolarHBondContact NH2-OD1 2.94Å; R55-D67 IonicContact NH2-OD2 3.93Å; R55-D67 PolarHBondContact NH2-OD2 2.91Å; D67-Y69 HydrophobicContact CB-CE2 4.14Å; D67-V148 HydrophobicContact CB-CB 4.31Å; D67-V148 PolarHBondContact N-O 3.47Å; D67-V148 PolarHBondContact O-N 3.43Å
68	Q	98.5	Very high	95.1	Very high	22 Å²	22	35.8 Å²	35.8	10%	0.103	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.8	-179.2	-63.7	-176.3	-5.5	0	0	110.9	G53 A54 V56 V66 L70 V146 Y147 S182	G53-Q68 CarbonylContact C-O 3.5Å; G53-Q68 WeakPolarHBondContact CA-O 3.47Å; A54-Q68 PolarHBondContact N-O 3.23Å; A54-Q68 PolarHBondContact O-N 2.86Å; V56-Q68 HydrophobicContact CB-CG 4.38Å; V56-Q68 HydrophobicContact CG2-CB 4.45Å; V56-Q68 HydrophobicContact CG2-CG 4.01Å; V66-Q68 HydrophobicContact CG1-CG 4.22Å; Q68-L70 HydrophobicContact CB-CD2 4.15Å; Q68-L70 HydrophobicContact CB-CG 4.27Å; Q68-V146 WeakPolarHBondContact CA-O 3.34Å; Q68-Y147 HydrophobicContact CG-CD1 3.89Å; Q68-Y147 HydrophobicContact CG-CE1 4.15Å; Q68-S182 PolarHBondContact NE2-OG 3.46Å
69	Y	98.7	Very high	95.3	Very high	14 Å²	14	38.6 Å²	38.6	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	94.7	170.9	-57.8	-98	0	0	0	108.3	V44 L51 D67 A99 N145 V146 V148 F235	V44-Y69 HydrophobicContact CB-CE1 4.15Å; V44-Y69 HydrophobicContact CG1-CD1 3.99Å; V44-Y69 HydrophobicContact CG1-CE1 3.45Å; V44-Y69 VanDerWaalsContact CG1-CE1 3.45Å; L51-Y69 HydrophobicContact CB-CD1 4.2Å; D67-Y69 HydrophobicContact CB-CE2 4.14Å; Y69-A99 CarbonylContact C-O 3.58Å; Y69-A99 WeakPolarHBondContact CA-O 3.49Å; Y69-N145 CarbonylContact O-C 3.54Å; Y69-N145 WeakPolarHBondContact O-CA 3.49Å; Y69-V146 HydrophobicContact CD2-CB 4.47Å; Y69-V146 PolarHBondContact N-O 3.28Å; Y69-V146 PolarHBondContact O-N 3.36Å; Y69-V148 HydrophobicContact CD2-CG2 4.38Å; Y69-V148 HydrophobicContact CE2-CG2 4.16Å; Y69-F235 HydrophobicContact CD1-CE1 4.05Å; Y69-F235 AromaticContact CD2-CD1 3.85Å; Y69-F235 HydrophobicContact CD2-CD1 3.85Å; Y69-F235 AromaticContact CD2-CE1 3.67Å; Y69-F235 HydrophobicContact CD2-CE1 3.67Å; Y69-F235 HydrophobicContact CE1-CE1 4.3Å; Y69-F235 AromaticContact CE2-CD1 3.81Å; Y69-F235 HydrophobicContact CE2-CD1 3.81Å; Y69-F235 AromaticContact CE2-CE1 3.95Å; Y69-F235 HydrophobicContact CE2-CE1 3.95Å; Y69-F235 HydrophobicContact CG-CD1 4.36Å; Y69-F235 AromaticContact CG-CE1 3.71Å; Y69-F235 HydrophobicContact CG-CE1 3.71Å
70	L	98.6	Very high	95.7	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.052	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.5	-173.7	-49.9	-177.9	0	0	0	110.6	Q68 A99 H101 F102 N145 Y147	Q68-L70 HydrophobicContact CB-CD2 4.15Å; Q68-L70 HydrophobicContact CB-CG 4.27Å; L70-A99 PolarHBondContact N-O 3.22Å; L70-A99 CarbonylContact O-C 3.54Å; L70-A99 WeakPolarHBondContact O-CA 3.43Å; L70-A99 WeakPolarHBondContact O-CB 3.04Å; L70-H101 CarbonylContact C-O 3.52Å; L70-H101 WeakPolarHBondContact CB-O 3.44Å; L70-F102 HydrophobicContact CB-CD1 4.24Å; L70-F102 HydrophobicContact CB-CE1 4.47Å; L70-F102 HydrophobicContact CD1-CD1 4.27Å; L70-F102 HydrophobicContact CD1-CE1 4.04Å; L70-F102 HydrophobicContact CD1-CE2 4.39Å; L70-F102 HydrophobicContact CD1-CZ 4.1Å; L70-F102 HydrophobicContact CD2-CD1 4.42Å; L70-F102 HydrophobicContact CD2-CE1 3.82Å; L70-F102 HydrophobicContact CD2-CZ 4.33Å; L70-F102 HydrophobicContact CG-CE1 4.32Å; L70-N145 WeakPolarHBondContact CA-OD1 3.38Å; L70-N145 HydrophobicContact CD2-CB 3.87Å; L70-Y147 HydrophobicContact CD2-CE1 4.27Å
71	G	97.9	Very high	96.2	Very high	7 Å²	7	40.2 Å²	40.2	7%	0.072	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.2	41.7	178.2	0	0	0	0	0	114.7	Y143 L144 N145	G71-Y143 WeakPolarHBondContact O-CD1 3.38Å; G71-L144 PolarHBondContact N-O 2.87Å; G71-N145 PolarHBondContact N-OD1 3.2Å
72	V	98.7	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	119.4	174.8	-176.2	0	0	0	0	109.5	L51 Y74 A99 Y143 L144 W227	L51-V72 HydrophobicContact CD1-CB 4.43Å; L51-V72 HydrophobicContact CD1-CG1 3.62Å; L51-V72 HydrophobicContact CD1-CG2 3.92Å; L51-V72 HydrophobicContact CD2-CG1 4.39Å; V72-Y74 PolarHBondContact O-N 3.48Å; V72-A99 HydrophobicContact CG2-CB 4.08Å; V72-Y143 CarbonylContact O-C 3.58Å; V72-Y143 VanDerWaalsContact O-CA 3.31Å; V72-Y143 WeakPolarHBondContact O-CA 3.07Å; V72-L144 HydrophobicContact CB-CD1 3.87Å; V72-L144 HydrophobicContact CB-CG 4.44Å; V72-L144 HydrophobicContact CG1-CD1 4.31Å; V72-L144 HydrophobicContact CG2-CD1 4.5Å; V72-L144 PolarHBondContact N-O 2.95Å; V72-L144 PolarHBondContact O-N 3.48Å; V72-W227 HydrophobicContact CG1-CH2 3.73Å; V72-W227 HydrophobicContact CG1-CZ2 3.43Å; V72-W227 VanDerWaalsContact CG1-CZ2 3.43Å
73	P	98.6	Very high	97.3	Very high	8 Å²	8	27.2 Å²	27.2	5%	0.052	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.1	179.6	28.2	-33.4	0	0	0	110.2	P90 W93 Y143	P73-P90 HydrophobicContact CB-CB 4.35Å; P73-W93 HydrophobicContact CG-CH2 4.15Å; P73-W93 HydrophobicContact CG-CZ3 3.83Å; P73-Y143 HydrophobicContact CB-CD1 3.99Å; P73-Y143 HydrophobicContact CB-CE1 3.77Å; P73-Y143 HydrophobicContact CG-CE1 4.44Å
74	Y	98.8	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.143	C	C	.	.			trans	-105.4	-8.5	176.3	71.3	-103.1	0	0	0	113.2	V72 P90 L142 Y143 L144 N196 D220 Q223 A224	V72-Y74 PolarHBondContact O-N 3.48Å; Y74-P90 VanDerWaalsContact O-CD 3.31Å; Y74-P90 WeakPolarHBondContact O-CD 3.44Å; Y74-L142 WeakPolarHBondContact CD1-O 3.27Å; Y74-L142 HydrophobicContact CE1-CB 4.17Å; Y74-L142 HydrophobicContact CE2-CB 4.14Å; Y74-L142 PolarHBondContact N-O 2.83Å; Y74-L142 WeakPolarHBondContact OH-CD2 3.36Å; Y74-Y143 VanDerWaalsContact CD1-C 3.48Å; Y74-Y143 VanDerWaalsContact CE1-N 3.34Å; Y74-Y143 WeakPolarHBondContact CE1-O 3.24Å; Y74-L144 HydrophobicContact CD1-CB 4.06Å; Y74-L144 HydrophobicContact CD1-CD2 3.98Å; Y74-L144 HydrophobicContact CD1-CG 4.09Å; Y74-L144 HydrophobicContact CG-CD2 4.11Å; Y74-N196 VanDerWaalsContact CE1-O 3.28Å; Y74-N196 WeakPolarHBondContact CE1-O 3.19Å; Y74-N196 PolarHBondContact OH-O 3Å; Y74-D220 WeakPolarHBondContact CE2-O 3.46Å; Y74-Q223 HydrophobicContact CD2-CB 4.43Å; Y74-Q223 HydrophobicContact CD2-CG 4.12Å; Y74-Q223 HydrophobicContact CE2-CB 4.41Å; Y74-Q223 HydrophobicContact CE2-CG 4.45Å; Y74-Q223 PolarHBondContact O-NE2 3.03Å; Y74-A224 HydrophobicContact CD1-CB 4.08Å; Y74-A224 HydrophobicContact CD2-CB 3.72Å; Y74-A224 HydrophobicContact CE1-CB 4.12Å; Y74-A224 HydrophobicContact CE2-CB 3.82Å; Y74-A224 HydrophobicContact CG-CB 3.88Å
75	A	98.8	Very high	97.9	Very high	3 Å²	3	28.8 Å²	28.8	3%	0.025	16%	0.159	C	C	.	.	S	Bend	trans	-148.4	165	177.1	0	0	0	0	0	111	P87 E88 L142 Q223	A75-P87 HydrophobicContact CB-CB 4.03Å; A75-E88 CarbonylContact C-O 3.56Å; A75-E88 WeakPolarHBondContact CA-O 3.37Å; A75-E88 VanDerWaalsContact CB-O 3.32Å; A75-E88 WeakPolarHBondContact CB-O 3.18Å; A75-L142 HydrophobicContact CB-CB 3.91Å; A75-L142 HydrophobicContact CB-CD1 3.61Å; A75-L142 HydrophobicContact CB-CG 4.43Å; A75-Q223 HydrophobicContact CB-CG 3.99Å
76	A	98.5	Very high	98.1	Very high	7 Å²	7	30.2 Å²	30.2	6%	0.058	17%	0.168	C	C	.	.			trans	-71.3	150.7	170.3	0	0	0	0	0	111	E88	A76-E88 HydrophobicContact CB-CB 4.23Å; A76-E88 PolarHBondContact N-O 2.74Å
77	P	98.4	Very high	98.2	Very high	37 Å²	37	31.1 Å²	31.1	24%	0.24	17%	0.174	C	C	.	.			trans	-58.2	126.3	178.4	-25.3	34.7	0	0	0	112.1	I79 D140	P77-I79 HydrophobicContact CB-CD1 4.22Å; P77-I79 HydrophobicContact CB-CG1 4.18Å; P77-I79 HydrophobicContact CB-CG2 4.22Å; P77-I79 PolarHBondContact O-N 2.95Å; P77-D140 HydrophobicContact CB-CB 3.97Å; P77-D140 HydrophobicContact CG-CB 4.33Å
78	P	98	Very high	98.2	Very high	6 Å²	6	35 Å²	35	4%	0.039	19%	0.192	C	C	.	.			trans	-82.8	49.5	-177.4	35.3	-37.7	0	0	0	112.3	R83 E139 L142 R198	P78-R83 WeakPolarHBondContact O-CA 3.44Å; P78-R83 PolarHBondContact O-N 2.84Å; P78-E139 WeakPolarHBondContact CD-O 3.49Å; P78-E139 WeakPolarHBondContact CG-O 3.34Å; P78-L142 HydrophobicContact CB-CD1 4.31Å; P78-L142 HydrophobicContact CG-CD1 3.87Å; P78-L142 HydrophobicContact CG-CG 4.01Å; P78-R198 HydrophobicContact CG-CG 4.21Å
79	I	97.5	Very high	98.2	Very high	86 Å²	86	37.7 Å²	37.7	44%	0.441	21%	0.211	S	C	.	.			trans	-102.4	155.9	-173.5	64.1	179.4	0	0	0	112.6	P77 E81 K82 E139	P77-I79 HydrophobicContact CB-CD1 4.22Å; P77-I79 HydrophobicContact CB-CG1 4.18Å; P77-I79 HydrophobicContact CB-CG2 4.22Å; P77-I79 PolarHBondContact O-N 2.95Å; I79-E81 PolarHBondContact O-N 3.17Å; I79-K82 PolarHBondContact O-N 2.98Å; I79-K82 VanDerWaalsContact O-N 3.11Å; I79-E139 HydrophobicContact CG2-CB 3.65Å
80	G	96	Very high	98.1	Very high	38 Å²	38	37.2 Å²	37.2	39%	0.392	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	59.9	-126	178.4	0	0	0	0	0	111.4	K82 R83	G80-K82 PolarHBondContact O-N 2.91Å; G80-K82 VanDerWaalsContact O-N 3.12Å; G80-R83 VanDerWaalsContact O-CB 3.24Å; G80-R83 WeakPolarHBondContact O-CB 3.44Å; G80-R83 PolarHBondContact O-N 2.87Å
81	E	96.8	Very high	97.9	Very high	144 Å²	144	41 Å²	41	67%	0.673	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-60.2	-21.8	178.2	-58.2	-52.3	129.1	0	0	113.6	I79 R83 L85	I79-E81 PolarHBondContact O-N 3.17Å; E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 3.39Å; E81-L85 WeakPolarHBondContact O-CD1 3.23Å
82	K	97.9	Very high	97.9	Very high	70 Å²	70	45 Å²	45	30%	0.304	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-80.7	-6.8	176.4	-59.1	-171.1	-176.7	-170	0	113.4	I79 G80 L85 E88	I79-K82 PolarHBondContact O-N 2.98Å; I79-K82 VanDerWaalsContact O-N 3.11Å; G80-K82 PolarHBondContact O-N 2.91Å; G80-K82 VanDerWaalsContact O-N 3.12Å; K82-L85 PolarHBondContact O-N 2.78Å; K82-E88 WeakPolarHBondContact CE-OE2 3.21Å; K82-E88 IonicContact NZ-OE2 3.81Å; K82-E88 PolarHBondContact NZ-OE2 3.23Å
83	R	98.5	Very high	97.8	Very high	15 Å²	15	47.1 Å²	47.1	6%	0.057	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	136.9	173.2	-167.5	-169.8	-69	162.6	3.7	109.3	P78 G80 E81 L85 E139 L202 L312 R313 K315	P78-R83 WeakPolarHBondContact O-CA 3.44Å; P78-R83 PolarHBondContact O-N 2.84Å; G80-R83 VanDerWaalsContact O-CB 3.24Å; G80-R83 WeakPolarHBondContact O-CB 3.44Å; G80-R83 PolarHBondContact O-N 2.87Å; E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 3.39Å; R83-L85 PolarHBondContact O-N 3.31Å; R83-E139 IonicContact CZ-OE1 3.46Å; R83-E139 IonicContact CZ-OE2 3.73Å; R83-E139 IonicContact NE-OE1 3.66Å; R83-E139 IonicContact NE-OE2 3.84Å; R83-E139 PolarHBondContact NE-OE2 3.25Å; R83-E139 IonicContact NH2-OE1 2.73Å; R83-E139 PolarHBondContact NH2-OE1 2.89Å; R83-E139 IonicContact NH2-OE2 3.31Å; R83-E139 PolarHBondContact NH2-OE2 3.23Å; R83-L202 HydrophobicContact CG-CD2 4.09Å; R83-L312 PolarHBondContact NH1-O 3.18Å; R83-L312 VanDerWaalsContact NH1-O 3.1Å; R83-R313 HydrophobicContact CB-CG 4.37Å; R83-R313 PolarHBondContact NH1-O 3Å; R83-R313 PolarHBondContact O-NE 2.92Å; R83-K315 PolarHBondContact NH1-O 3.37Å; R83-K315 PolarHBondContact NH2-O 2.81Å; R83-K315 VanDerWaalsContact NH2-O 3.12Å
84	F	98.5	Very high	97.7	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.009	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	32.9	-174.3	-42.3	-56.2	0	0	0	113.4	V201 L202 L205 Y216 V309 L312 R313 L320	F84-V201 HydrophobicContact CE1-CG1 4.31Å; F84-V201 WeakPolarHBondContact CE1-O 3.39Å; F84-V201 HydrophobicContact CZ-CG1 4.43Å; F84-L202 HydrophobicContact CE1-CD2 4.11Å; F84-L202 HydrophobicContact CZ-CD2 4.27Å; F84-L205 HydrophobicContact CD1-CB 4.17Å; F84-L205 HydrophobicContact CE1-CB 4.03Å; F84-L205 HydrophobicContact CE1-CD1 4.29Å; F84-L205 HydrophobicContact CZ-CD1 4.28Å; F84-Y216 VanDerWaalsContact C-CZ 3.5Å; F84-Y216 HydrophobicContact CB-CE2 3.8Å; F84-Y216 HydrophobicContact CD1-CD2 4.47Å; F84-Y216 HydrophobicContact CD1-CE2 4.07Å; F84-Y216 HydrophobicContact CG-CE2 4.42Å; F84-Y216 WeakPolarHBondContact O-CE1 3.47Å; F84-Y216 VanDerWaalsContact O-CZ 3.25Å; F84-Y216 PolarHBondContact O-OH 2.84Å; F84-V309 HydrophobicContact CD2-CG1 4.01Å; F84-L312 HydrophobicContact CE2-CB 3.97Å; F84-R313 HydrophobicContact CD2-CG 3.87Å; F84-R313 HydrophobicContact CE2-CG 4.19Å; F84-L320 HydrophobicContact CZ-CD1 4.12Å
85	L	98.4	Very high	97.6	Very high	73 Å²	73	55 Å²	55	38%	0.382	33%	0.333	S	S	.	.	S	Bend	trans	-124.9	159.6	170	-67.2	-177.1	0	0	0	110.9	E81 K82 R83 R198	E81-L85 WeakPolarHBondContact O-CD1 3.23Å; K82-L85 PolarHBondContact O-N 2.78Å; R83-L85 PolarHBondContact O-N 3.31Å; L85-R198 PolarHBondContact O-NH1 2.73Å; L85-R198 PolarHBondContact O-NH2 3.32Å
86	P	98.8	Very high	97.6	Very high	76 Å²	76	58.6 Å²	58.6	49%	0.494	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-52.2	145.5	169.3	-26.3	35.6	0	0	0	112.1	L219	P86-L219 HydrophobicContact CB-CD1 4.05Å; P86-L219 HydrophobicContact CG-CD1 4.04Å
87	P	98.7	Very high	97.6	Very high	18 Å²	18	62.6 Å²	62.6	12%	0.117	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.4	145.5	176	31.2	-35.6	0	0	0	110.9	A75 L142 L219 D220 Q223	A75-P87 HydrophobicContact CB-CB 4.03Å; P87-L142 HydrophobicContact CB-CD1 4.11Å; P87-L219 HydrophobicContact CG-CB 4.22Å; P87-L219 WeakPolarHBondContact CG-O 3.43Å; P87-D220 WeakPolarHBondContact CB-OD1 3.39Å; P87-D220 WeakPolarHBondContact CG-OD1 3.28Å; P87-Q223 HydrophobicContact CB-CB 4.22Å; P87-Q223 HydrophobicContact CB-CG 4.19Å; P87-Q223 HydrophobicContact CG-CB 3.63Å; P87-Q223 HydrophobicContact CG-CG 4.1Å
88	E	98.3	Very high	97.6	Very high	98 Å²	98	65.6 Å²	65.6	46%	0.458	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-103	154.6	172.1	-67.8	177.3	-176.8	0	0	110.2	A75 A76 K82	A75-E88 CarbonylContact C-O 3.56Å; A75-E88 WeakPolarHBondContact CA-O 3.37Å; A75-E88 VanDerWaalsContact CB-O 3.32Å; A75-E88 WeakPolarHBondContact CB-O 3.18Å; A76-E88 HydrophobicContact CB-CB 4.23Å; A76-E88 PolarHBondContact N-O 2.74Å; K82-E88 WeakPolarHBondContact CE-OE2 3.21Å; K82-E88 IonicContact NZ-OE2 3.81Å; K82-E88 PolarHBondContact NZ-OE2 3.23Å
89	P	97.7	Very high	97.6	Very high	79 Å²	79	65.3 Å²	65.3	51%	0.513	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-53.1	150.4	172.6	-26.6	35.3	0	0	0	112.9	F48	F48-P89 HydrophobicContact CE1-CB 4.36Å; F48-P89 HydrophobicContact CZ-CB 4.43Å
90	P	97.2	Very high	97.5	Very high	5 Å²	5	63.2 Å²	63.2	3%	0.032	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-69.5	147	-177.9	29.3	-30	0	0	0	110.1	F48 P73 Y74	F48-P90 HydrophobicContact CD1-CG 3.81Å; F48-P90 WeakPolarHBondContact CD1-O 3.48Å; F48-P90 HydrophobicContact CD2-CG 3.96Å; F48-P90 HydrophobicContact CE1-CG 3.77Å; F48-P90 WeakPolarHBondContact CE1-O 3.34Å; F48-P90 HydrophobicContact CE2-CG 3.92Å; F48-P90 HydrophobicContact CG-CG 3.91Å; F48-P90 HydrophobicContact CZ-CG 3.84Å; P73-P90 HydrophobicContact CB-CB 4.35Å; Y74-P90 VanDerWaalsContact O-CD 3.31Å; Y74-P90 WeakPolarHBondContact O-CD 3.44Å
91	P	94.6	Very high	97.5	Very high	89 Å²	89	68.4 Å²	68.4	58%	0.578	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-66.3	138.8	173.5	27.9	-33.4	0	0	0	110.1
92	S	97.3	Very high	97.5	Very high	90 Å²	90	65.6 Å²	65.6	63%	0.629	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-63.6	149.7	170.2	-55	0	0	0	0	111.3	F48	F48-S92 CarbonylContact O-C 3.55Å; F48-S92 WeakPolarHBondContact O-CA 3.42Å; F48-S92 VanDerWaalsContact O-CB 3.31Å; F48-S92 WeakPolarHBondContact O-CB 3.4Å
93	W	97.4	Very high	97.1	Very high	46 Å²	46	63 Å²	63	17%	0.174	36%	0.359	C	S	.	.			trans	-125.8	151.4	176.5	60.5	88	0	0	0	112	F48 K50 L51 P73 R97	F48-W93 HydrophobicContact CB-CE3 4.17Å; F48-W93 HydrophobicContact CB-CH2 3.82Å; F48-W93 HydrophobicContact CB-CZ3 3.57Å; F48-W93 PolarHBondContact O-N 3.3Å; K50-W93 PolarHBondContact O-NE1 3.5Å; L51-W93 HydrophobicContact CD2-CH2 4.16Å; L51-W93 HydrophobicContact CD2-CZ2 3.54Å; L51-W93 HydrophobicContact CG-CZ2 3.96Å; P73-W93 HydrophobicContact CG-CH2 4.15Å; P73-W93 HydrophobicContact CG-CZ3 3.83Å; W93-R97 HydrophobicContact CZ2-CB 4.44Å
94	S	96.8	Very high	96.9	Very high	120 Å²	120	64.7 Å²	64.7	84%	0.839	37%	0.371	S	S	*	.	S	Bend	trans	-90.1	157.9	170.8	64.7	0	0	0	0	111
95	G	96.8	Very high	96.8	Very high	53 Å²	53	64.7 Å²	64.7	55%	0.546	37%	0.371	S	S	.	.	S	Bend	trans	74.7	-151.2	-179	0	0	0	0	0	113.6
96	I	97.9	Very high	96.8	Very high	78 Å²	78	61.3 Å²	61.3	40%	0.4	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.2	-178.5	-56.6	174.5	0	0	0	108.2	K50 R52	K50-I96 HydrophobicContact CB-CB 4.46Å; K50-I96 HydrophobicContact CB-CG1 4.05Å; K50-I96 HydrophobicContact CD-CG1 4.26Å; R52-I96 HydrophobicContact CB-CG2 3.64Å
97	R	97.9	Very high	96.7	Very high	92 Å²	92	58.3 Å²	58.3	35%	0.347	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.5	173.4	-179.8	176.8	-176.2	126.1	1.5	109.3	K50 L51 R52 W93	K50-R97 PolarHBondContact O-N 3.38Å; L51-R97 CarbonylContact C-O 3.49Å; L51-R97 WeakPolarHBondContact CA-O 3.38Å; L51-R97 HydrophobicContact CD2-CB 4.18Å; L51-R97 HydrophobicContact CD2-CG 4.39Å; R52-R97 PolarHBondContact N-O 2.95Å; W93-R97 HydrophobicContact CZ2-CB 4.44Å
98	N	98.1	Very high	96.4	Very high	99 Å²	99	58.3 Å²	58.3	53%	0.529	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	131.1	173.7	-70	-27.6	0	0	0	109.5
99	A	98.1	Very high	95.8	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.008	32%	0.319	C	S	.	.			trans	-125.8	59.5	176.8	0	0	0	0	0	108.8	L51 R52 Y69 L70 V72	L51-A99 HydrophobicContact CD2-CB 4.25Å; R52-A99 PolarHBondContact O-N 3.27Å; Y69-A99 CarbonylContact C-O 3.58Å; Y69-A99 WeakPolarHBondContact CA-O 3.49Å; L70-A99 PolarHBondContact N-O 3.22Å; L70-A99 CarbonylContact O-C 3.54Å; L70-A99 WeakPolarHBondContact O-CA 3.43Å; L70-A99 WeakPolarHBondContact O-CB 3.04Å; V72-A99 HydrophobicContact CG2-CB 4.08Å
100	T	97.1	Very high	94.9	Very high	42 Å²	42	52.2 Å²	52.2	26%	0.258	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-120.2	-0.4	-171.2	62	0	0	0	0	113.5	A54	A54-T100 HydrophobicContact CB-CG2 4.19Å
101	H	95.7	Very high	93.4	Very high	147 Å²	147	59.8 Å²	59.8	68%	0.681	33%	0.334	S	S	*	.	S	Bend	trans	-140.9	151.7	-179.7	-56.4	95.1	0	0	0	108.9	L70	L70-H101 CarbonylContact C-O 3.52Å; L70-H101 WeakPolarHBondContact CB-O 3.44Å
102	F	95.9	Very high	91.7	Very high	84 Å²	84	58.1 Å²	58.1	37%	0.368	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-63.8	143.1	173.7	-68	-58.6	0	0	0	111.1	L70 N177	L70-F102 HydrophobicContact CB-CD1 4.24Å; L70-F102 HydrophobicContact CB-CE1 4.47Å; L70-F102 HydrophobicContact CD1-CD1 4.27Å; L70-F102 HydrophobicContact CD1-CE1 4.04Å; L70-F102 HydrophobicContact CD1-CE2 4.39Å; L70-F102 HydrophobicContact CD1-CZ 4.1Å; L70-F102 HydrophobicContact CD2-CD1 4.42Å; L70-F102 HydrophobicContact CD2-CE1 3.82Å; L70-F102 HydrophobicContact CD2-CZ 4.33Å; L70-F102 HydrophobicContact CG-CE1 4.32Å; F102-N177 HydrophobicContact CD1-CB 3.87Å; F102-N177 WeakPolarHBondContact CD1-OD1 3.47Å; F102-N177 HydrophobicContact CD2-CB 4.37Å; F102-N177 HydrophobicContact CE1-CB 4.1Å; F102-N177 HydrophobicContact CG-CB 4.01Å; F102-N177 HydrophobicContact CZ-CB 4.45Å
103	P	89.9	Confident	89.7	Confident	17 Å²	17	57.3 Å²	57.3	11%	0.11	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-80.4	168.8	173.3	36.4	-34.3	0	0	0	110.4	Y143 N177	P103-Y143 HydrophobicContact CB-CD1 4.09Å; P103-Y143 HydrophobicContact CB-CD2 3.51Å; P103-Y143 HydrophobicContact CB-CE1 4.49Å; P103-Y143 HydrophobicContact CB-CE2 4Å; P103-Y143 HydrophobicContact CB-CG 3.61Å; P103-Y143 VanDerWaalsContact CG-CB 3.42Å; P103-Y143 HydrophobicContact CG-CD1 4.33Å; P103-Y143 HydrophobicContact CG-CD2 3.77Å; P103-Y143 HydrophobicContact CG-CG 3.58Å; P103-N177 PolarHBondContact O-ND2 3.47Å
104	P	94.1	Very high	87.9	Confident	49 Å²	49	56.5 Å²	56.5	32%	0.318	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-48.8	143.8	164.8	-29.7	38.2	0	0	0	112.5	E136 N138	P104-E136 WeakPolarHBondContact CB-O 3.25Å; P104-N138 HydrophobicContact CB-CB 3.56Å; P104-N138 HydrophobicContact CG-CB 4.2Å
105	V	95.9	Very high	86.6	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-84.3	163	173.4	-60.8	0	0	0	0	111.3	Y133 I134 P137 N138 T175	V105-Y133 VanDerWaalsContact CG1-O 3.24Å; V105-Y133 WeakPolarHBondContact CG1-O 3.35Å; V105-I134 HydrophobicContact CG2-CG2 4.22Å; V105-P137 HydrophobicContact CG2-CB 4.42Å; V105-P137 WeakPolarHBondContact O-CA 3.49Å; V105-N138 PolarHBondContact O-N 3.45Å; V105-T175 HydrophobicContact CG1-CG2 4.06Å; V105-T175 WeakPolarHBondContact CG1-OG1 3.34Å
106	C	97.8	Very high	85.6	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.02	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-66.3	148.1	174.8	-61.1	0	0	0	0	111.4	Q108 C141 Y197 V199	C106-Q108 WeakPolarHBondContact O-CG 3.42Å; C106-Q108 PolarHBondContact O-N 3.4Å; C106-Q108 PolarHBondContact O-NE2 3.49Å; C106-C141 VanDerWaalsContact CA-CB 3.47Å; C106-C141 WeakPolarHBondContact CA-SG 3.45Å; C106-C141 HydrophobicContact CB-CB 3.82Å; C106-C141 WeakPolarHBondContact CB-SG 3.23Å; C106-C141 WeakPolarHBondContact SG-CB 3.27Å; C106-C141 CovalentContact SG-SG 2.04Å; C106-C141 PolarHBondContact SG-SG 3.44Å; C106-Y197 VanDerWaalsContact SG-C 3.6Å; C106-Y197 PolarHBondContact SG-O 3.32Å; C106-V199 HydrophobicContact CB-CG2 4.01Å
107	P	96.8	Very high	84.7	Confident	13 Å²	13	52.9 Å²	52.9	8%	0.084	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-61.2	124.4	-178.4	-23	36.5	0	0	0	112.1	P137 N138 E139 L202 A317 V321	P107-P137 HydrophobicContact CB-CB 4.38Å; P107-N138 WeakPolarHBondContact CD-O 3.45Å; P107-E139 HydrophobicContact CG-CG 3.91Å; P107-L202 HydrophobicContact CB-CD1 3.87Å; P107-L202 HydrophobicContact CG-CD1 3.69Å; P107-A317 HydrophobicContact CB-CB 4.02Å; P107-A317 HydrophobicContact CG-CB 3.91Å; P107-V321 HydrophobicContact CB-CG2 4.1Å
108	Q	93.2	Very high	83.9	Confident	17 Å²	17	49.3 Å²	49.3	8%	0.079	27%	0.268	C	S	.	.			trans	-153.8	157.8	-175.1	61	-165.7	-85.3	0	0	109.8	C106 I134 M172 E173 G174 V199 V321	C106-Q108 WeakPolarHBondContact O-CG 3.42Å; C106-Q108 PolarHBondContact O-N 3.4Å; C106-Q108 PolarHBondContact O-NE2 3.49Å; Q108-I134 HydrophobicContact CG-CG2 3.44Å; Q108-I134 VanDerWaalsContact CG-CG2 3.44Å; Q108-M172 WeakPolarHBondContact CB-O 3.23Å; Q108-E173 HydrophobicContact CB-CB 4.3Å; Q108-E173 VanDerWaalsContact OE1-CA 3.24Å; Q108-E173 VanDerWaalsContact OE1-CB 3.25Å; Q108-G174 PolarHBondContact NE2-O 2.86Å; Q108-G174 PolarHBondContact OE1-O 3.41Å; Q108-V199 HydrophobicContact CB-CG2 4.05Å; Q108-V321 VanDerWaalsContact C-CG1 3.49Å
109	N	86.2	Confident	83.2	Confident	31 Å²	31	45.1 Å²	45.1	17%	0.166	25%	0.245	C	C	.	.			trans	-129.3	109.7	177.1	-176.2	-0.1	0	0	0	110.3	H111 T112 V321	N109-H111 WeakPolarHBondContact OD1-CB 3.21Å; N109-H111 PolarHBondContact OD1-N 3.08Å; N109-T112 WeakPolarHBondContact ND2-CG2 3.39Å; N109-T112 PolarHBondContact ND2-OG1 2.85Å; N109-V321 HydrophobicContact CB-CG1 3.97Å
110	I	78.4	Confident	82.5	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.092	26%	0.256	C	S	.	.	S	Bend	trans	-92.1	-0.6	178.8	61.8	170.7	0	0	0	113.3	A131 I134 E173	I110-A131 HydrophobicContact CD1-CB 3.84Å; I110-I134 HydrophobicContact CD1-CD1 4.29Å; I110-I134 HydrophobicContact CG2-CD1 3.78Å; I110-E173 HydrophobicContact CG2-CB 3.89Å; I110-E173 HydrophobicContact CG2-CG 4.25Å
111	H	66.1	Low	81.9	Confident	165 Å²	165	46.1 Å²	46.1	76%	0.764	25%	0.252	S	S	*	.	S	Bend	trans	-95.3	-18.3	-177.2	-62.1	-61	0	0	0	113.5	N109	N109-H111 WeakPolarHBondContact OD1-CB 3.21Å; N109-H111 PolarHBondContact OD1-N 3.08Å
112	T	58	Low	81.2	Confident	53 Å²	53	41.3 Å²	41.3	33%	0.325	23%	0.228	S	C	.	.	S	Bend	trans	-87.4	152.6	171.4	43.4	0	0	0	0	110.6	N109 V114	N109-T112 WeakPolarHBondContact ND2-CG2 3.39Å; N109-T112 PolarHBondContact ND2-OG1 2.85Å; T112-V114 VanDerWaalsContact O-CG2 3.25Å; T112-V114 WeakPolarHBondContact O-CG2 3.43Å; T112-V114 PolarHBondContact O-N 3.47Å
113	A	54.8	Low	80.6	Confident	73 Å²	73	37.4 Å²	37.4	60%	0.603	21%	0.21	S	C	*	.			trans	-42.7	96.8	-170.3	0	0	0	0	0	113.5
114	V	60.7	Low	80.1	Confident	30 Å²	30	37.5 Å²	37.5	18%	0.182	21%	0.211	C	C	.	.			trans	-80.6	136.3	177	-158.6	0	0	0	0	107.7	T112 E116 L119	T112-V114 VanDerWaalsContact O-CG2 3.25Å; T112-V114 WeakPolarHBondContact O-CG2 3.43Å; T112-V114 PolarHBondContact O-N 3.47Å; V114-E116 VanDerWaalsContact C-N 3.25Å; V114-E116 PolarHBondContact O-N 2.85Å; V114-L119 HydrophobicContact CB-CD1 4.02Å; V114-L119 HydrophobicContact CG1-CD1 3.22Å; V114-L119 HydrophobicContact CG1-CD2 4.45Å; V114-L119 HydrophobicContact CG1-CG 3.9Å
115	P	68.9	Low	79.5	Confident	43 Å²	43	37.3 Å²	37.3	28%	0.279	21%	0.213	S	C	.	.			trans	-66.3	84.9	176.1	-17	30.1	0	0	0	110.2	V117 M118 L119	P115-V117 PolarHBondContact O-N 3.43Å; P115-M118 HydrophobicContact CB-CB 4.33Å; P115-M118 HydrophobicContact CB-CE 4.33Å; P115-M118 HydrophobicContact CB-CG 4.03Å; P115-M118 HydrophobicContact CB-SD 3.89Å; P115-M118 HydrophobicContact CG-SD 4.34Å; P115-M118 PolarHBondContact O-N 2.98Å; P115-L119 PolarHBondContact O-N 3.48Å
116	E	75.8	Confident	78.7	Confident	100 Å²	100	39 Å²	39	47%	0.467	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.4	-174.6	-70.6	-168.2	-157.5	0	0	112.7	V114 M118 L119 T124 K372	V114-E116 VanDerWaalsContact C-N 3.25Å; V114-E116 PolarHBondContact O-N 2.85Å; E116-M118 PolarHBondContact O-N 2.87Å; E116-L119 PolarHBondContact O-N 2.83Å; E116-T124 HydrophobicContact CB-CG2 4.44Å; E116-T124 HydrophobicContact CG-CG2 4.25Å; E116-K372 HydrophobicContact CB-CD 4.23Å; E116-K372 IonicContact OE2-NZ 3.32Å; E116-K372 PolarHBondContact OE2-NZ 3.39Å
117	V	79.7	Confident	77.9	Confident	31 Å²	31	42.4 Å²	42.4	19%	0.188	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19	176.8	-61.1	0	0	0	0	114.3	P115 K372 F438	P115-V117 PolarHBondContact O-N 3.43Å; V117-K372 HydrophobicContact CB-CB 4.41Å; V117-K372 HydrophobicContact CG1-CB 4.13Å; V117-F438 HydrophobicContact CB-CE1 4.37Å
118	M	79.7	Confident	77.2	Confident	18 Å²	18	48.7 Å²	48.7	9%	0.089	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-15.2	179.4	-58.3	-178.6	-173	0	0	112.7	P115 E116 W281 Y330	P115-M118 HydrophobicContact CB-CB 4.33Å; P115-M118 HydrophobicContact CB-CE 4.33Å; P115-M118 HydrophobicContact CB-CG 4.03Å; P115-M118 HydrophobicContact CB-SD 3.89Å; P115-M118 HydrophobicContact CG-SD 4.34Å; P115-M118 PolarHBondContact O-N 2.98Å; E116-M118 PolarHBondContact O-N 2.87Å; M118-W281 HydrophobicContact CE-CB 3.94Å; M118-W281 HydrophobicContact CE-CD2 4.3Å; M118-W281 HydrophobicContact CE-CE3 3.57Å; M118-W281 HydrophobicContact CE-CZ3 4.37Å; M118-W281 HydrophobicContact CG-CD2 4.07Å; M118-W281 HydrophobicContact CG-CE3 3.51Å; M118-W281 HydrophobicContact CG-CH2 4.45Å; M118-W281 HydrophobicContact CG-CZ3 3.71Å; M118-W281 HydrophobicContact SD-CB 3.94Å; M118-W281 HydrophobicContact SD-CD2 4.2Å; M118-W281 HydrophobicContact SD-CE3 3.87Å; M118-W281 HydrophobicContact SD-CG 4.3Å; M118-Y330 VanDerWaalsContact CE-C 3.48Å; M118-Y330 VanDerWaalsContact CE-CA 3.48Å
119	L	83.5	Confident	76.8	Confident	11 Å²	11	52.2 Å²	52.2	6%	0.058	29%	0.291	C	S	.	.	S	Bend	trans	-90.6	149.4	-175.3	-75.2	-171	0	0	0	112.9	V114 P115 E116 V121 F123 T124 G169 E173	V114-L119 HydrophobicContact CB-CD1 4.02Å; V114-L119 HydrophobicContact CG1-CD1 3.22Å; V114-L119 HydrophobicContact CG1-CD2 4.45Å; V114-L119 HydrophobicContact CG1-CG 3.9Å; P115-L119 PolarHBondContact O-N 3.48Å; E116-L119 PolarHBondContact O-N 2.83Å; L119-V121 PolarHBondContact O-N 3.18Å; L119-F123 HydrophobicContact CD1-CD1 3.72Å; L119-F123 HydrophobicContact CD1-CE1 3.89Å; L119-T124 HydrophobicContact CB-CG2 3.57Å; L119-T124 HydrophobicContact CD1-CG2 3.6Å; L119-T124 HydrophobicContact CG-CG2 4.25Å; L119-G169 VanDerWaalsContact CD2-C 3.46Å; L119-E173 WeakPolarHBondContact CD2-OE1 3.41Å
120	P	83.2	Confident	76.7	Confident	37 Å²	37	51.3 Å²	51.3	24%	0.24	29%	0.287	C	S	.	.			trans	-57.8	139.5	170.8	-21.4	32.2	0	0	0	111.7	W122 F123 T124	P120-W122 VanDerWaalsContact C-N 3.26Å; P120-W122 HydrophobicContact CB-CD2 4.33Å; P120-W122 HydrophobicContact CB-CG 4.25Å; P120-W122 HydrophobicContact CB-CZ2 4.31Å; P120-W122 VanDerWaalsContact CB-NE1 3.27Å; P120-W122 HydrophobicContact CG-CZ2 4.33Å; P120-W122 PolarHBondContact O-N 3.47Å; P120-F123 HydrophobicContact CB-CB 4.25Å; P120-F123 WeakPolarHBondContact O-CB 3.41Å; P120-F123 PolarHBondContact O-N 3.08Å; P120-T124 PolarHBondContact O-N 3Å; P120-T124 PolarHBondContact O-OG1 3.49Å
121	V	85	Confident	77	Confident	26 Å²	26	51.8 Å²	51.8	16%	0.158	29%	0.294	C	S	.	.	H	α-helix	trans	-57.8	-38.8	179.6	177.1	0	0	0	0	111.8	L119 F123 T124 A125 L371 M483	L119-V121 PolarHBondContact O-N 3.18Å; V121-F123 PolarHBondContact O-N 3.48Å; V121-T124 PolarHBondContact O-OG1 3.16Å; V121-A125 WeakPolarHBondContact O-CB 3.44Å; V121-A125 PolarHBondContact O-N 3.11Å; V121-L371 HydrophobicContact CG2-CD2 4.28Å; V121-M483 HydrophobicContact CG1-CE 4.21Å
122	W	82.1	Confident	78.1	Confident	46 Å²	46	47.7 Å²	47.7	17%	0.174	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-29.3	179.1	64.4	-101.5	0	0	0	112.8	P120 N126 V130 M178 M483	P120-W122 VanDerWaalsContact C-N 3.26Å; P120-W122 HydrophobicContact CB-CD2 4.33Å; P120-W122 HydrophobicContact CB-CG 4.25Å; P120-W122 HydrophobicContact CB-CZ2 4.31Å; P120-W122 VanDerWaalsContact CB-NE1 3.27Å; P120-W122 HydrophobicContact CG-CZ2 4.33Å; P120-W122 PolarHBondContact O-N 3.47Å; W122-N126 PolarHBondContact O-N 3.19Å; W122-N126 PolarHBondContact O-ND2 3.48Å; W122-V130 HydrophobicContact CZ3-CG2 4.37Å; W122-M178 HydrophobicContact CH2-CE 3.93Å; W122-M178 HydrophobicContact CH2-CG 4.21Å; W122-M178 HydrophobicContact CH2-SD 3.8Å; W122-M178 HydrophobicContact CZ2-CE 4.36Å; W122-M483 HydrophobicContact CB-CG 4.46Å
123	F	83.2	Confident	79.5	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-74.4	-51.4	-180	-172.6	-75.6	0	0	0	109.8	L119 P120 V121 A125 N126 L127 V130 I134 E173 M178	L119-F123 HydrophobicContact CD1-CD1 3.72Å; L119-F123 HydrophobicContact CD1-CE1 3.89Å; P120-F123 HydrophobicContact CB-CB 4.25Å; P120-F123 WeakPolarHBondContact O-CB 3.41Å; P120-F123 PolarHBondContact O-N 3.08Å; V121-F123 PolarHBondContact O-N 3.48Å; F123-A125 PolarHBondContact O-N 3.37Å; F123-N126 PolarHBondContact O-N 3.29Å; F123-L127 HydrophobicContact CD1-CD2 4.27Å; F123-L127 HydrophobicContact CE1-CD2 4.22Å; F123-V130 HydrophobicContact CD1-CG1 4.32Å; F123-V130 HydrophobicContact CD2-CG1 4.04Å; F123-V130 HydrophobicContact CD2-CG2 4.08Å; F123-V130 HydrophobicContact CE1-CG1 3.84Å; F123-V130 HydrophobicContact CE2-CG1 3.53Å; F123-V130 HydrophobicContact CE2-CG2 4.41Å; F123-V130 HydrophobicContact CG-CG1 4.42Å; F123-V130 HydrophobicContact CG-CG2 4.15Å; F123-V130 HydrophobicContact CZ-CG1 3.43Å; F123-V130 VanDerWaalsContact CZ-CG1 3.43Å; F123-I134 HydrophobicContact CZ-CD1 4.31Å; F123-E173 HydrophobicContact CE1-CG 4.31Å; F123-E173 HydrophobicContact CZ-CG 3.9Å; F123-M178 HydrophobicContact CD2-SD 4.47Å; F123-M178 HydrophobicContact CE2-SD 4.31Å
124	T	79.7	Confident	81	Confident	20 Å²	20	46.1 Å²	46.1	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-70.3	-30.7	180	51.5	0	0	0	0	113	E116 L119 P120 V121 N126	E116-T124 HydrophobicContact CB-CG2 4.44Å; E116-T124 HydrophobicContact CG-CG2 4.25Å; L119-T124 HydrophobicContact CB-CG2 3.57Å; L119-T124 HydrophobicContact CD1-CG2 3.6Å; L119-T124 HydrophobicContact CG-CG2 4.25Å; P120-T124 PolarHBondContact O-N 3Å; P120-T124 PolarHBondContact O-OG1 3.49Å; V121-T124 PolarHBondContact O-OG1 3.16Å; T124-N126 VanDerWaalsContact C-N 3.34Å
125	A	79.8	Confident	81.8	Confident	44 Å²	44	50.5 Å²	50.5	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-75.1	-20	178.2	0	0	0	0	0	114	V121 F123	V121-A125 WeakPolarHBondContact O-CB 3.44Å; V121-A125 PolarHBondContact O-N 3.11Å; F123-A125 PolarHBondContact O-N 3.37Å
126	N	80.9	Confident	82.4	Confident	39 Å²	39	56.1 Å²	56.1	21%	0.209	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128	43.4	-174.7	-60.8	-75	0	0	0	112.2	W122 F123 T124 D128 I129 V130 M474	W122-N126 PolarHBondContact O-N 3.19Å; W122-N126 PolarHBondContact O-ND2 3.48Å; F123-N126 PolarHBondContact O-N 3.29Å; T124-N126 VanDerWaalsContact C-N 3.34Å; N126-D128 PolarHBondContact O-N 3.39Å; N126-D128 VanDerWaalsContact O-N 3.13Å; N126-I129 HydrophobicContact CB-CB 4.29Å; N126-I129 HydrophobicContact CB-CD1 4.29Å; N126-I129 HydrophobicContact CB-CG1 4.5Å; N126-I129 PolarHBondContact O-N 3.26Å; N126-V130 WeakPolarHBondContact O-CG2 3.48Å; N126-V130 PolarHBondContact O-N 3.23Å; N126-M474 PolarHBondContact OD1-SD 2.99Å; N126-M474 VanDerWaalsContact OD1-SD 3.35Å
127	L	81.1	Confident	83.2	Confident	73 Å²	73	54.7 Å²	54.7	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-54.5	-33.9	-176.7	-74.2	174.8	0	0	0	113.3	F123 I129 V130 A131	F123-L127 HydrophobicContact CD1-CD2 4.27Å; F123-L127 HydrophobicContact CE1-CD2 4.22Å; L127-I129 PolarHBondContact O-N 3.27Å; L127-V130 PolarHBondContact O-N 3.29Å; L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 3.13Å
128	D	82.4	Confident	84	Confident	145 Å²	145	57 Å²	57	78%	0.775	31%	0.306	S	S	*	.	H	α-helix	trans	-62.9	-41.4	176.6	-67	-29.2	0	0	0	112.3	N126 T132	N126-D128 PolarHBondContact O-N 3.39Å; N126-D128 VanDerWaalsContact O-N 3.13Å; D128-T132 WeakPolarHBondContact O-CG2 3.26Å; D128-T132 PolarHBondContact O-N 2.92Å
129	I	84.1	Confident	84.9	Confident	92 Å²	92	57.7 Å²	57.7	47%	0.472	31%	0.309	S	S	.	.	H	α-helix	trans	-70.9	-46.4	176.9	-62.1	177.3	0	0	0	109.4	N126 L127 A131 T132 Y133	N126-I129 HydrophobicContact CB-CB 4.29Å; N126-I129 HydrophobicContact CB-CD1 4.29Å; N126-I129 HydrophobicContact CB-CG1 4.5Å; N126-I129 PolarHBondContact O-N 3.26Å; L127-I129 PolarHBondContact O-N 3.27Å; I129-A131 PolarHBondContact O-N 3.47Å; I129-T132 WeakPolarHBondContact O-CB 3.33Å; I129-T132 PolarHBondContact O-N 3.41Å; I129-T132 PolarHBondContact O-OG1 3.48Å; I129-Y133 HydrophobicContact CG2-CE2 4.23Å; I129-Y133 WeakPolarHBondContact O-CD2 3.19Å
130	V	84.5	Confident	85.6	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-56.9	-41.8	177.3	169.4	0	0	0	0	111	W122 F123 N126 L127 T132 Y133 I134	W122-V130 HydrophobicContact CZ3-CG2 4.37Å; F123-V130 HydrophobicContact CD1-CG1 4.32Å; F123-V130 HydrophobicContact CD2-CG1 4.04Å; F123-V130 HydrophobicContact CD2-CG2 4.08Å; F123-V130 HydrophobicContact CE1-CG1 3.84Å; F123-V130 HydrophobicContact CE2-CG1 3.53Å; F123-V130 HydrophobicContact CE2-CG2 4.41Å; F123-V130 HydrophobicContact CG-CG1 4.42Å; F123-V130 HydrophobicContact CG-CG2 4.15Å; F123-V130 HydrophobicContact CZ-CG1 3.43Å; F123-V130 VanDerWaalsContact CZ-CG1 3.43Å; N126-V130 WeakPolarHBondContact O-CG2 3.48Å; N126-V130 PolarHBondContact O-N 3.23Å; L127-V130 PolarHBondContact O-N 3.29Å; V130-T132 PolarHBondContact O-N 3.04Å; V130-Y133 PolarHBondContact O-N 2.86Å; V130-I134 HydrophobicContact CG1-CD1 3.58Å; V130-I134 PolarHBondContact O-N 2.82Å
131	A	84.9	Confident	86.3	Confident	29 Å²	29	57.6 Å²	57.6	24%	0.24	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-27.2	177.3	0	0	0	0	0	112.7	I110 L127 I129 Y133 I134 Q135	I110-A131 HydrophobicContact CD1-CB 3.84Å; L127-A131 WeakPolarHBondContact O-CB 3.45Å; L127-A131 PolarHBondContact O-N 3.13Å; I129-A131 PolarHBondContact O-N 3.47Å; A131-Y133 VanDerWaalsContact C-N 3.33Å; A131-I134 PolarHBondContact O-N 3.03Å; A131-Q135 WeakPolarHBondContact O-CG 3.45Å; A131-Q135 PolarHBondContact O-N 3.47Å
132	T	88.1	Confident	87	Confident	79 Å²	79	56.4 Å²	56.4	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-68.2	-29.7	174.6	71.9	0	0	0	0	113.5	D128 I129 V130	D128-T132 WeakPolarHBondContact O-CG2 3.26Å; D128-T132 PolarHBondContact O-N 2.92Å; I129-T132 WeakPolarHBondContact O-CB 3.33Å; I129-T132 PolarHBondContact O-N 3.41Å; I129-T132 PolarHBondContact O-OG1 3.48Å; V130-T132 PolarHBondContact O-N 3.04Å
133	Y	87.3	Confident	87.8	Confident	76 Å²	76	55.2 Å²	55.2	30%	0.298	30%	0.295	S	S	.	.	H	α-helix	trans	-82.9	-17.5	177.3	-72.7	-87	0	0	0	113.3	V105 I129 V130 A131 N177 M178	V105-Y133 VanDerWaalsContact CG1-O 3.24Å; V105-Y133 WeakPolarHBondContact CG1-O 3.35Å; I129-Y133 HydrophobicContact CG2-CE2 4.23Å; I129-Y133 WeakPolarHBondContact O-CD2 3.19Å; V130-Y133 PolarHBondContact O-N 2.86Å; A131-Y133 VanDerWaalsContact C-N 3.33Å; Y133-N177 HydrophobicContact CD1-CB 4.36Å; Y133-N177 WeakPolarHBondContact CD1-O 3.45Å; Y133-N177 WeakPolarHBondContact CE1-O 3.32Å; Y133-M178 HydrophobicContact CG-CB 4.4Å
134	I	85.6	Confident	88.5	Confident	16 Å²	16	55.1 Å²	55.1	8%	0.082	30%	0.295	C	S	.	.	S	Bend	trans	-103.6	7.4	-175.1	-61.2	169.9	0	0	0	111.3	V105 Q108 I110 F123 V130 A131 T175	V105-I134 HydrophobicContact CG2-CG2 4.22Å; Q108-I134 HydrophobicContact CG-CG2 3.44Å; Q108-I134 VanDerWaalsContact CG-CG2 3.44Å; I110-I134 HydrophobicContact CD1-CD1 4.29Å; I110-I134 HydrophobicContact CG2-CD1 3.78Å; F123-I134 HydrophobicContact CZ-CD1 4.31Å; V130-I134 HydrophobicContact CG1-CD1 3.58Å; V130-I134 PolarHBondContact O-N 2.82Å; A131-I134 PolarHBondContact O-N 3.03Å; I134-T175 HydrophobicContact CG1-CG2 4.3Å
135	Q	77.7	Confident	89.4	Confident	123 Å²	123	54.2 Å²	54.2	58%	0.575	29%	0.289	S	S	*	.			trans	-65	152	176.5	-56.4	-171.7	-4.5	0	0	111.1	A131	A131-Q135 WeakPolarHBondContact O-CG 3.45Å; A131-Q135 PolarHBondContact O-N 3.47Å
136	E	83	Confident	90.3	Very high	160 Å²	160	52.1 Å²	52.1	75%	0.748	27%	0.272	S	S	*	.	S	Bend	trans	58	54.8	175.2	-52.5	-174.7	162.4	0	0	114.9	P104	P104-E136 WeakPolarHBondContact CB-O 3.25Å
137	P	92.4	Very high	91.2	Very high	71 Å²	71	50.3 Å²	50.3	46%	0.461	26%	0.262	S	S	.	.			trans	-61.3	139.9	176.8	23.8	-32.1	0	0	0	112.5	V105 P107	V105-P137 HydrophobicContact CG2-CB 4.42Å; V105-P137 WeakPolarHBondContact O-CA 3.49Å; P107-P137 HydrophobicContact CB-CB 4.38Å
138	N	96.8	Very high	92	Very high	80 Å²	80	47.6 Å²	47.6	43%	0.428	25%	0.248	S	C	.	.			trans	-143	145	176.3	-160	-53.9	0	0	0	110.5	P104 V105 P107 D140 C141	P104-N138 HydrophobicContact CB-CB 3.56Å; P104-N138 HydrophobicContact CG-CB 4.2Å; V105-N138 PolarHBondContact O-N 3.45Å; P107-N138 WeakPolarHBondContact CD-O 3.45Å; N138-D140 PolarHBondContact O-N 3.37Å; N138-D140 PolarHBondContact OD1-N 3.32Å; N138-C141 WeakPolarHBondContact O-CB 3.43Å
139	E	98	Very high	92.6	Very high	31 Å²	31	41 Å²	41	15%	0.145	21%	0.213	C	C	.	.	S	Bend	trans	-66.6	-26.6	174.1	-74.7	-179.9	-123.2	0	0	112.7	P78 I79 R83 P107 C141 L202 A317	P78-E139 WeakPolarHBondContact CD-O 3.49Å; P78-E139 WeakPolarHBondContact CG-O 3.34Å; I79-E139 HydrophobicContact CG2-CB 3.65Å; R83-E139 IonicContact CZ-OE1 3.46Å; R83-E139 IonicContact CZ-OE2 3.73Å; R83-E139 IonicContact NE-OE1 3.66Å; R83-E139 IonicContact NE-OE2 3.84Å; R83-E139 PolarHBondContact NE-OE2 3.25Å; R83-E139 IonicContact NH2-OE1 2.73Å; R83-E139 PolarHBondContact NH2-OE1 2.89Å; R83-E139 IonicContact NH2-OE2 3.31Å; R83-E139 PolarHBondContact NH2-OE2 3.23Å; P107-E139 HydrophobicContact CG-CG 3.91Å; E139-C141 VanDerWaalsContact C-N 3.28Å; E139-C141 PolarHBondContact O-N 3.43Å; E139-L202 HydrophobicContact CG-CD1 4.01Å; E139-A317 HydrophobicContact CG-CB 3.63Å; E139-A317 WeakPolarHBondContact OE1-CB 3.32Å
140	D	98	Very high	93	Very high	47 Å²	47	38.5 Å²	38.5	25%	0.251	20%	0.203	S	C	.	.			trans	-74.7	84	163.8	-174.3	-1.2	0	0	0	109.2	P77 N138 Y143	P77-D140 HydrophobicContact CB-CB 3.97Å; P77-D140 HydrophobicContact CG-CB 4.33Å; N138-D140 PolarHBondContact O-N 3.37Å; N138-D140 PolarHBondContact OD1-N 3.32Å; D140-Y143 VanDerWaalsContact CG-OH 3.29Å; D140-Y143 WeakPolarHBondContact O-CE2 3.32Å; D140-Y143 VanDerWaalsContact OD1-CE2 3.25Å; D140-Y143 WeakPolarHBondContact OD1-CE2 3.42Å; D140-Y143 PolarHBondContact OD1-OH 3.19Å; D140-Y143 PolarHBondContact OD2-OH 2.92Å
141	C	98.3	Very high	92.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.			trans	-131.5	4.6	-175.5	67	0	0	0	0	115.2	C106 N138 E139 Y143 N196	C106-C141 VanDerWaalsContact CA-CB 3.47Å; C106-C141 WeakPolarHBondContact CA-SG 3.45Å; C106-C141 HydrophobicContact CB-CB 3.82Å; C106-C141 WeakPolarHBondContact CB-SG 3.23Å; C106-C141 WeakPolarHBondContact SG-CB 3.27Å; C106-C141 CovalentContact SG-SG 2.04Å; C106-C141 PolarHBondContact SG-SG 3.44Å; N138-C141 WeakPolarHBondContact O-CB 3.43Å; E139-C141 VanDerWaalsContact C-N 3.28Å; E139-C141 PolarHBondContact O-N 3.43Å; C141-Y143 VanDerWaalsContact C-N 3.3Å; C141-Y143 PolarHBondContact O-N 2.88Å; C141-N196 VanDerWaalsContact O-CB 3.28Å; C141-N196 WeakPolarHBondContact O-CB 3.3Å
142	L	98.8	Very high	92.1	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.246	C	C	.	.			trans	-81.6	74.4	-175	-57.5	-172.4	0	0	0	112.4	Y74 A75 P78 P87 R198 D220	Y74-L142 WeakPolarHBondContact CD1-O 3.27Å; Y74-L142 HydrophobicContact CE1-CB 4.17Å; Y74-L142 HydrophobicContact CE2-CB 4.14Å; Y74-L142 PolarHBondContact N-O 2.83Å; Y74-L142 WeakPolarHBondContact OH-CD2 3.36Å; A75-L142 HydrophobicContact CB-CB 3.91Å; A75-L142 HydrophobicContact CB-CD1 3.61Å; A75-L142 HydrophobicContact CB-CG 4.43Å; P78-L142 HydrophobicContact CB-CD1 4.31Å; P78-L142 HydrophobicContact CG-CD1 3.87Å; P78-L142 HydrophobicContact CG-CG 4.01Å; P87-L142 HydrophobicContact CB-CD1 4.11Å; L142-R198 HydrophobicContact CD2-CG 4.14Å; L142-D220 HydrophobicContact CD2-CB 4.18Å; L142-D220 WeakPolarHBondContact CD2-OD2 3.26Å
143	Y	98.8	Very high	91	Very high	20 Å²	20	47 Å²	47	8%	0.078	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	154	-176.7	-62.1	-87.8	0	0	0	112.2	G71 V72 P73 Y74 P103 D140 C141 N196	G71-Y143 WeakPolarHBondContact O-CD1 3.38Å; V72-Y143 CarbonylContact O-C 3.58Å; V72-Y143 VanDerWaalsContact O-CA 3.31Å; V72-Y143 WeakPolarHBondContact O-CA 3.07Å; P73-Y143 HydrophobicContact CB-CD1 3.99Å; P73-Y143 HydrophobicContact CB-CE1 3.77Å; P73-Y143 HydrophobicContact CG-CE1 4.44Å; Y74-Y143 VanDerWaalsContact CD1-C 3.48Å; Y74-Y143 VanDerWaalsContact CE1-N 3.34Å; Y74-Y143 WeakPolarHBondContact CE1-O 3.24Å; P103-Y143 HydrophobicContact CB-CD1 4.09Å; P103-Y143 HydrophobicContact CB-CD2 3.51Å; P103-Y143 HydrophobicContact CB-CE1 4.49Å; P103-Y143 HydrophobicContact CB-CE2 4Å; P103-Y143 HydrophobicContact CB-CG 3.61Å; P103-Y143 VanDerWaalsContact CG-CB 3.42Å; P103-Y143 HydrophobicContact CG-CD1 4.33Å; P103-Y143 HydrophobicContact CG-CD2 3.77Å; P103-Y143 HydrophobicContact CG-CG 3.58Å; D140-Y143 VanDerWaalsContact CG-OH 3.29Å; D140-Y143 WeakPolarHBondContact O-CE2 3.32Å; D140-Y143 VanDerWaalsContact OD1-CE2 3.25Å; D140-Y143 WeakPolarHBondContact OD1-CE2 3.42Å; D140-Y143 PolarHBondContact OD1-OH 3.19Å; D140-Y143 PolarHBondContact OD2-OH 2.92Å; C141-Y143 VanDerWaalsContact C-N 3.3Å; C141-Y143 PolarHBondContact O-N 2.88Å; Y143-N196 PolarHBondContact O-N 3.27Å
144	L	98.8	Very high	89.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	162.2	171.4	60.8	80.2	0	0	0	111.4	G71 V72 Y74 V146 I193 T194 L195 A224 W227 V228	G71-L144 PolarHBondContact N-O 2.87Å; V72-L144 HydrophobicContact CB-CD1 3.87Å; V72-L144 HydrophobicContact CB-CG 4.44Å; V72-L144 HydrophobicContact CG1-CD1 4.31Å; V72-L144 HydrophobicContact CG2-CD1 4.5Å; V72-L144 PolarHBondContact N-O 2.95Å; V72-L144 PolarHBondContact O-N 3.48Å; Y74-L144 HydrophobicContact CD1-CB 4.06Å; Y74-L144 HydrophobicContact CD1-CD2 3.98Å; Y74-L144 HydrophobicContact CD1-CG 4.09Å; Y74-L144 HydrophobicContact CG-CD2 4.11Å; L144-V146 HydrophobicContact CD1-CG2 3.52Å; L144-I193 HydrophobicContact CB-CG2 4.16Å; L144-I193 HydrophobicContact CD1-CG2 4.24Å; L144-I193 HydrophobicContact CD2-CG2 4.46Å; L144-T194 CarbonylContact C-O 3.56Å; L144-T194 VanDerWaalsContact CA-O 3.26Å; L144-T194 WeakPolarHBondContact CA-O 3.36Å; L144-T194 WeakPolarHBondContact CB-O 3.44Å; L144-L195 HydrophobicContact CB-CB 3.89Å; L144-A224 HydrophobicContact CD2-CB 4.43Å; L144-W227 HydrophobicContact CD1-CE3 4.19Å; L144-W227 HydrophobicContact CD1-CH2 4.16Å; L144-W227 HydrophobicContact CD1-CZ3 3.75Å; L144-W227 HydrophobicContact CD2-CD2 4.15Å; L144-W227 HydrophobicContact CD2-CE3 3.6Å; L144-W227 HydrophobicContact CD2-CZ3 4.03Å; L144-W227 HydrophobicContact CG-CE3 4.45Å; L144-W227 HydrophobicContact CG-CZ3 4.48Å; L144-V228 HydrophobicContact CD2-CG2 4.2Å
145	N	98.8	Very high	88.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132	178.9	-52	-57.2	0	0	0	108.5	Y69 L70 G71 Y147 N177 I193 T194	Y69-N145 CarbonylContact O-C 3.54Å; Y69-N145 WeakPolarHBondContact O-CA 3.49Å; L70-N145 WeakPolarHBondContact CA-OD1 3.38Å; L70-N145 HydrophobicContact CD2-CB 3.87Å; G71-N145 PolarHBondContact N-OD1 3.2Å; N145-Y147 HydrophobicContact CB-CE2 3.83Å; N145-N177 PolarHBondContact ND2-OD1 3.44Å; N145-I193 VanDerWaalsContact O-CA 3.23Å; N145-I193 WeakPolarHBondContact O-CA 3.28Å; N145-T194 PolarHBondContact N-O 2.99Å; N145-T194 PolarHBondContact ND2-OG1 3.21Å; N145-T194 VanDerWaalsContact ND2-OG1 3.07Å; N145-T194 PolarHBondContact O-N 2.85Å
146	V	98.8	Very high	88.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.2	-179.3	-169.9	0	0	0	0	109.8	Q68 Y69 L144 V148 I191 I193 I232 F235	Q68-V146 WeakPolarHBondContact CA-O 3.34Å; Y69-V146 HydrophobicContact CD2-CB 4.47Å; Y69-V146 PolarHBondContact N-O 3.28Å; Y69-V146 PolarHBondContact O-N 3.36Å; L144-V146 HydrophobicContact CD1-CG2 3.52Å; V146-V148 HydrophobicContact CG1-CG2 3.81Å; V146-I191 HydrophobicContact CG1-CG2 3.69Å; V146-I193 HydrophobicContact CG1-CG1 4.32Å; V146-I193 HydrophobicContact CG2-CG1 4.46Å; V146-I232 HydrophobicContact CG1-CD1 4.14Å; V146-F235 HydrophobicContact CB-CD1 4.39Å; V146-F235 HydrophobicContact CB-CE1 4.25Å; V146-F235 HydrophobicContact CG1-CD1 3.9Å; V146-F235 HydrophobicContact CG1-CE1 4.24Å; V146-F235 HydrophobicContact CG1-CG 4.32Å; V146-F235 HydrophobicContact CG2-CE1 4.26Å; V146-F235 HydrophobicContact CG2-CZ 4.45Å
147	Y	98.8	Very high	87.4	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	108.1	179.2	-59.2	-96.4	0	0	0	108.8	V66 Q68 L70 N145 D180 S182 I191 V192 T194	V66-Y147 HydrophobicContact CG1-CD1 4.45Å; Q68-Y147 HydrophobicContact CG-CD1 3.89Å; Q68-Y147 HydrophobicContact CG-CE1 4.15Å; L70-Y147 HydrophobicContact CD2-CE1 4.27Å; N145-Y147 HydrophobicContact CB-CE2 3.83Å; Y147-D180 WeakPolarHBondContact CE1-OD1 3.08Å; Y147-S182 VanDerWaalsContact CD1-OG 3.27Å; Y147-S182 WeakPolarHBondContact CD1-OG 3.48Å; Y147-I191 WeakPolarHBondContact O-CA 3.18Å; Y147-V192 WeakPolarHBondContact CD2-O 3.35Å; Y147-V192 PolarHBondContact N-O 2.64Å; Y147-V192 PolarHBondContact O-N 3.46Å; Y147-T194 HydrophobicContact CE2-CG2 4.24Å
148	V	98.2	Very high	86.9	Confident	16 Å²	16	56 Å²	56	10%	0.097	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.6	-174.9	-173.5	0	0	0	0	109.8	V66 D67 Y69 V146 I191 F235	V66-V148 CarbonylContact C-O 3.5Å; V66-V148 WeakPolarHBondContact CA-O 3.4Å; V66-V148 WeakPolarHBondContact CG1-O 3.41Å; D67-V148 HydrophobicContact CB-CB 4.31Å; D67-V148 PolarHBondContact N-O 3.47Å; D67-V148 PolarHBondContact O-N 3.43Å; Y69-V148 HydrophobicContact CD2-CG2 4.38Å; Y69-V148 HydrophobicContact CE2-CG2 4.16Å; V146-V148 HydrophobicContact CG1-CG2 3.81Å; V148-I191 HydrophobicContact CG1-CD1 4.35Å; V148-I191 HydrophobicContact CG1-CG1 4.31Å; V148-I191 HydrophobicContact CG2-CD1 4.39Å; V148-I191 HydrophobicContact CG2-CG1 4.46Å; V148-I191 HydrophobicContact CG2-CG2 4.43Å; V148-F235 HydrophobicContact CG2-CB 4.09Å; V148-F235 HydrophobicContact CG2-CD1 4.12Å
149	P	95.8	Very high	86.7	Confident	6 Å²	6	54.4 Å²	54.4	4%	0.039	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	137.9	175.7	29.5	-32.1	0	0	0	110.2	K160 A185 V190	P149-K160 HydrophobicContact CG-CD 3.67Å; P149-A185 WeakPolarHBondContact CB-O 3.39Å; P149-A185 WeakPolarHBondContact CG-O 3.31Å; P149-V190 VanDerWaalsContact CD-O 3.28Å; P149-V190 WeakPolarHBondContact CD-O 3.44Å
150	T	91.5	Very high	86.6	Confident	41 Å²	41	54 Å²	54	25%	0.252	29%	0.29	S	S	.	.			trans	-85	-14.7	-176.6	61.9	0	0	0	0	114.2	P65	P65-T150 WeakPolarHBondContact CD-OG1 3.16Å; P65-T150 HydrophobicContact CG-CG2 4.33Å; P65-T150 WeakPolarHBondContact CG-OG1 3.31Å; P65-T150 WeakPolarHBondContact O-CB 3.21Å; P65-T150 VanDerWaalsContact O-CG2 3.23Å; P65-T150 WeakPolarHBondContact O-CG2 3.13Å; P65-T150 PolarHBondContact O-N 3.4Å; P65-T150 PolarHBondContact O-OG1 2.88Å
151	E	80.3	Confident	86.5	Confident	106 Å²	106	53.2 Å²	53.2	50%	0.495	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-81.5	134.1	180	-66.4	-171.8	178.1	0	0	110.8	G64 K160 N189	G64-E151 VanDerWaalsContact CA-OE1 3.27Å; G64-E151 WeakPolarHBondContact CA-OE1 3.2Å; G64-E151 PolarHBondContact N-OE1 2.9Å; E151-K160 PolarHBondContact O-NZ 2.89Å; E151-N189 PolarHBondContact O-OD1 3.27Å
152	D	70.3	Confident	86.6	Confident	134 Å²	134	53.2 Å²	53.2	72%	0.717	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-78.3	132.7	167	-69.1	-36.4	0	0	0	108.5	I154	D152-I154 PolarHBondContact O-N 3.13Å
153	D	65.8	Low	86.6	Confident	57 Å²	57	54.7 Å²	54.7	31%	0.305	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-69.3	124.4	170.3	-152.3	-44.4	0	0	0	108.5	R155 D156 S157 N189	D153-R155 PolarHBondContact O-N 2.88Å; D153-R155 WeakPolarHBondContact OD1-CB 3.43Å; D153-R155 PolarHBondContact OD1-N 2.76Å; D153-D156 HydrophobicContact CB-CB 4.15Å; D153-D156 VanDerWaalsContact CB-O 3.27Å; D153-D156 WeakPolarHBondContact CB-O 3.26Å; D153-D156 CarbonylContact O-C 3.46Å; D153-D156 PolarHBondContact O-N 2.9Å; D153-S157 PolarHBondContact O-N 2.85Å; D153-N189 WeakPolarHBondContact CA-ND2 3.37Å; D153-N189 WeakPolarHBondContact CB-ND2 3.34Å; D153-N189 PolarHBondContact N-ND2 3.46Å; D153-N189 PolarHBondContact OD2-ND2 2.86Å
154	I	62.4	Low	86.6	Confident	175 Å²	175	53.8 Å²	53.8	90%	0.897	29%	0.291	S	S	*	.	S	Bend	trans	-63.3	-21.9	173	-57.4	172.8	0	0	0	110.2	D152	D152-I154 PolarHBondContact O-N 3.13Å
155	R	62.3	Low	86.6	Confident	239 Å²	239	54.7 Å²	54.7	90%	0.902	30%	0.295	S	S	*	.	S	Bend	trans	-95.9	-23.9	-179.8	-58.1	-179	176.9	-175.6	0.6	114.3	D153	D153-R155 PolarHBondContact O-N 2.88Å; D153-R155 WeakPolarHBondContact OD1-CB 3.43Å; D153-R155 PolarHBondContact OD1-N 2.76Å
156	D	65.6	Low	86.6	Confident	69 Å²	69	54.8 Å²	54.8	37%	0.369	30%	0.295	S	S	.	.			trans	-143.1	85.8	-180	-172.8	6.9	0	0	0	110.1	D153 G158 R241	D153-D156 HydrophobicContact CB-CB 4.15Å; D153-D156 VanDerWaalsContact CB-O 3.27Å; D153-D156 WeakPolarHBondContact CB-O 3.26Å; D153-D156 CarbonylContact O-C 3.46Å; D153-D156 PolarHBondContact O-N 2.9Å; D156-G158 PolarHBondContact O-N 2.85Å; D156-G158 PolarHBondContact OD1-N 2.89Å; D156-G158 VanDerWaalsContact OD1-N 3.13Å; D156-R241 IonicContact OD2-NH1 3.66Å; D156-R241 IonicContact OD2-NH2 3.23Å; D156-R241 PolarHBondContact OD2-NH2 2.92Å
157	S	66.3	Low	86.5	Confident	114 Å²	114	54.9 Å²	54.9	80%	0.797	30%	0.296	S	S	*	.			trans	-78.3	13.7	176.2	69.6	0	0	0	0	113.1	D153	D153-S157 PolarHBondContact O-N 2.85Å
158	G	81.9	Confident	86	Confident	39 Å²	39	55.1 Å²	55.1	40%	0.402	30%	0.299	S	S	.	.	S	Bend	trans	-85.1	-178.6	-178.3	0	0	0	0	0	113.9	D156 K160	D156-G158 PolarHBondContact O-N 2.85Å; D156-G158 PolarHBondContact OD1-N 2.89Å; D156-G158 VanDerWaalsContact OD1-N 3.13Å; G158-K160 PolarHBondContact O-N 2.79Å
159	A	92.6	Very high	85.4	Confident	46 Å²	46	54.6 Å²	54.6	38%	0.38	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-61.9	129.6	172.3	0	0	0	0	0	110	G236 D238 R241	A159-G236 CarbonylContact C-O 3.5Å; A159-G236 WeakPolarHBondContact CA-O 3.34Å; A159-D238 HydrophobicContact CB-CB 3.86Å; A159-R241 PolarHBondContact O-NH2 3.16Å
160	K	95.7	Very high	84.9	Confident	21 Å²	21	54.5 Å²	54.5	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.4	-167.9	-59.1	-178.9	-172.1	-71.7	0	112.5	P149 E151 G158 N189 I191 G236 G237 D238	P149-K160 HydrophobicContact CG-CD 3.67Å; E151-K160 PolarHBondContact O-NZ 2.89Å; G158-K160 PolarHBondContact O-N 2.79Å; K160-N189 PolarHBondContact NZ-OD1 3.45Å; K160-I191 HydrophobicContact CB-CG1 4.26Å; K160-I191 HydrophobicContact CD-CG1 4.45Å; K160-G236 PolarHBondContact N-O 2.82Å; K160-G237 CarbonylContact O-C 3.51Å; K160-G237 WeakPolarHBondContact O-CA 3.39Å; K160-D238 PolarHBondContact O-N 2.7Å
161	P	97.8	Very high	85	Confident	32 Å²	32	52.6 Å²	52.6	21%	0.208	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	154.2	167.3	-16.4	27.9	0	0	0	111.6	V190 I191 R241	P161-V190 HydrophobicContact CB-CB 4.5Å; P161-V190 HydrophobicContact CB-CG1 3.86Å; P161-V190 HydrophobicContact CG-CG1 3.97Å; P161-I191 PolarHBondContact O-N 3.45Å; P161-R241 HydrophobicContact CB-CB 4.43Å
162	V	98.8	Very high	85.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	126	-178.1	-174.9	0	0	0	0	109.1	V164 I191 I193 V228 I232 R241 I242 T243	V162-V164 HydrophobicContact CG1-CG2 4.09Å; V162-I191 CarbonylContact C-O 3.5Å; V162-I191 WeakPolarHBondContact CA-O 3.28Å; V162-I191 HydrophobicContact CG2-CB 4.43Å; V162-I193 HydrophobicContact CG1-CD1 3.71Å; V162-I193 HydrophobicContact CG1-CG1 4.18Å; V162-V228 HydrophobicContact CG1-CG1 4.04Å; V162-I232 HydrophobicContact CG1-CG1 4.03Å; V162-I232 HydrophobicContact CG2-CB 4.45Å; V162-I232 HydrophobicContact CG2-CG1 3.63Å; V162-I232 HydrophobicContact CG2-CG2 4.02Å; V162-R241 PolarHBondContact N-O 3.2Å; V162-I242 HydrophobicContact CB-CG1 4.13Å; V162-I242 CarbonylContact O-C 3.53Å; V162-I242 WeakPolarHBondContact O-CA 3.32Å; V162-T243 PolarHBondContact O-N 2.72Å
163	M	98.9	Very high	86.6	Confident	31 Å²	31	44.2 Å²	44.2	15%	0.153	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.9	175.4	-64.3	-169.4	70.5	0	0	109.8	L184 V190 I191 V192 I193 T243 F245 I271	M163-L184 HydrophobicContact CE-CD2 4.48Å; M163-L184 HydrophobicContact SD-CD2 4.19Å; M163-V190 HydrophobicContact CG-CG2 4.28Å; M163-V190 HydrophobicContact SD-CG2 4.04Å; M163-I191 PolarHBondContact N-O 2.97Å; M163-V192 CarbonylContact O-C 3.57Å; M163-V192 WeakPolarHBondContact O-CA 3.43Å; M163-I193 PolarHBondContact O-N 2.83Å; M163-T243 CarbonylContact C-O 3.55Å; M163-T243 VanDerWaalsContact CA-O 3.32Å; M163-T243 WeakPolarHBondContact CA-O 3.49Å; M163-F245 HydrophobicContact CB-CD1 4.23Å; M163-F245 HydrophobicContact CB-CE1 3.8Å; M163-F245 HydrophobicContact CE-CD1 4.14Å; M163-F245 HydrophobicContact CE-CE1 4.19Å; M163-F245 HydrophobicContact CE-CG 4.36Å; M163-F245 HydrophobicContact CE-CZ 4.42Å; M163-I271 HydrophobicContact CE-CD1 4.04Å
164	V	98.9	Very high	87.8	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	112.8	-178	-174.3	0	0	0	0	109.4	V162 I193 L195 L225 V228 I242 T243 V244 F245	V162-V164 HydrophobicContact CG1-CG2 4.09Å; V164-I193 HydrophobicContact CG1-CB 4.45Å; V164-I193 HydrophobicContact CG1-CG2 4.45Å; V164-I193 HydrophobicContact CG2-CB 4.27Å; V164-I193 HydrophobicContact CG2-CD1 4.32Å; V164-L195 HydrophobicContact CG1-CD2 3.71Å; V164-L225 HydrophobicContact CB-CD2 4.24Å; V164-L225 HydrophobicContact CG1-CD2 4.05Å; V164-L225 HydrophobicContact CG2-CD2 4.23Å; V164-V228 HydrophobicContact CG2-CG1 4.22Å; V164-I242 HydrophobicContact CG2-CG2 3.93Å; V164-T243 PolarHBondContact N-O 2.78Å; V164-V244 CarbonylContact O-C 3.41Å; V164-V244 WeakPolarHBondContact O-CA 3.28Å; V164-F245 VanDerWaalsContact O-CD1 3.31Å; V164-F245 WeakPolarHBondContact O-CD1 3.32Å; V164-F245 PolarHBondContact O-N 2.89Å
165	Y	98.9	Very high	89.4	Confident	21 Å²	21	33.3 Å²	33.3	8%	0.082	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.9	-179.5	-174.5	-107.7	0	0	0	111.8	H167 I179 I193 T194 F245	Y165-H167 HydrophobicContact CD1-CB 4.48Å; Y165-H167 HydrophobicContact CE1-CB 3.88Å; Y165-I179 HydrophobicContact CD1-CB 4.31Å; Y165-I179 HydrophobicContact CD1-CG1 3.99Å; Y165-I179 HydrophobicContact CD1-CG2 4.4Å; Y165-I179 HydrophobicContact CE1-CB 4.29Å; Y165-I179 HydrophobicContact CE1-CD1 4.41Å; Y165-I179 HydrophobicContact CE1-CG1 3.47Å; Y165-I179 VanDerWaalsContact CE1-CG1 3.47Å; Y165-I193 PolarHBondContact N-O 3.32Å; Y165-T194 HydrophobicContact CD1-CG2 4.46Å; Y165-F245 CarbonylContact C-O 3.49Å; Y165-F245 VanDerWaalsContact CA-O 3.28Å; Y165-F245 WeakPolarHBondContact CA-O 3.48Å; Y165-F245 HydrophobicContact CD2-CD1 4.3Å; Y165-F245 AromaticContact CD2-CD2 3.66Å; Y165-F245 HydrophobicContact CD2-CD2 3.66Å; Y165-F245 HydrophobicContact CD2-CE1 4.06Å; Y165-F245 AromaticContact CD2-CE2 3.4Å; Y165-F245 HydrophobicContact CD2-CE2 3.4Å; Y165-F245 VanDerWaalsContact CD2-CE2 3.4Å; Y165-F245 HydrophobicContact CD2-CG 4.1Å; Y165-F245 AromaticContact CD2-CZ 3.61Å; Y165-F245 HydrophobicContact CD2-CZ 3.61Å; Y165-F245 HydrophobicContact CE2-CD2 4.26Å; Y165-F245 HydrophobicContact CE2-CE2 4.1Å; Y165-F245 HydrophobicContact CG-CE1 4.3Å; Y165-F245 HydrophobicContact CG-CE2 4.26Å; Y165-F245 HydrophobicContact CG-CZ 4.01Å
166	I	98.8	Very high	91	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.5	170	-56.2	-177.3	0	0	0	107.8	L195 Y197 Q221 V244 F245 G246 G250 C253 V254 L257	I166-L195 HydrophobicContact CG1-CD2 4.39Å; I166-Y197 HydrophobicContact CG2-CD1 4.42Å; I166-Y197 HydrophobicContact CG2-CE1 3.84Å; I166-Q221 HydrophobicContact CD1-CB 4.37Å; I166-Q221 HydrophobicContact CD1-CG 4.3Å; I166-Q221 HydrophobicContact CG2-CG 4.39Å; I166-V244 HydrophobicContact CD1-CG1 3.58Å; I166-V244 HydrophobicContact CG1-CG1 3.9Å; I166-F245 PolarHBondContact N-O 3.23Å; I166-G246 VanDerWaalsContact O-CA 3.29Å; I166-G246 WeakPolarHBondContact O-CA 3.48Å; I166-G250 WeakPolarHBondContact O-CA 3.26Å; I166-C253 HydrophobicContact CG2-CB 3.86Å; I166-V254 HydrophobicContact CB-CG2 4.44Å; I166-V254 HydrophobicContact CD1-CG2 4.02Å; I166-V254 HydrophobicContact CG1-CG2 4.44Å; I166-L257 HydrophobicContact CD1-CD1 3.39Å
167	H	96.5	Very high	92.4	Very high	2 Å²	2	19 Å²	19	1%	0.009	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-70.1	153.9	-179.9	70.8	82.1	0	0	0	112.3	Y165 T175 G176 M178 L195 Y197 G250	Y165-H167 HydrophobicContact CD1-CB 4.48Å; Y165-H167 HydrophobicContact CE1-CB 3.88Å; H167-T175 VanDerWaalsContact CD2-C 3.42Å; H167-G176 PolarHBondContact CD2-N 2.89Å; H167-M178 HydrophobicContact CB-CE 3.68Å; H167-L195 PolarHBondContact CD2-O 2.97Å; H167-Y197 AromaticContact CD2-CE1 3.7Å; H167-Y197 AromaticContact CE1-CE1 3.55Å; H167-Y197 AromaticContact CE1-CZ 3.77Å; H167-Y197 AromaticContact ND1-CE1 3.97Å; H167-Y197 AromaticContact NE2-CD1 3.7Å; H167-Y197 AromaticContact NE2-CE1 3.39Å; H167-Y197 WeakPolarHBondContact NE2-CE1 3.39Å; H167-Y197 PolarHBondContact O-OH 3.05Å; H167-Y197 VanDerWaalsContact O-OH 3.05Å; H167-G250 WeakPolarHBondContact O-CA 3.2Å
168	G	88.3	Confident	93.7	Very high	7 Å²	7	14.3 Å²	14.3	7%	0.072	9%	0.092	C	C	.	.			trans	-93.9	-152.1	169.7	0	0	0	0	0	112.7
169	G	85.4	Confident	94.2	Very high	4 Å²	4	14.7 Å²	14.7	4%	0.041	9%	0.085	C	C	.	.	S	Bend	trans	133.1	-143.8	-164.4	0	0	0	0	0	107.2	L119 I249	L119-G169 VanDerWaalsContact CD2-C 3.46Å; G169-I249 WeakPolarHBondContact O-CB 3.46Å; G169-I249 WeakPolarHBondContact O-CG1 3.35Å
170	S	84.9	Confident	94.4	Very high	5 Å²	5	16.8 Å²	16.8	4%	0.035	9%	0.09	C	C	.	.	S	Bend	trans	-117.8	26.3	169.2	64.8	0	0	0	0	112.7	M172 E173	S170-M172 PolarHBondContact O-N 2.83Å; S170-M172 VanDerWaalsContact O-N 3.17Å; S170-E173 VanDerWaalsContact CB-OE1 3.25Å; S170-E173 WeakPolarHBondContact CB-OE1 3.27Å; S170-E173 PolarHBondContact N-OE1 3.05Å; S170-E173 VanDerWaalsContact OG-CD 3.25Å; S170-E173 PolarHBondContact OG-OE1 2.85Å; S170-E173 PolarHBondContact OG-OE2 2.8Å
171	Y	93.8	Very high	94.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.086	C	C	.	.	S	Bend	trans	66.6	-13.9	-159.3	-58.5	-76.7	0	0	0	114.8	V199 G200 F204 I249 S252 C253 W281 A282 V332 P336	Y171-V199 CarbonylContact O-C 3.32Å; Y171-V199 WeakPolarHBondContact O-CA 3.32Å; Y171-V199 WeakPolarHBondContact O-CB 3.18Å; Y171-G200 PolarHBondContact O-N 2.64Å; Y171-F204 HydrophobicContact CD1-CE1 4.3Å; Y171-F204 AromaticContact CD1-CE2 3.91Å; Y171-F204 HydrophobicContact CD1-CE2 3.91Å; Y171-F204 AromaticContact CD1-CZ 3.68Å; Y171-F204 HydrophobicContact CD1-CZ 3.68Å; Y171-F204 HydrophobicContact CE1-CZ 4.37Å; Y171-F204 HydrophobicContact CG-CE2 4.31Å; Y171-F204 HydrophobicContact CG-CZ 4.47Å; Y171-I249 HydrophobicContact CD1-CG2 3.38Å; Y171-I249 HydrophobicContact CD2-CD1 3.96Å; Y171-I249 HydrophobicContact CD2-CG1 4.26Å; Y171-I249 HydrophobicContact CD2-CG2 3.86Å; Y171-I249 HydrophobicContact CE1-CG2 3.3Å; Y171-I249 HydrophobicContact CE2-CD1 3.43Å; Y171-I249 VanDerWaalsContact CE2-CD1 3.43Å; Y171-I249 HydrophobicContact CE2-CG1 4.12Å; Y171-I249 HydrophobicContact CE2-CG2 3.77Å; Y171-I249 HydrophobicContact CG-CG2 3.66Å; Y171-I249 VanDerWaalsContact CZ-CG2 3.47Å; Y171-S252 VanDerWaalsContact OH-CB 3.29Å; Y171-S252 WeakPolarHBondContact OH-CB 3.32Å; Y171-C253 VanDerWaalsContact CE1-SG 3.57Å; Y171-W281 WeakPolarHBondContact CE2-O 3.42Å; Y171-A282 PolarHBondContact OH-O 3.34Å; Y171-V332 HydrophobicContact CD2-CG1 4.19Å; Y171-P336 HydrophobicContact CD1-CG 4.36Å; Y171-P336 HydrophobicContact CE1-CG 3.62Å; Y171-P336 HydrophobicContact CE2-CG 4.45Å
172	M	92.6	Very high	94.5	Very high	61 Å²	61	14.3 Å²	14.3	30%	0.3	8%	0.076	S	C	.	.	S	Bend	trans	-92.4	-20.8	-176.3	-59.5	-64.7	-62.1	0	0	113.6	Q108 S170 G200 F334	Q108-M172 WeakPolarHBondContact CB-O 3.23Å; S170-M172 PolarHBondContact O-N 2.83Å; S170-M172 VanDerWaalsContact O-N 3.17Å; M172-G200 WeakPolarHBondContact SD-CA 3.35Å; M172-F334 HydrophobicContact CE-CD2 4.18Å; M172-F334 HydrophobicContact SD-CB 3.88Å; M172-F334 HydrophobicContact SD-CD2 4.14Å
173	E	91.6	Very high	94.4	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.019	9%	0.092	C	C	.	.	S	Bend	trans	-147.2	172.8	-177.4	65.2	-73.6	142.5	0	0	112	Q108 I110 L119 F123 S170	Q108-E173 HydrophobicContact CB-CB 4.3Å; Q108-E173 VanDerWaalsContact OE1-CA 3.24Å; Q108-E173 VanDerWaalsContact OE1-CB 3.25Å; I110-E173 HydrophobicContact CG2-CB 3.89Å; I110-E173 HydrophobicContact CG2-CG 4.25Å; L119-E173 WeakPolarHBondContact CD2-OE1 3.41Å; F123-E173 HydrophobicContact CE1-CG 4.31Å; F123-E173 HydrophobicContact CZ-CG 3.9Å; S170-E173 VanDerWaalsContact CB-OE1 3.25Å; S170-E173 WeakPolarHBondContact CB-OE1 3.27Å; S170-E173 PolarHBondContact N-OE1 3.05Å; S170-E173 VanDerWaalsContact OG-CD 3.25Å; S170-E173 PolarHBondContact OG-OE1 2.85Å; S170-E173 PolarHBondContact OG-OE2 2.8Å
174	G	92.5	Very high	94.3	Very high	2 Å²	2	19.2 Å²	19.2	2%	0.021	10%	0.102	C	C	.	.			trans	119.2	166.9	-179	0	0	0	0	0	112.5	Q108	Q108-G174 PolarHBondContact NE2-O 2.86Å; Q108-G174 PolarHBondContact OE1-O 3.41Å
175	T	95.8	Very high	94.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.102	C	C	.	.			trans	-157.5	144.1	174.5	171.8	0	0	0	0	109.6	V105 I134 H167 N177 M178 N196	V105-T175 HydrophobicContact CG1-CG2 4.06Å; V105-T175 WeakPolarHBondContact CG1-OG1 3.34Å; I134-T175 HydrophobicContact CG1-CG2 4.3Å; H167-T175 VanDerWaalsContact CD2-C 3.42Å; T175-N177 HydrophobicContact CG2-CB 4.15Å; T175-N177 PolarHBondContact O-N 3.48Å; T175-N177 VanDerWaalsContact OG1-CB 3.31Å; T175-N177 WeakPolarHBondContact OG1-CB 3.45Å; T175-N177 PolarHBondContact OG1-N 2.93Å; T175-N177 VanDerWaalsContact OG1-N 3.1Å; T175-N177 PolarHBondContact OG1-ND2 3.45Å; T175-M178 HydrophobicContact CG2-CB 4.26Å; T175-M178 WeakPolarHBondContact O-CG 3.27Å; T175-M178 PolarHBondContact O-N 2.87Å; T175-M178 VanDerWaalsContact O-SD 3.34Å; T175-N196 PolarHBondContact OG1-OD1 3.19Å
176	G	95.8	Very high	94.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-63.3	-19.5	171	0	0	0	0	0	112.7	H167 M178 I179 T194 N196	H167-G176 PolarHBondContact CD2-N 2.89Å; G176-M178 PolarHBondContact O-N 2.87Å; G176-I179 PolarHBondContact O-N 2.81Å; G176-T194 WeakPolarHBondContact O-CB 3.39Å; G176-T194 PolarHBondContact O-OG1 3.45Å; G176-N196 PolarHBondContact N-OD1 3.42Å
177	N	94.8	Very high	93.9	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.043	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-68	-20.8	-178.6	-56.9	-15.2	0	0	0	113.1	F102 P103 Y133 N145 T175 I179	F102-N177 HydrophobicContact CD1-CB 3.87Å; F102-N177 WeakPolarHBondContact CD1-OD1 3.47Å; F102-N177 HydrophobicContact CD2-CB 4.37Å; F102-N177 HydrophobicContact CE1-CB 4.1Å; F102-N177 HydrophobicContact CG-CB 4.01Å; F102-N177 HydrophobicContact CZ-CB 4.45Å; P103-N177 PolarHBondContact O-ND2 3.47Å; Y133-N177 HydrophobicContact CD1-CB 4.36Å; Y133-N177 WeakPolarHBondContact CD1-O 3.45Å; Y133-N177 WeakPolarHBondContact CE1-O 3.32Å; N145-N177 PolarHBondContact ND2-OD1 3.44Å; T175-N177 HydrophobicContact CG2-CB 4.15Å; T175-N177 PolarHBondContact O-N 3.48Å; T175-N177 VanDerWaalsContact OG1-CB 3.31Å; T175-N177 WeakPolarHBondContact OG1-CB 3.45Å; T175-N177 PolarHBondContact OG1-N 2.93Å; T175-N177 VanDerWaalsContact OG1-N 3.1Å; T175-N177 PolarHBondContact OG1-ND2 3.45Å; N177-I179 PolarHBondContact O-N 2.86Å
178	M	92.8	Very high	93.8	Very high	15 Å²	15	29.5 Å²	29.5	7%	0.074	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-75.6	-10.3	-179.8	75.4	-160.2	-179.7	0	0	113.2	W122 F123 Y133 H167 T175 G176	W122-M178 HydrophobicContact CH2-CE 3.93Å; W122-M178 HydrophobicContact CH2-CG 4.21Å; W122-M178 HydrophobicContact CH2-SD 3.8Å; W122-M178 HydrophobicContact CZ2-CE 4.36Å; F123-M178 HydrophobicContact CD2-SD 4.47Å; F123-M178 HydrophobicContact CE2-SD 4.31Å; Y133-M178 HydrophobicContact CG-CB 4.4Å; H167-M178 HydrophobicContact CB-CE 3.68Å; T175-M178 HydrophobicContact CG2-CB 4.26Å; T175-M178 WeakPolarHBondContact O-CG 3.27Å; T175-M178 PolarHBondContact O-N 2.87Å; T175-M178 VanDerWaalsContact O-SD 3.34Å; G176-M178 PolarHBondContact O-N 2.87Å
179	I	93.1	Very high	94.2	Very high	48 Å²	48	30.5 Å²	30.5	25%	0.246	16%	0.159	C	C	.	.	S	Bend	trans	-112	114.5	179.9	-57	-54.9	0	0	0	109	Y165 G176 N177 G181 T194	Y165-I179 HydrophobicContact CD1-CB 4.31Å; Y165-I179 HydrophobicContact CD1-CG1 3.99Å; Y165-I179 HydrophobicContact CD1-CG2 4.4Å; Y165-I179 HydrophobicContact CE1-CB 4.29Å; Y165-I179 HydrophobicContact CE1-CD1 4.41Å; Y165-I179 HydrophobicContact CE1-CG1 3.47Å; Y165-I179 VanDerWaalsContact CE1-CG1 3.47Å; G176-I179 PolarHBondContact O-N 2.81Å; N177-I179 PolarHBondContact O-N 2.86Å; I179-G181 PolarHBondContact O-N 3.21Å; I179-T194 HydrophobicContact CB-CG2 4.25Å; I179-T194 HydrophobicContact CG2-CG2 4.34Å
180	D	96.1	Very high	94.7	Very high	89 Å²	89	31.1 Å²	31.1	48%	0.476	16%	0.162	S	C	.	.			trans	-83.2	111.9	171.2	-169.3	-19.5	0	0	0	110.2	Y147 S182	Y147-D180 WeakPolarHBondContact CE1-OD1 3.08Å; D180-S182 VanDerWaalsContact C-N 3.25Å; D180-S182 PolarHBondContact O-N 2.98Å; D180-S182 WeakPolarHBondContact OD1-CB 3.17Å; D180-S182 PolarHBondContact OD1-N 2.82Å; D180-S182 PolarHBondContact OD1-OG 3.29Å
181	G	97.6	Very high	95.4	Very high	2 Å²	2	30.9 Å²	30.9	2%	0.021	16%	0.161	C	C	.	.			trans	-75.8	-6.4	178.9	0	0	0	0	0	114.8	I179 I183 L184 A185	I179-G181 PolarHBondContact O-N 3.21Å; G181-I183 PolarHBondContact O-N 2.81Å; G181-L184 PolarHBondContact O-N 3.39Å; G181-A185 VanDerWaalsContact O-CB 3.27Å; G181-A185 WeakPolarHBondContact O-CB 3.43Å; G181-A185 PolarHBondContact O-N 2.83Å
182	S	97.4	Very high	95.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.2	-40.5	-165.9	-49.9	0	0	0	0	113.7	V66 Q68 Y147 D180 A185 S186	V66-S182 WeakPolarHBondContact CG2-O 3.37Å; Q68-S182 PolarHBondContact NE2-OG 3.46Å; Y147-S182 VanDerWaalsContact CD1-OG 3.27Å; Y147-S182 WeakPolarHBondContact CD1-OG 3.48Å; D180-S182 VanDerWaalsContact C-N 3.25Å; D180-S182 PolarHBondContact O-N 2.98Å; D180-S182 WeakPolarHBondContact OD1-CB 3.17Å; D180-S182 PolarHBondContact OD1-N 2.82Å; D180-S182 PolarHBondContact OD1-OG 3.29Å; S182-A185 PolarHBondContact O-N 3.19Å; S182-S186 WeakPolarHBondContact O-CB 3.42Å; S182-S186 PolarHBondContact O-N 2.91Å
183	I	96.9	Very high	95.9	Very high	66 Å²	66	28 Å²	28	34%	0.338	15%	0.147	S	C	.	.	H	α-helix	trans	-65.8	-46.7	179.2	-65.2	177	0	0	0	110.3	L63 G181 A185 S186 Y187 V487	L63-I183 HydrophobicContact CD1-CG2 4.24Å; G181-I183 PolarHBondContact O-N 2.81Å; I183-A185 VanDerWaalsContact C-N 3.32Å; I183-A185 PolarHBondContact O-N 3.35Å; I183-S186 PolarHBondContact O-N 3Å; I183-Y187 WeakPolarHBondContact O-CB 3.47Å; I183-Y187 PolarHBondContact O-N 3.27Å; I183-V487 HydrophobicContact CD1-CB 4Å; I183-V487 HydrophobicContact CD1-CG1 3.46Å; I183-V487 VanDerWaalsContact CD1-CG1 3.46Å
184	L	97.4	Very high	96.3	Very high	67 Å²	67	27.9 Å²	27.9	35%	0.351	15%	0.146	S	C	.	.	H	α-helix	trans	-63.5	-40.7	178	178.1	61.3	0	0	0	111.2	M163 G181 G188 V190 V192 F245	M163-L184 HydrophobicContact CE-CD2 4.48Å; M163-L184 HydrophobicContact SD-CD2 4.19Å; G181-L184 PolarHBondContact O-N 3.39Å; L184-G188 WeakPolarHBondContact O-CA 3.19Å; L184-G188 PolarHBondContact O-N 3.28Å; L184-V190 HydrophobicContact CG-CG2 4.46Å; L184-V192 HydrophobicContact CB-CG2 4.04Å; L184-V192 HydrophobicContact CD2-CG2 3.87Å; L184-V192 HydrophobicContact CG-CG2 3.8Å; L184-F245 HydrophobicContact CD2-CZ 4.13Å
185	A	97.5	Very high	96.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-51.1	177.5	0	0	0	0	0	111.7	P149 G181 S182 I183 N189 V190 V192	P149-A185 WeakPolarHBondContact CB-O 3.39Å; P149-A185 WeakPolarHBondContact CG-O 3.31Å; G181-A185 VanDerWaalsContact O-CB 3.27Å; G181-A185 WeakPolarHBondContact O-CB 3.43Å; G181-A185 PolarHBondContact O-N 2.83Å; S182-A185 PolarHBondContact O-N 3.19Å; I183-A185 VanDerWaalsContact C-N 3.32Å; I183-A185 PolarHBondContact O-N 3.35Å; A185-N189 WeakPolarHBondContact O-CA 3.4Å; A185-N189 PolarHBondContact O-N 3.44Å; A185-V190 WeakPolarHBondContact CA-O 3.41Å; A185-V190 WeakPolarHBondContact CB-O 3.26Å; A185-V190 PolarHBondContact O-N 3.01Å; A185-V192 HydrophobicContact CB-CB 4.4Å; A185-V192 HydrophobicContact CB-CG2 3.93Å
186	S	96	Very high	96.7	Very high	14 Å²	14	27.9 Å²	27.9	10%	0.098	15%	0.145	C	C	.	.	H	α-helix	trans	-66.9	-49.1	-179.3	-173	0	0	0	0	112.1	G64 S182 I183	G64-S186 PolarHBondContact N-OG 2.9Å; G64-S186 PolarHBondContact O-OG 2.94Å; S182-S186 WeakPolarHBondContact O-CB 3.42Å; S182-S186 PolarHBondContact O-N 2.91Å; I183-S186 PolarHBondContact O-N 3Å
187	Y	95.3	Very high	96.8	Very high	189 Å²	189	27.9 Å²	27.9	74%	0.741	15%	0.146	S	C	*	.	H	α-helix	trans	-69.2	-46.4	-177.3	179.3	-95.5	0	0	0	113	L63 I183 N189	L63-Y187 HydrophobicContact CD2-CD2 4.24Å; I183-Y187 WeakPolarHBondContact O-CB 3.47Å; I183-Y187 PolarHBondContact O-N 3.27Å; Y187-N189 VanDerWaalsContact C-N 3.29Å
188	G	95.1	Very high	97	Very high	38 Å²	38	27.8 Å²	27.8	39%	0.392	15%	0.145	S	C	.	.	H	α-helix	trans	-81.6	-9.7	-178.5	0	0	0	0	0	113.6	L184 V190	L184-G188 WeakPolarHBondContact O-CA 3.19Å; L184-G188 PolarHBondContact O-N 3.28Å; G188-V190 VanDerWaalsContact C-N 3.25Å; G188-V190 WeakPolarHBondContact O-CG1 3.43Å; G188-V190 PolarHBondContact O-N 3Å
189	N	95.3	Very high	97.2	Very high	28 Å²	28	27.1 Å²	27.1	15%	0.15	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	45.2	-171.7	-161.8	10.6	0	0	0	113.2	E151 D153 K160 A185 Y187	E151-N189 PolarHBondContact O-OD1 3.27Å; D153-N189 WeakPolarHBondContact CA-ND2 3.37Å; D153-N189 WeakPolarHBondContact CB-ND2 3.34Å; D153-N189 PolarHBondContact N-ND2 3.46Å; D153-N189 PolarHBondContact OD2-ND2 2.86Å; K160-N189 PolarHBondContact NZ-OD1 3.45Å; A185-N189 WeakPolarHBondContact O-CA 3.4Å; A185-N189 PolarHBondContact O-N 3.44Å; Y187-N189 VanDerWaalsContact C-N 3.29Å
190	V	97.3	Very high	97.4	Very high	17 Å²	17	25 Å²	25	10%	0.103	13%	0.131	C	C	.	.			trans	-122.7	155.1	179.8	-64.7	0	0	0	0	109.9	P149 P161 M163 L184 A185 G188 V192	P149-V190 VanDerWaalsContact CD-O 3.28Å; P149-V190 WeakPolarHBondContact CD-O 3.44Å; P161-V190 HydrophobicContact CB-CB 4.5Å; P161-V190 HydrophobicContact CB-CG1 3.86Å; P161-V190 HydrophobicContact CG-CG1 3.97Å; M163-V190 HydrophobicContact CG-CG2 4.28Å; M163-V190 HydrophobicContact SD-CG2 4.04Å; L184-V190 HydrophobicContact CG-CG2 4.46Å; A185-V190 WeakPolarHBondContact CA-O 3.41Å; A185-V190 WeakPolarHBondContact CB-O 3.26Å; A185-V190 PolarHBondContact O-N 3.01Å; G188-V190 VanDerWaalsContact C-N 3.25Å; G188-V190 WeakPolarHBondContact O-CG1 3.43Å; G188-V190 PolarHBondContact O-N 3Å; V190-V192 HydrophobicContact CG2-CG2 4.04Å
191	I	98.6	Very high	97.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128	167.2	-62.5	-179.9	0	0	0	108.1	V146 Y147 V148 K160 P161 V162 M163 I193 I232 F235 G237	V146-I191 HydrophobicContact CG1-CG2 3.69Å; Y147-I191 WeakPolarHBondContact O-CA 3.18Å; V148-I191 HydrophobicContact CG1-CD1 4.35Å; V148-I191 HydrophobicContact CG1-CG1 4.31Å; V148-I191 HydrophobicContact CG2-CD1 4.39Å; V148-I191 HydrophobicContact CG2-CG1 4.46Å; V148-I191 HydrophobicContact CG2-CG2 4.43Å; K160-I191 HydrophobicContact CB-CG1 4.26Å; K160-I191 HydrophobicContact CD-CG1 4.45Å; P161-I191 PolarHBondContact O-N 3.45Å; V162-I191 CarbonylContact C-O 3.5Å; V162-I191 WeakPolarHBondContact CA-O 3.28Å; V162-I191 HydrophobicContact CG2-CB 4.43Å; M163-I191 PolarHBondContact N-O 2.97Å; I191-I193 HydrophobicContact CG2-CG1 4.2Å; I191-I232 HydrophobicContact CD1-CD1 4.4Å; I191-I232 HydrophobicContact CD1-CG1 4.34Å; I191-I232 HydrophobicContact CG2-CD1 4Å; I191-F235 HydrophobicContact CD1-CB 4.15Å; I191-F235 WeakPolarHBondContact CD1-O 3.49Å; I191-G237 VanDerWaalsContact CD1-CA 3.48Å
192	V	98.9	Very high	97.5	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.3	174.3	-178.2	0	0	0	0	108.9	Y147 M163 L184 A185 V190	Y147-V192 WeakPolarHBondContact CD2-O 3.35Å; Y147-V192 PolarHBondContact N-O 2.64Å; Y147-V192 PolarHBondContact O-N 3.46Å; M163-V192 CarbonylContact O-C 3.57Å; M163-V192 WeakPolarHBondContact O-CA 3.43Å; L184-V192 HydrophobicContact CB-CG2 4.04Å; L184-V192 HydrophobicContact CD2-CG2 3.87Å; L184-V192 HydrophobicContact CG-CG2 3.8Å; A185-V192 HydrophobicContact CB-CB 4.4Å; A185-V192 HydrophobicContact CB-CG2 3.93Å; V190-V192 HydrophobicContact CG2-CG2 4.04Å
193	I	98.9	Very high	97.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.6	176.4	-56.5	-178.3	0	0	0	108.5	L144 N145 V146 V162 M163 V164 Y165 I191 V228 I232	L144-I193 HydrophobicContact CB-CG2 4.16Å; L144-I193 HydrophobicContact CD1-CG2 4.24Å; L144-I193 HydrophobicContact CD2-CG2 4.46Å; N145-I193 VanDerWaalsContact O-CA 3.23Å; N145-I193 WeakPolarHBondContact O-CA 3.28Å; V146-I193 HydrophobicContact CG1-CG1 4.32Å; V146-I193 HydrophobicContact CG2-CG1 4.46Å; V162-I193 HydrophobicContact CG1-CD1 3.71Å; V162-I193 HydrophobicContact CG1-CG1 4.18Å; M163-I193 PolarHBondContact O-N 2.83Å; V164-I193 HydrophobicContact CG1-CB 4.45Å; V164-I193 HydrophobicContact CG1-CG2 4.45Å; V164-I193 HydrophobicContact CG2-CB 4.27Å; V164-I193 HydrophobicContact CG2-CD1 4.32Å; Y165-I193 PolarHBondContact N-O 3.32Å; I191-I193 HydrophobicContact CG2-CG1 4.2Å; I193-V228 HydrophobicContact CD1-CB 4.26Å; I193-V228 HydrophobicContact CD1-CG1 3.69Å; I193-V228 HydrophobicContact CD1-CG2 3.49Å; I193-V228 VanDerWaalsContact CD1-CG2 3.49Å; I193-V228 HydrophobicContact CG2-CG2 4.41Å; I193-I232 HydrophobicContact CD1-CD1 3.6Å; I193-I232 HydrophobicContact CD1-CG1 4.3Å; I193-I232 HydrophobicContact CG1-CD1 4.48Å
194	T	98.8	Very high	97.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149.4	165.8	69.5	0	0	0	0	108.8	L144 N145 Y147 Y165 G176 I179	L144-T194 CarbonylContact C-O 3.56Å; L144-T194 VanDerWaalsContact CA-O 3.26Å; L144-T194 WeakPolarHBondContact CA-O 3.36Å; L144-T194 WeakPolarHBondContact CB-O 3.44Å; N145-T194 PolarHBondContact N-O 2.99Å; N145-T194 PolarHBondContact ND2-OG1 3.21Å; N145-T194 VanDerWaalsContact ND2-OG1 3.07Å; N145-T194 PolarHBondContact O-N 2.85Å; Y147-T194 HydrophobicContact CE2-CG2 4.24Å; Y165-T194 HydrophobicContact CD1-CG2 4.46Å; G176-T194 WeakPolarHBondContact O-CB 3.39Å; G176-T194 PolarHBondContact O-OG1 3.45Å; I179-T194 HydrophobicContact CB-CG2 4.25Å; I179-T194 HydrophobicContact CG2-CG2 4.34Å
195	L	98.5	Very high	97.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	154	-177.2	70.9	101	0	0	0	112	L144 V164 I166 H167 Y197 Q221 A224	L144-L195 HydrophobicContact CB-CB 3.89Å; V164-L195 HydrophobicContact CG1-CD2 3.71Å; I166-L195 HydrophobicContact CG1-CD2 4.39Å; H167-L195 PolarHBondContact CD2-O 2.97Å; L195-Y197 HydrophobicContact CD1-CD1 3.95Å; L195-Q221 HydrophobicContact CD1-CG 4.11Å; L195-A224 HydrophobicContact CD1-CB 4.37Å; L195-A224 HydrophobicContact CD2-CB 4.03Å
196	N	98.4	Very high	97.8	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.078	C	C	.	.			trans	-101.5	137.2	166.9	-68.6	-23.6	0	0	0	109.1	Y74 C141 Y143 T175 G176	Y74-N196 VanDerWaalsContact CE1-O 3.28Å; Y74-N196 WeakPolarHBondContact CE1-O 3.19Å; Y74-N196 PolarHBondContact OH-O 3Å; C141-N196 VanDerWaalsContact O-CB 3.28Å; C141-N196 WeakPolarHBondContact O-CB 3.3Å; Y143-N196 PolarHBondContact O-N 3.27Å; T175-N196 PolarHBondContact OG1-OD1 3.19Å; G176-N196 PolarHBondContact N-OD1 3.42Å
197	Y	98.8	Very high	97.9	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	8%	0.076	C	C	.	.			trans	-129	156.8	172.7	60.6	-88.9	0	0	0	109.1	C106 I166 H167 L195 V199 F204 Q221	C106-Y197 VanDerWaalsContact SG-C 3.6Å; C106-Y197 PolarHBondContact SG-O 3.32Å; I166-Y197 HydrophobicContact CG2-CD1 4.42Å; I166-Y197 HydrophobicContact CG2-CE1 3.84Å; H167-Y197 AromaticContact CD2-CE1 3.7Å; H167-Y197 AromaticContact CE1-CE1 3.55Å; H167-Y197 AromaticContact CE1-CZ 3.77Å; H167-Y197 AromaticContact ND1-CE1 3.97Å; H167-Y197 AromaticContact NE2-CD1 3.7Å; H167-Y197 AromaticContact NE2-CE1 3.39Å; H167-Y197 WeakPolarHBondContact NE2-CE1 3.39Å; H167-Y197 PolarHBondContact O-OH 3.05Å; H167-Y197 VanDerWaalsContact O-OH 3.05Å; L195-Y197 HydrophobicContact CD1-CD1 3.95Å; Y197-V199 HydrophobicContact CD2-CG1 4.44Å; Y197-V199 HydrophobicContact CE2-CG1 4.08Å; Y197-V199 PolarHBondContact O-N 2.91Å; Y197-F204 HydrophobicContact CD2-CZ 4.48Å; Y197-F204 HydrophobicContact CE2-CE2 4.35Å; Y197-F204 HydrophobicContact CE2-CZ 4.17Å; Y197-Q221 HydrophobicContact CD1-CG 3.92Å; Y197-Q221 HydrophobicContact CG-CG 3.88Å
198	R	98.8	Very high	98	Very high	6 Å²	6	8.2 Å²	8.2	2%	0.023	7%	0.067	C	C	.	.			trans	-58.9	132.5	178.1	-76.5	170.9	-76.8	179.6	-4.5	110.6	P78 L85 L142 G203 G217 D220	P78-R198 HydrophobicContact CG-CG 4.21Å; L85-R198 PolarHBondContact O-NH1 2.73Å; L85-R198 PolarHBondContact O-NH2 3.32Å; L142-R198 HydrophobicContact CD2-CG 4.14Å; R198-G203 VanDerWaalsContact CB-CA 3.47Å; R198-G203 WeakPolarHBondContact O-CA 3.44Å; R198-G217 WeakPolarHBondContact O-CA 3.02Å; R198-D220 WeakPolarHBondContact CB-OD2 3.31Å; R198-D220 VanDerWaalsContact CG-OD2 3.26Å; R198-D220 WeakPolarHBondContact CG-OD2 3.28Å; R198-D220 IonicContact CZ-OD1 3.68Å; R198-D220 IonicContact CZ-OD2 3.2Å; R198-D220 PolarHBondContact N-OD2 2.91Å; R198-D220 IonicContact NE-OD1 2.76Å; R198-D220 PolarHBondContact NE-OD1 3.25Å; R198-D220 IonicContact NE-OD2 2.62Å; R198-D220 PolarHBondContact NE-OD2 2.83Å; R198-D220 IonicContact NH2-OD1 3.27Å; R198-D220 PolarHBondContact NH2-OD1 3.41Å; R198-D220 IonicContact NH2-OD2 3.73Å
199	V	97.6	Very high	98.2	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.006	6%	0.064	C	C	.	.			trans	-110.5	163.2	178.9	-67.9	0	0	0	0	111.4	C106 Q108 Y171 Y197 L202 G203	C106-V199 HydrophobicContact CB-CG2 4.01Å; Q108-V199 HydrophobicContact CB-CG2 4.05Å; Y171-V199 CarbonylContact O-C 3.32Å; Y171-V199 WeakPolarHBondContact O-CA 3.32Å; Y171-V199 WeakPolarHBondContact O-CB 3.18Å; Y197-V199 HydrophobicContact CD2-CG1 4.44Å; Y197-V199 HydrophobicContact CE2-CG1 4.08Å; Y197-V199 PolarHBondContact O-N 2.91Å; V199-L202 PolarHBondContact O-N 2.81Å; V199-G203 PolarHBondContact O-N 2.84Å; V199-G203 VanDerWaalsContact O-N 3.13Å
200	G	96.2	Very high	98.3	Very high	3 Å²	3	14.9 Å²	14.9	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	52.4	-135.7	175	0	0	0	0	0	114	Y171 M172 L202 G203 F204	Y171-G200 PolarHBondContact O-N 2.64Å; M172-G200 WeakPolarHBondContact SD-CA 3.35Å; G200-L202 VanDerWaalsContact C-N 3.25Å; G200-L202 PolarHBondContact O-N 2.93Å; G200-G203 PolarHBondContact O-N 3.43Å; G200-G203 VanDerWaalsContact O-N 3.12Å; G200-F204 PolarHBondContact O-N 3.46Å
201	V	97.9	Very high	98.3	Very high	4 Å²	4	15 Å²	15	2%	0.024	9%	0.092	C	C	.	.	H	α-helix	trans	-52	-45.9	-179.4	177.9	0	0	0	0	111.5	F84 G203 L205 L294 L320 F334	F84-V201 HydrophobicContact CE1-CG1 4.31Å; F84-V201 WeakPolarHBondContact CE1-O 3.39Å; F84-V201 HydrophobicContact CZ-CG1 4.43Å; V201-G203 VanDerWaalsContact C-N 3.3Å; V201-G203 PolarHBondContact O-N 3.34Å; V201-L205 HydrophobicContact CG1-CB 4.34Å; V201-L205 HydrophobicContact CG1-CD1 3.88Å; V201-L205 WeakPolarHBondContact O-CB 3.33Å; V201-L205 PolarHBondContact O-N 3.25Å; V201-L205 VanDerWaalsContact O-N 3.07Å; V201-L294 HydrophobicContact CB-CD2 4.32Å; V201-L294 HydrophobicContact CG1-CD2 3.41Å; V201-L294 VanDerWaalsContact CG1-CD2 3.41Å; V201-L294 HydrophobicContact CG2-CD2 3.88Å; V201-L320 HydrophobicContact CG1-CB 4.31Å; V201-F334 HydrophobicContact CG2-CD1 4.49Å; V201-F334 HydrophobicContact CG2-CD2 3.87Å; V201-F334 HydrophobicContact CG2-CE1 4.35Å; V201-F334 HydrophobicContact CG2-CE2 3.71Å; V201-F334 HydrophobicContact CG2-CG 4.27Å; V201-F334 HydrophobicContact CG2-CZ 3.97Å
202	L	98.6	Very high	98.3	Very high	5 Å²	5	15 Å²	15	3%	0.026	9%	0.092	C	C	.	.	H	α-helix	trans	-70.5	-27.7	-175.1	-59.5	177	0	0	0	112.8	R83 F84 P107 E139 V199 G200 A317 L320 V321	R83-L202 HydrophobicContact CG-CD2 4.09Å; F84-L202 HydrophobicContact CE1-CD2 4.11Å; F84-L202 HydrophobicContact CZ-CD2 4.27Å; P107-L202 HydrophobicContact CB-CD1 3.87Å; P107-L202 HydrophobicContact CG-CD1 3.69Å; E139-L202 HydrophobicContact CG-CD1 4.01Å; V199-L202 PolarHBondContact O-N 2.81Å; G200-L202 VanDerWaalsContact C-N 3.25Å; G200-L202 PolarHBondContact O-N 2.93Å; L202-A317 HydrophobicContact CD1-CB 3.94Å; L202-L320 HydrophobicContact CD2-CD1 4.12Å; L202-V321 HydrophobicContact CD1-CG2 4.45Å
203	G	98.6	Very high	98.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-90.9	-26.8	179.5	0	0	0	0	0	114.7	R198 V199 G200 V201 Y216 G217	R198-G203 VanDerWaalsContact CB-CA 3.47Å; R198-G203 WeakPolarHBondContact O-CA 3.44Å; V199-G203 PolarHBondContact O-N 2.84Å; V199-G203 VanDerWaalsContact O-N 3.13Å; G200-G203 PolarHBondContact O-N 3.43Å; G200-G203 VanDerWaalsContact O-N 3.12Å; V201-G203 VanDerWaalsContact C-N 3.3Å; V201-G203 PolarHBondContact O-N 3.34Å; G203-Y216 CarbonylContact O-C 3.6Å; G203-Y216 WeakPolarHBondContact O-CA 3.28Å; G203-Y216 VanDerWaalsContact O-CB 3.31Å; G203-Y216 WeakPolarHBondContact O-CB 3.42Å; G203-Y216 PolarHBondContact O-N 2.88Å; G203-G217 PolarHBondContact O-N 3.27Å
204	F	98.8	Very high	98.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-140.6	6.5	-162.3	-60.3	-75	0	0	0	115.2	Y171 Y197 G200 S206 L218 F334 G335 P336	Y171-F204 HydrophobicContact CD1-CE1 4.3Å; Y171-F204 AromaticContact CD1-CE2 3.91Å; Y171-F204 HydrophobicContact CD1-CE2 3.91Å; Y171-F204 AromaticContact CD1-CZ 3.68Å; Y171-F204 HydrophobicContact CD1-CZ 3.68Å; Y171-F204 HydrophobicContact CE1-CZ 4.37Å; Y171-F204 HydrophobicContact CG-CE2 4.31Å; Y171-F204 HydrophobicContact CG-CZ 4.47Å; Y197-F204 HydrophobicContact CD2-CZ 4.48Å; Y197-F204 HydrophobicContact CE2-CE2 4.35Å; Y197-F204 HydrophobicContact CE2-CZ 4.17Å; G200-F204 PolarHBondContact O-N 3.46Å; F204-S206 PolarHBondContact O-N 2.7Å; F204-L218 HydrophobicContact CE1-CG 4.41Å; F204-F334 HydrophobicContact CB-CB 4.16Å; F204-G335 WeakPolarHBondContact CB-O 3.33Å; F204-P336 HydrophobicContact CD1-CG 4.46Å; F204-P336 HydrophobicContact CE1-CG 4.06Å
205	L	98.7	Very high	98.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.108	C	C	.	.			trans	-58.8	128.8	173.4	-178.5	147	0	0	0	111.1	F84 V201 A212 G214 Y216 T291 L294 L312	F84-L205 HydrophobicContact CD1-CB 4.17Å; F84-L205 HydrophobicContact CE1-CB 4.03Å; F84-L205 HydrophobicContact CE1-CD1 4.29Å; F84-L205 HydrophobicContact CZ-CD1 4.28Å; V201-L205 HydrophobicContact CG1-CB 4.34Å; V201-L205 HydrophobicContact CG1-CD1 3.88Å; V201-L205 WeakPolarHBondContact O-CB 3.33Å; V201-L205 PolarHBondContact O-N 3.25Å; V201-L205 VanDerWaalsContact O-N 3.07Å; L205-A212 HydrophobicContact CD2-CB 3.64Å; L205-G214 WeakPolarHBondContact O-CA 3.28Å; L205-Y216 WeakPolarHBondContact O-CE2 3.27Å; L205-Y216 PolarHBondContact O-OH 3.17Å; L205-T291 HydrophobicContact CD1-CG2 4.11Å; L205-T291 HydrophobicContact CD2-CG2 4.07Å; L205-T291 HydrophobicContact CG-CG2 3.99Å; L205-L294 HydrophobicContact CD1-CD2 3.86Å; L205-L312 HydrophobicContact CD1-CD1 3.83Å
206	S	98.8	Very high	98.3	Very high	4 Å²	4	19 Å²	19	3%	0.028	11%	0.109	C	C	.	.			trans	-139	137.5	176.1	175.4	0	0	0	0	111.1	F204 G208 A212 K213 P287 T291	F204-S206 PolarHBondContact O-N 2.7Å; S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact OG-N 3.28Å; S206-A212 CarbonylContact C-O 3.55Å; S206-A212 WeakPolarHBondContact CA-O 3.49Å; S206-A212 PolarHBondContact OG-O 3.33Å; S206-K213 WeakPolarHBondContact CB-O 3.36Å; S206-K213 PolarHBondContact OG-O 3.5Å; S206-P287 CarbonylContact O-C 3.5Å; S206-T291 WeakPolarHBondContact O-CB 3.33Å; S206-T291 PolarHBondContact O-OG1 3.48Å
207	T	98.6	Very high	98.3	Very high	8 Å²	8	18.9 Å²	18.9	5%	0.049	11%	0.109	C	C	.	.			trans	-90.1	-1.8	174.5	46.9	0	0	0	0	112.2	D209 A211 A212 V288 T291 T305 V309	T207-D209 WeakPolarHBondContact CB-OD1 3.47Å; T207-D209 PolarHBondContact O-N 2.84Å; T207-D209 PolarHBondContact OG1-OD1 3.15Å; T207-A211 HydrophobicContact CG2-CB 4.49Å; T207-A212 HydrophobicContact CG2-CB 4.14Å; T207-A212 PolarHBondContact N-O 2.86Å; T207-A212 PolarHBondContact OG1-N 3.38Å; T207-A212 PolarHBondContact OG1-O 3.09Å; T207-V288 WeakPolarHBondContact O-CG2 3.44Å; T207-T291 HydrophobicContact CG2-CG2 4.06Å; T207-T305 HydrophobicContact CG2-CG2 4.27Å; T207-V309 HydrophobicContact CG2-CG2 3.76Å
208	G	97.9	Very high	98.3	Very high	54 Å²	54	18.9 Å²	18.9	56%	0.557	11%	0.109	S	C	*	.	S	Bend	trans	69.8	10.5	-173.9	0	0	0	0	0	113.9	S206	S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact OG-N 3.28Å
209	D	98.1	Very high	98.4	Very high	59 Å²	59	19.5 Å²	19.5	32%	0.316	11%	0.113	S	C	.	.	S	Bend	trans	-140.5	-163.1	177.3	68.7	17.6	0	0	0	110.8	T207 A211 T305	T207-D209 WeakPolarHBondContact CB-OD1 3.47Å; T207-D209 PolarHBondContact O-N 2.84Å; T207-D209 PolarHBondContact OG1-OD1 3.15Å; D209-A211 VanDerWaalsContact C-N 3.34Å; D209-A211 PolarHBondContact O-N 3.46Å; D209-A211 WeakPolarHBondContact OD1-CB 3.4Å; D209-A211 PolarHBondContact OD1-N 2.91Å; D209-T305 WeakPolarHBondContact OD2-CB 3.34Å; D209-T305 WeakPolarHBondContact OD2-CG2 3.2Å; D209-T305 PolarHBondContact OD2-OG1 3.32Å
210	Q	97.9	Very high	98.4	Very high	146 Å²	146	19.5 Å²	19.5	68%	0.682	11%	0.113	S	C	*	.	S	Bend	trans	-78.3	-11.8	-175.5	-59.4	-61.5	-64.9	0	0	114.5	K213	Q210-K213 VanDerWaalsContact OE1-NZ 3.07Å
211	A	98.1	Very high	98.5	Very high	19 Å²	19	19.3 Å²	19.3	16%	0.157	11%	0.111	C	C	.	.	S	Bend	trans	-68.9	-41.5	-176.5	0	0	0	0	0	112.1	T207 D209 T305 V306 V309	T207-A211 HydrophobicContact CG2-CB 4.49Å; D209-A211 VanDerWaalsContact C-N 3.34Å; D209-A211 PolarHBondContact O-N 3.46Å; D209-A211 WeakPolarHBondContact OD1-CB 3.4Å; D209-A211 PolarHBondContact OD1-N 2.91Å; A211-T305 WeakPolarHBondContact CB-O 3.24Å; A211-V306 HydrophobicContact CB-CG2 3.96Å; A211-V309 HydrophobicContact CB-CG2 4.11Å
212	A	98.4	Very high	98.6	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.008	11%	0.11	C	C	.	.			trans	-146.1	104.5	169.8	0	0	0	0	0	108.8	L205 S206 T207 G214 Y216 V309	L205-A212 HydrophobicContact CD2-CB 3.64Å; S206-A212 CarbonylContact C-O 3.55Å; S206-A212 WeakPolarHBondContact CA-O 3.49Å; S206-A212 PolarHBondContact OG-O 3.33Å; T207-A212 HydrophobicContact CG2-CB 4.14Å; T207-A212 PolarHBondContact N-O 2.86Å; T207-A212 PolarHBondContact OG1-N 3.38Å; T207-A212 PolarHBondContact OG1-O 3.09Å; A212-G214 PolarHBondContact O-N 3.4Å; A212-Y216 VanDerWaalsContact C-OH 3.31Å; A212-Y216 WeakPolarHBondContact CA-OH 3.31Å; A212-Y216 VanDerWaalsContact CB-OH 3.27Å; A212-Y216 WeakPolarHBondContact CB-OH 3.25Å; A212-V309 HydrophobicContact CB-CG1 4.42Å; A212-V309 HydrophobicContact CB-CG2 3.7Å
213	K	98.4	Very high	98.6	Very high	77 Å²	77	19.6 Å²	19.6	34%	0.335	11%	0.112	S	C	.	.			trans	-71.3	-30.6	-176.1	-64.4	-175.6	179.1	-169.8	0	113.2	S206 Q210 Y216 V337	S206-K213 WeakPolarHBondContact CB-O 3.36Å; S206-K213 PolarHBondContact OG-O 3.5Å; Q210-K213 VanDerWaalsContact OE1-NZ 3.07Å; K213-Y216 PolarHBondContact N-OH 2.89Å; K213-V337 VanDerWaalsContact O-CG2 3.31Å; K213-V337 WeakPolarHBondContact O-CG2 3.43Å
214	G	98.6	Very high	98.6	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.021	11%	0.112	C	C	.	.			trans	96.4	-161.4	-173.5	0	0	0	0	0	112.8	L205 A212 Y216	L205-G214 WeakPolarHBondContact O-CA 3.28Å; A212-G214 PolarHBondContact O-N 3.4Å; G214-Y216 PolarHBondContact N-OH 3.27Å; G214-Y216 WeakPolarHBondContact O-CD1 3.05Å; G214-Y216 WeakPolarHBondContact O-CE1 3.35Å; G214-Y216 PolarHBondContact O-N 3.49Å
215	N	98.9	Very high	98.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.112	C	C	.	.			trans	57.1	17.4	176.3	-63.1	-27.7	0	0	0	116.3	G217 L218 L219 P336 V337 D339 V342	N215-G217 VanDerWaalsContact C-N 3.28Å; N215-G217 PolarHBondContact O-N 3.12Å; N215-L218 HydrophobicContact CB-CB 4.49Å; N215-L218 HydrophobicContact CB-CD1 4.42Å; N215-L218 PolarHBondContact O-N 3.23Å; N215-L219 WeakPolarHBondContact O-CG 3.21Å; N215-L219 PolarHBondContact O-N 3.27Å; N215-P336 VanDerWaalsContact OD1-CA 3.28Å; N215-P336 WeakPolarHBondContact OD1-CA 3.24Å; N215-V337 PolarHBondContact ND2-O 3.38Å; N215-V337 PolarHBondContact OD1-N 3.18Å; N215-V337 PolarHBondContact OD1-O 2.69Å; N215-D339 PolarHBondContact ND2-OD1 3.25Å; N215-D339 PolarHBondContact ND2-OD2 2.74Å; N215-V342 HydrophobicContact CB-CB 4.13Å; N215-V342 HydrophobicContact CB-CG1 4.16Å; N215-V342 HydrophobicContact CB-CG2 4.28Å
216	Y	98.9	Very high	98.6	Very high	7 Å²	7	23.2 Å²	23.2	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-60.5	-37	-179.4	-43	-61.7	0	0	0	112.7	F84 G203 L205 A212 K213 G214 L219 D220	F84-Y216 VanDerWaalsContact C-CZ 3.5Å; F84-Y216 HydrophobicContact CB-CE2 3.8Å; F84-Y216 HydrophobicContact CD1-CD2 4.47Å; F84-Y216 HydrophobicContact CD1-CE2 4.07Å; F84-Y216 HydrophobicContact CG-CE2 4.42Å; F84-Y216 WeakPolarHBondContact O-CE1 3.47Å; F84-Y216 VanDerWaalsContact O-CZ 3.25Å; F84-Y216 PolarHBondContact O-OH 2.84Å; G203-Y216 CarbonylContact O-C 3.6Å; G203-Y216 WeakPolarHBondContact O-CA 3.28Å; G203-Y216 VanDerWaalsContact O-CB 3.31Å; G203-Y216 WeakPolarHBondContact O-CB 3.42Å; G203-Y216 PolarHBondContact O-N 2.88Å; L205-Y216 WeakPolarHBondContact O-CE2 3.27Å; L205-Y216 PolarHBondContact O-OH 3.17Å; A212-Y216 VanDerWaalsContact C-OH 3.31Å; A212-Y216 WeakPolarHBondContact CA-OH 3.31Å; A212-Y216 VanDerWaalsContact CB-OH 3.27Å; A212-Y216 WeakPolarHBondContact CB-OH 3.25Å; K213-Y216 PolarHBondContact N-OH 2.89Å; G214-Y216 PolarHBondContact N-OH 3.27Å; G214-Y216 WeakPolarHBondContact O-CD1 3.05Å; G214-Y216 WeakPolarHBondContact O-CE1 3.35Å; G214-Y216 PolarHBondContact O-N 3.49Å; Y216-L219 PolarHBondContact O-N 3.37Å; Y216-D220 WeakPolarHBondContact O-CB 3.49Å; Y216-D220 PolarHBondContact O-N 3.27Å
217	G	98.8	Very high	98.6	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-34	174.3	0	0	0	0	0	113.6	R198 G203 N215 D220 Q221	R198-G217 WeakPolarHBondContact O-CA 3.02Å; G203-G217 PolarHBondContact O-N 3.27Å; N215-G217 VanDerWaalsContact C-N 3.28Å; N215-G217 PolarHBondContact O-N 3.12Å; G217-D220 WeakPolarHBondContact O-CB 3.3Å; G217-Q221 WeakPolarHBondContact O-CG 3.28Å; G217-Q221 PolarHBondContact O-N 3.1Å
218	L	98.9	Very high	98.7	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-71.2	-41.1	171.7	-68.2	-180	0	0	0	110.9	F204 N215 D220 Q221 I222 C253 L256 P336 V342 I343	F204-L218 HydrophobicContact CE1-CG 4.41Å; N215-L218 HydrophobicContact CB-CB 4.49Å; N215-L218 HydrophobicContact CB-CD1 4.42Å; N215-L218 PolarHBondContact O-N 3.23Å; L218-D220 VanDerWaalsContact C-N 3.26Å; L218-D220 PolarHBondContact O-N 2.94Å; L218-Q221 WeakPolarHBondContact O-CB 3.35Å; L218-Q221 PolarHBondContact O-N 3.22Å; L218-Q221 VanDerWaalsContact O-N 3.12Å; L218-I222 WeakPolarHBondContact O-CG1 3.34Å; L218-I222 PolarHBondContact O-N 3.03Å; L218-C253 HydrophobicContact CD2-CB 4.26Å; L218-L256 HydrophobicContact CD1-CB 4.42Å; L218-L256 HydrophobicContact CD1-CD1 4.4Å; L218-P336 HydrophobicContact CD1-CB 4.03Å; L218-P336 HydrophobicContact CD1-CG 4.15Å; L218-P336 HydrophobicContact CG-CG 4.42Å; L218-V342 HydrophobicContact CB-CG1 4.37Å; L218-V342 HydrophobicContact CD1-CG1 4.36Å; L218-I343 HydrophobicContact CD1-CD1 4.17Å; L218-I343 HydrophobicContact CD1-CG1 4.22Å
219	L	98.9	Very high	98.7	Very high	19 Å²	19	22 Å²	22	10%	0.099	11%	0.109	C	C	.	.	H	α-helix	trans	-63	-34.2	175.9	-71	167.9	0	0	0	112.2	P86 P87 N215 Y216 I222 Q223 V342	P86-L219 HydrophobicContact CB-CD1 4.05Å; P86-L219 HydrophobicContact CG-CD1 4.04Å; P87-L219 HydrophobicContact CG-CB 4.22Å; P87-L219 WeakPolarHBondContact CG-O 3.43Å; N215-L219 WeakPolarHBondContact O-CG 3.21Å; N215-L219 PolarHBondContact O-N 3.27Å; Y216-L219 PolarHBondContact O-N 3.37Å; L219-I222 HydrophobicContact CD2-CD1 4.33Å; L219-I222 PolarHBondContact O-N 2.77Å; L219-Q223 WeakPolarHBondContact O-CB 3.33Å; L219-Q223 PolarHBondContact O-N 2.88Å; L219-V342 HydrophobicContact CD1-CG2 4.2Å; L219-V342 HydrophobicContact CD2-CG2 3.7Å; L219-V342 HydrophobicContact CG-CG2 3.96Å
220	D	98.9	Very high	98.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.6	-45.9	171.1	-69.7	-16	0	0	0	111.4	Y74 P87 L142 R198 Y216 G217 L218 I222 Q223 A224	Y74-D220 WeakPolarHBondContact CE2-O 3.46Å; P87-D220 WeakPolarHBondContact CB-OD1 3.39Å; P87-D220 WeakPolarHBondContact CG-OD1 3.28Å; L142-D220 HydrophobicContact CD2-CB 4.18Å; L142-D220 WeakPolarHBondContact CD2-OD2 3.26Å; R198-D220 WeakPolarHBondContact CB-OD2 3.31Å; R198-D220 VanDerWaalsContact CG-OD2 3.26Å; R198-D220 WeakPolarHBondContact CG-OD2 3.28Å; R198-D220 IonicContact CZ-OD1 3.68Å; R198-D220 IonicContact CZ-OD2 3.2Å; R198-D220 PolarHBondContact N-OD2 2.91Å; R198-D220 IonicContact NE-OD1 2.76Å; R198-D220 PolarHBondContact NE-OD1 3.25Å; R198-D220 IonicContact NE-OD2 2.62Å; R198-D220 PolarHBondContact NE-OD2 2.83Å; R198-D220 IonicContact NH2-OD1 3.27Å; R198-D220 PolarHBondContact NH2-OD1 3.41Å; R198-D220 IonicContact NH2-OD2 3.73Å; Y216-D220 WeakPolarHBondContact O-CB 3.49Å; Y216-D220 PolarHBondContact O-N 3.27Å; G217-D220 WeakPolarHBondContact O-CB 3.3Å; L218-D220 VanDerWaalsContact C-N 3.26Å; L218-D220 PolarHBondContact O-N 2.94Å; D220-I222 PolarHBondContact O-N 2.78Å; D220-Q223 PolarHBondContact O-N 3.07Å; D220-A224 PolarHBondContact O-N 2.86Å
221	Q	98.9	Very high	98.7	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62	-43.4	175.2	-64.6	162.5	17	0	0	111.4	I166 L195 Y197 G217 L218 Q223 A224 L225 C253 L257	I166-Q221 HydrophobicContact CD1-CB 4.37Å; I166-Q221 HydrophobicContact CD1-CG 4.3Å; I166-Q221 HydrophobicContact CG2-CG 4.39Å; L195-Q221 HydrophobicContact CD1-CG 4.11Å; Y197-Q221 HydrophobicContact CD1-CG 3.92Å; Y197-Q221 HydrophobicContact CG-CG 3.88Å; G217-Q221 WeakPolarHBondContact O-CG 3.28Å; G217-Q221 PolarHBondContact O-N 3.1Å; L218-Q221 WeakPolarHBondContact O-CB 3.35Å; L218-Q221 PolarHBondContact O-N 3.22Å; L218-Q221 VanDerWaalsContact O-N 3.12Å; Q221-Q223 PolarHBondContact O-N 2.83Å; Q221-A224 WeakPolarHBondContact O-CB 3.26Å; Q221-A224 PolarHBondContact O-N 2.89Å; Q221-L225 WeakPolarHBondContact O-CG 3.36Å; Q221-L225 PolarHBondContact O-N 2.98Å; Q221-C253 PolarHBondContact NE2-SG 3.18Å; Q221-C253 VanDerWaalsContact NE2-SG 3.38Å; Q221-L257 HydrophobicContact CB-CD1 4.25Å
222	I	98.9	Very high	98.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.3	-44	175.3	-68.8	161.6	0	0	0	110.7	L218 L219 D220 A224 L225 R226 L257 H262 L266 V342	L218-I222 WeakPolarHBondContact O-CG1 3.34Å; L218-I222 PolarHBondContact O-N 3.03Å; L219-I222 HydrophobicContact CD2-CD1 4.33Å; L219-I222 PolarHBondContact O-N 2.77Å; D220-I222 PolarHBondContact O-N 2.78Å; I222-A224 VanDerWaalsContact C-N 3.34Å; I222-A224 PolarHBondContact O-N 2.85Å; I222-L225 PolarHBondContact O-N 2.83Å; I222-R226 VanDerWaalsContact CG2-CZ 3.45Å; I222-R226 WeakPolarHBondContact O-CG 3.33Å; I222-R226 PolarHBondContact O-N 3.42Å; I222-L257 HydrophobicContact CD1-CD2 3.95Å; I222-L257 HydrophobicContact CG1-CD2 3.46Å; I222-L257 VanDerWaalsContact CG1-CD2 3.46Å; I222-H262 HydrophobicContact CD1-CB 3.81Å; I222-H262 HydrophobicContact CG2-CB 4.37Å; I222-L266 HydrophobicContact CG2-CD1 3.89Å; I222-V342 HydrophobicContact CD1-CG1 4.4Å
223	Q	98.9	Very high	98.7	Very high	14 Å²	14	18.9 Å²	18.9	7%	0.065	10%	0.099	C	C	.	.	H	α-helix	trans	-65.4	-37	177.6	-179.6	53.3	43.3	0	0	112	Y74 A75 P87 L219 D220 Q221 R226 W227	Y74-Q223 HydrophobicContact CD2-CB 4.43Å; Y74-Q223 HydrophobicContact CD2-CG 4.12Å; Y74-Q223 HydrophobicContact CE2-CB 4.41Å; Y74-Q223 HydrophobicContact CE2-CG 4.45Å; Y74-Q223 PolarHBondContact O-NE2 3.03Å; A75-Q223 HydrophobicContact CB-CG 3.99Å; P87-Q223 HydrophobicContact CB-CB 4.22Å; P87-Q223 HydrophobicContact CB-CG 4.19Å; P87-Q223 HydrophobicContact CG-CB 3.63Å; P87-Q223 HydrophobicContact CG-CG 4.1Å; L219-Q223 WeakPolarHBondContact O-CB 3.33Å; L219-Q223 PolarHBondContact O-N 2.88Å; D220-Q223 PolarHBondContact O-N 3.07Å; Q221-Q223 PolarHBondContact O-N 2.83Å; Q223-R226 PolarHBondContact O-N 2.57Å; Q223-W227 PolarHBondContact O-N 3.12Å
224	A	98.9	Very high	98.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.7	-44.2	171.2	0	0	0	0	0	111.3	Y74 L144 L195 D220 Q221 I222 R226 W227 V228	Y74-A224 HydrophobicContact CD1-CB 4.08Å; Y74-A224 HydrophobicContact CD2-CB 3.72Å; Y74-A224 HydrophobicContact CE1-CB 4.12Å; Y74-A224 HydrophobicContact CE2-CB 3.82Å; Y74-A224 HydrophobicContact CG-CB 3.88Å; L144-A224 HydrophobicContact CD2-CB 4.43Å; L195-A224 HydrophobicContact CD1-CB 4.37Å; L195-A224 HydrophobicContact CD2-CB 4.03Å; D220-A224 PolarHBondContact O-N 2.86Å; Q221-A224 WeakPolarHBondContact O-CB 3.26Å; Q221-A224 PolarHBondContact O-N 2.89Å; I222-A224 VanDerWaalsContact C-N 3.34Å; I222-A224 PolarHBondContact O-N 2.85Å; A224-R226 PolarHBondContact O-N 2.86Å; A224-W227 WeakPolarHBondContact O-CB 3.41Å; A224-W227 PolarHBondContact O-N 2.97Å; A224-V228 VanDerWaalsContact O-CG2 3.28Å; A224-V228 WeakPolarHBondContact O-CG2 3.47Å; A224-V228 PolarHBondContact O-N 2.97Å
225	L	98.9	Very high	98.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-39.1	176.7	-69.3	168.6	0	0	0	112.5	V164 Q221 I222 V228 S229 V244 L257 L266 F267	V164-L225 HydrophobicContact CB-CD2 4.24Å; V164-L225 HydrophobicContact CG1-CD2 4.05Å; V164-L225 HydrophobicContact CG2-CD2 4.23Å; Q221-L225 WeakPolarHBondContact O-CG 3.36Å; Q221-L225 PolarHBondContact O-N 2.98Å; I222-L225 PolarHBondContact O-N 2.83Å; L225-V228 PolarHBondContact O-N 3.39Å; L225-S229 WeakPolarHBondContact O-CB 3.34Å; L225-S229 PolarHBondContact O-N 2.84Å; L225-V244 HydrophobicContact CD1-CG2 4.3Å; L225-V244 HydrophobicContact CD2-CG2 3.61Å; L225-L257 HydrophobicContact CD1-CD1 4.08Å; L225-L266 HydrophobicContact CB-CB 4.11Å; L225-L266 HydrophobicContact CB-CD1 4.07Å; L225-F267 HydrophobicContact CD1-CD1 3.94Å; L225-F267 HydrophobicContact CD1-CE1 4.16Å
226	R	98.8	Very high	98.5	Very high	76 Å²	76	22 Å²	22	29%	0.287	12%	0.122	S	C	.	.	H	α-helix	trans	-59.4	-49.1	170.7	-71.6	176.2	-172.1	147.8	3	111.2	I222 Q223 A224 V228 S229 E230 H262 L266	I222-R226 VanDerWaalsContact CG2-CZ 3.45Å; I222-R226 WeakPolarHBondContact O-CG 3.33Å; I222-R226 PolarHBondContact O-N 3.42Å; Q223-R226 PolarHBondContact O-N 2.57Å; A224-R226 PolarHBondContact O-N 2.86Å; R226-V228 VanDerWaalsContact C-N 3.29Å; R226-V228 PolarHBondContact O-N 3.47Å; R226-S229 PolarHBondContact O-N 3.3Å; R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.12Å; R226-H262 PolarHBondContact NH2-O 2.53Å; R226-L266 HydrophobicContact CG-CD1 3.69Å; R226-L266 HydrophobicContact CG-CD2 3.69Å; R226-L266 HydrophobicContact CG-CG 4.38Å
227	W	98.8	Very high	98.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-43.7	176.8	-174.7	100	0	0	0	111.6	T46 F48 V72 L144 Q223 A224 E230 N231 F235	T46-W227 HydrophobicContact CG2-CZ2 4.12Å; F48-W227 AromaticContact CD2-NE1 3.69Å; F48-W227 AromaticContact CE2-CD1 3.65Å; F48-W227 AromaticContact CE2-NE1 3.8Å; V72-W227 HydrophobicContact CG1-CH2 3.73Å; V72-W227 HydrophobicContact CG1-CZ2 3.43Å; V72-W227 VanDerWaalsContact CG1-CZ2 3.43Å; L144-W227 HydrophobicContact CD1-CE3 4.19Å; L144-W227 HydrophobicContact CD1-CH2 4.16Å; L144-W227 HydrophobicContact CD1-CZ3 3.75Å; L144-W227 HydrophobicContact CD2-CD2 4.15Å; L144-W227 HydrophobicContact CD2-CE3 3.6Å; L144-W227 HydrophobicContact CD2-CZ3 4.03Å; L144-W227 HydrophobicContact CG-CE3 4.45Å; L144-W227 HydrophobicContact CG-CZ3 4.48Å; Q223-W227 PolarHBondContact O-N 3.12Å; A224-W227 WeakPolarHBondContact O-CB 3.41Å; A224-W227 PolarHBondContact O-N 2.97Å; W227-E230 PolarHBondContact O-N 3.45Å; W227-N231 HydrophobicContact CD2-CB 4.19Å; W227-N231 HydrophobicContact CE3-CB 4.22Å; W227-N231 HydrophobicContact CH2-CB 4.06Å; W227-N231 HydrophobicContact CZ2-CB 4.02Å; W227-N231 HydrophobicContact CZ3-CB 4.16Å; W227-N231 VanDerWaalsContact O-CB 3.28Å; W227-N231 WeakPolarHBondContact O-CB 3.39Å; W227-N231 PolarHBondContact O-N 2.82Å; W227-N231 PolarHBondContact O-ND2 2.99Å; W227-F235 AromaticContact CH2-CE2 3.76Å; W227-F235 HydrophobicContact CH2-CE2 3.76Å; W227-F235 AromaticContact CH2-CZ 3.93Å; W227-F235 HydrophobicContact CH2-CZ 3.93Å; W227-F235 HydrophobicContact CZ3-CE2 4.43Å
228	V	98.8	Very high	98.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-62.2	-51.3	177.7	171.3	0	0	0	0	110.4	L144 V162 V164 I193 A224 L225 R226 E230 N231 I232 I242	L144-V228 HydrophobicContact CD2-CG2 4.2Å; V162-V228 HydrophobicContact CG1-CG1 4.04Å; V164-V228 HydrophobicContact CG2-CG1 4.22Å; I193-V228 HydrophobicContact CD1-CB 4.26Å; I193-V228 HydrophobicContact CD1-CG1 3.69Å; I193-V228 HydrophobicContact CD1-CG2 3.49Å; I193-V228 VanDerWaalsContact CD1-CG2 3.49Å; I193-V228 HydrophobicContact CG2-CG2 4.41Å; A224-V228 VanDerWaalsContact O-CG2 3.28Å; A224-V228 WeakPolarHBondContact O-CG2 3.47Å; A224-V228 PolarHBondContact O-N 2.97Å; L225-V228 PolarHBondContact O-N 3.39Å; R226-V228 VanDerWaalsContact C-N 3.29Å; R226-V228 PolarHBondContact O-N 3.47Å; V228-E230 PolarHBondContact O-N 3.28Å; V228-N231 PolarHBondContact O-N 3.21Å; V228-I232 HydrophobicContact CG1-CB 4.02Å; V228-I232 HydrophobicContact CG1-CG1 4.3Å; V228-I232 HydrophobicContact CG1-CG2 4.27Å; V228-I232 WeakPolarHBondContact O-CB 3.34Å; V228-I232 WeakPolarHBondContact O-CG2 3.04Å; V228-I232 PolarHBondContact O-N 3.26Å; V228-I242 HydrophobicContact CG1-CD1 3.97Å; V228-I242 HydrophobicContact CG1-CG1 4.45Å
229	S	98.1	Very high	98.3	Very high	39 Å²	39	24.5 Å²	24.5	27%	0.273	14%	0.139	S	C	.	.	H	α-helix	trans	-53.1	-42.4	177.7	177.1	0	0	0	0	112.3	L225 R226 P239	L225-S229 WeakPolarHBondContact O-CB 3.34Å; L225-S229 PolarHBondContact O-N 2.84Å; R226-S229 PolarHBondContact O-N 3.3Å; S229-P239 VanDerWaalsContact O-CB 3.31Å; S229-P239 WeakPolarHBondContact O-CB 3.36Å
230	E	98.4	Very high	98.2	Very high	102 Å²	102	32.7 Å²	32.7	48%	0.477	17%	0.168	S	C	.	.	H	α-helix	trans	-79.5	-29.7	-177.4	-68.7	172	-175.3	0	0	113.8	H47 R226 W227 V228	H47-E230 PolarHBondContact CD2-O 3.11Å; H47-E230 VanDerWaalsContact CD2-O 3.3Å; H47-E230 PolarHBondContact NE2-O 3.39Å; R226-E230 WeakPolarHBondContact O-CG 3.27Å; R226-E230 PolarHBondContact O-N 3.12Å; W227-E230 PolarHBondContact O-N 3.45Å; V228-E230 PolarHBondContact O-N 3.28Å
231	N	98.7	Very high	98.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-114.9	-18.3	-167.9	-65.1	-88.2	0	0	0	114.6	T46 H47 W227 V228 A233 F234 F235	T46-N231 WeakPolarHBondContact CB-OD1 3.16Å; H47-N231 WeakPolarHBondContact CB-OD1 3.39Å; H47-N231 PolarHBondContact CD2-OD1 3.03Å; H47-N231 PolarHBondContact N-OD1 3.35Å; W227-N231 HydrophobicContact CD2-CB 4.19Å; W227-N231 HydrophobicContact CE3-CB 4.22Å; W227-N231 HydrophobicContact CH2-CB 4.06Å; W227-N231 HydrophobicContact CZ2-CB 4.02Å; W227-N231 HydrophobicContact CZ3-CB 4.16Å; W227-N231 VanDerWaalsContact O-CB 3.28Å; W227-N231 WeakPolarHBondContact O-CB 3.39Å; W227-N231 PolarHBondContact O-N 2.82Å; W227-N231 PolarHBondContact O-ND2 2.99Å; V228-N231 PolarHBondContact O-N 3.21Å; N231-A233 PolarHBondContact O-N 3.29Å; N231-A233 VanDerWaalsContact O-N 3.17Å; N231-F234 HydrophobicContact CB-CD2 4.31Å; N231-F234 WeakPolarHBondContact O-CB 3.49Å; N231-F234 VanDerWaalsContact O-CD2 3.26Å; N231-F234 WeakPolarHBondContact O-CD2 3.46Å; N231-F234 PolarHBondContact O-N 3.29Å; N231-F235 WeakPolarHBondContact O-CD2 3.37Å
232	I	98.4	Very high	98.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23.1	-169.3	-156	58.6	0	0	0	113.5	V146 V162 I191 I193 V228 F234 F235 G236 G237 P239	V146-I232 HydrophobicContact CG1-CD1 4.14Å; V162-I232 HydrophobicContact CG1-CG1 4.03Å; V162-I232 HydrophobicContact CG2-CB 4.45Å; V162-I232 HydrophobicContact CG2-CG1 3.63Å; V162-I232 HydrophobicContact CG2-CG2 4.02Å; I191-I232 HydrophobicContact CD1-CD1 4.4Å; I191-I232 HydrophobicContact CD1-CG1 4.34Å; I191-I232 HydrophobicContact CG2-CD1 4Å; I193-I232 HydrophobicContact CD1-CD1 3.6Å; I193-I232 HydrophobicContact CD1-CG1 4.3Å; I193-I232 HydrophobicContact CG1-CD1 4.48Å; V228-I232 HydrophobicContact CG1-CB 4.02Å; V228-I232 HydrophobicContact CG1-CG1 4.3Å; V228-I232 HydrophobicContact CG1-CG2 4.27Å; V228-I232 WeakPolarHBondContact O-CB 3.34Å; V228-I232 WeakPolarHBondContact O-CG2 3.04Å; V228-I232 PolarHBondContact O-N 3.26Å; I232-F234 PolarHBondContact O-N 3.05Å; I232-F235 HydrophobicContact CD1-CB 4.11Å; I232-F235 HydrophobicContact CD1-CD2 4.15Å; I232-F235 HydrophobicContact CD1-CG 4.27Å; I232-F235 WeakPolarHBondContact O-CA 3.18Å; I232-F235 WeakPolarHBondContact O-CB 3.27Å; I232-F235 PolarHBondContact O-N 3.2Å; I232-G236 PolarHBondContact O-N 2.84Å; I232-G237 PolarHBondContact O-N 3Å; I232-P239 HydrophobicContact CG2-CB 4.2Å
233	A	97.9	Very high	98.2	Very high	58 Å²	58	36.7 Å²	36.7	48%	0.479	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-58	-32.5	172.3	0	0	0	0	0	112.8	N231 F235 G236 G237	N231-A233 PolarHBondContact O-N 3.29Å; N231-A233 VanDerWaalsContact O-N 3.17Å; A233-F235 PolarHBondContact O-N 2.93Å; A233-G236 PolarHBondContact O-N 2.85Å; A233-G236 VanDerWaalsContact O-N 3.09Å; A233-G237 VanDerWaalsContact CA-O 3.3Å; A233-G237 WeakPolarHBondContact CA-O 3.37Å
234	F	97.7	Very high	98.2	Very high	93 Å²	93	36 Å²	36	41%	0.408	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-68.9	-22.9	176.4	-59.7	-62.9	0	0	0	113.2	V44 N45 H47 N231 I232 G236	V44-F234 HydrophobicContact CG2-CB 3.77Å; V44-F234 WeakPolarHBondContact CG2-O 3.48Å; N45-F234 WeakPolarHBondContact O-CB 3.4Å; N45-F234 WeakPolarHBondContact O-CD1 3.49Å; N45-F234 WeakPolarHBondContact O-CD2 3.48Å; N45-F234 WeakPolarHBondContact O-CG 3.39Å; H47-F234 AromaticContact CD2-CE2 3.63Å; H47-F234 AromaticContact CE1-CZ 3.92Å; H47-F234 AromaticContact NE2-CE2 3.61Å; H47-F234 AromaticContact NE2-CZ 3.79Å; N231-F234 HydrophobicContact CB-CD2 4.31Å; N231-F234 WeakPolarHBondContact O-CB 3.49Å; N231-F234 VanDerWaalsContact O-CD2 3.26Å; N231-F234 WeakPolarHBondContact O-CD2 3.46Å; N231-F234 PolarHBondContact O-N 3.29Å; I232-F234 PolarHBondContact O-N 3.05Å; F234-G236 VanDerWaalsContact C-N 3.32Å
235	F	97.3	Very high	98.2	Very high	16 Å²	16	37 Å²	37	7%	0.07	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-90.9	3.4	174.9	-61.1	-102.3	0	0	0	112.2	V44 T46 L51 Y69 V146 V148 I191 W227 N231 I232 A233	V44-F235 HydrophobicContact CB-CE1 4.47Å; V44-F235 HydrophobicContact CG1-CD1 4.14Å; V44-F235 HydrophobicContact CG1-CE1 3.56Å; V44-F235 HydrophobicContact CG1-CE2 4.38Å; V44-F235 HydrophobicContact CG1-CZ 3.69Å; V44-F235 HydrophobicContact CG2-CD1 4.34Å; V44-F235 HydrophobicContact CG2-CD2 4.33Å; V44-F235 HydrophobicContact CG2-CE1 4.44Å; V44-F235 HydrophobicContact CG2-CE2 4.41Å; V44-F235 HydrophobicContact CG2-CG 4.3Å; V44-F235 HydrophobicContact CG2-CZ 4.47Å; T46-F235 HydrophobicContact CG2-CE2 4.01Å; T46-F235 HydrophobicContact CG2-CZ 4.15Å; L51-F235 HydrophobicContact CD1-CZ 3.94Å; Y69-F235 HydrophobicContact CD1-CE1 4.05Å; Y69-F235 AromaticContact CD2-CD1 3.85Å; Y69-F235 HydrophobicContact CD2-CD1 3.85Å; Y69-F235 AromaticContact CD2-CE1 3.67Å; Y69-F235 HydrophobicContact CD2-CE1 3.67Å; Y69-F235 HydrophobicContact CE1-CE1 4.3Å; Y69-F235 AromaticContact CE2-CD1 3.81Å; Y69-F235 HydrophobicContact CE2-CD1 3.81Å; Y69-F235 AromaticContact CE2-CE1 3.95Å; Y69-F235 HydrophobicContact CE2-CE1 3.95Å; Y69-F235 HydrophobicContact CG-CD1 4.36Å; Y69-F235 AromaticContact CG-CE1 3.71Å; Y69-F235 HydrophobicContact CG-CE1 3.71Å; V146-F235 HydrophobicContact CB-CD1 4.39Å; V146-F235 HydrophobicContact CB-CE1 4.25Å; V146-F235 HydrophobicContact CG1-CD1 3.9Å; V146-F235 HydrophobicContact CG1-CE1 4.24Å; V146-F235 HydrophobicContact CG1-CG 4.32Å; V146-F235 HydrophobicContact CG2-CE1 4.26Å; V146-F235 HydrophobicContact CG2-CZ 4.45Å; V148-F235 HydrophobicContact CG2-CB 4.09Å; V148-F235 HydrophobicContact CG2-CD1 4.12Å; I191-F235 HydrophobicContact CD1-CB 4.15Å; I191-F235 WeakPolarHBondContact CD1-O 3.49Å; W227-F235 AromaticContact CH2-CE2 3.76Å; W227-F235 HydrophobicContact CH2-CE2 3.76Å; W227-F235 AromaticContact CH2-CZ 3.93Å; W227-F235 HydrophobicContact CH2-CZ 3.93Å; W227-F235 HydrophobicContact CZ3-CE2 4.43Å; N231-F235 WeakPolarHBondContact O-CD2 3.37Å; I232-F235 HydrophobicContact CD1-CB 4.11Å; I232-F235 HydrophobicContact CD1-CD2 4.15Å; I232-F235 HydrophobicContact CD1-CG 4.27Å; I232-F235 WeakPolarHBondContact O-CA 3.18Å; I232-F235 WeakPolarHBondContact O-CB 3.27Å; I232-F235 PolarHBondContact O-N 3.2Å; A233-F235 PolarHBondContact O-N 2.93Å
236	G	95.9	Very high	98.1	Very high	36 Å²	36	37 Å²	37	37%	0.371	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	14.9	-176	0	0	0	0	0	114.5	A159 K160 I232 A233 F234	A159-G236 CarbonylContact C-O 3.5Å; A159-G236 WeakPolarHBondContact CA-O 3.34Å; K160-G236 PolarHBondContact N-O 2.82Å; I232-G236 PolarHBondContact O-N 2.84Å; A233-G236 PolarHBondContact O-N 2.85Å; A233-G236 VanDerWaalsContact O-N 3.09Å; F234-G236 VanDerWaalsContact C-N 3.32Å
237	G	97.4	Very high	98	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	156.6	176	0	0	0	0	0	113.7	K160 I191 I232 A233	K160-G237 CarbonylContact O-C 3.51Å; K160-G237 WeakPolarHBondContact O-CA 3.39Å; I191-G237 VanDerWaalsContact CD1-CA 3.48Å; I232-G237 PolarHBondContact O-N 3Å; A233-G237 VanDerWaalsContact CA-O 3.3Å; A233-G237 WeakPolarHBondContact CA-O 3.37Å
238	D	97.7	Very high	97.9	Very high	21 Å²	21	35.5 Å²	35.5	11%	0.112	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.8	175.4	-172.9	-7.8	0	0	0	110.4	A159 K160 R240 R241	A159-D238 HydrophobicContact CB-CB 3.86Å; K160-D238 PolarHBondContact O-N 2.7Å; D238-R240 PolarHBondContact O-N 2.85Å; D238-R240 VanDerWaalsContact O-N 3.09Å; D238-R240 WeakPolarHBondContact OD1-CB 3.39Å; D238-R240 PolarHBondContact OD1-N 2.9Å; D238-R240 IonicContact OD1-NE 3.64Å; D238-R241 HydrophobicContact CB-CB 4.22Å; D238-R241 HydrophobicContact CB-CG 4.37Å; D238-R241 PolarHBondContact O-N 3Å; D238-R241 IonicContact OD2-NE 3.36Å; D238-R241 PolarHBondContact OD2-NE 3.43Å
239	P	97.7	Very high	97.7	Very high	39 Å²	39	35.7 Å²	35.7	25%	0.253	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-10.7	179.7	28.6	-35.4	0	0	0	113.5	S229 I232 I242 Q268	S229-P239 VanDerWaalsContact O-CB 3.31Å; S229-P239 WeakPolarHBondContact O-CB 3.36Å; I232-P239 HydrophobicContact CG2-CB 4.2Å; P239-I242 WeakPolarHBondContact O-CD1 3.38Å; P239-Q268 PolarHBondContact O-NE2 3.03Å
240	R	97.4	Very high	97.7	Very high	191 Å²	191	33.9 Å²	33.9	72%	0.721	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	2.4	174.2	-54.6	178.8	-61	171.6	4.8	113.2	D238 Q268	D238-R240 PolarHBondContact O-N 2.85Å; D238-R240 VanDerWaalsContact O-N 3.09Å; D238-R240 WeakPolarHBondContact OD1-CB 3.39Å; D238-R240 PolarHBondContact OD1-N 2.9Å; D238-R240 IonicContact OD1-NE 3.64Å; R240-Q268 VanDerWaalsContact C-CD 3.48Å; R240-Q268 PolarHBondContact O-OE1 2.85Å
241	R	97.9	Very high	97.7	Very high	65 Å²	65	29 Å²	29	25%	0.245	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	48.8	177.1	-60.4	-166.2	-65.5	162	-5.9	111.5	D156 A159 P161 V162 D238	D156-R241 IonicContact OD2-NH1 3.66Å; D156-R241 IonicContact OD2-NH2 3.23Å; D156-R241 PolarHBondContact OD2-NH2 2.92Å; A159-R241 PolarHBondContact O-NH2 3.16Å; P161-R241 HydrophobicContact CB-CB 4.43Å; V162-R241 PolarHBondContact N-O 3.2Å; D238-R241 HydrophobicContact CB-CB 4.22Å; D238-R241 HydrophobicContact CB-CG 4.37Å; D238-R241 PolarHBondContact O-N 3Å; D238-R241 IonicContact OD2-NE 3.36Å; D238-R241 PolarHBondContact OD2-NE 3.43Å
242	I	98.8	Very high	97.7	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.7	172.5	-59.6	169.9	0	0	0	109.1	V162 V164 V228 P239 V244 L266 F267 Q268 R269	V162-I242 HydrophobicContact CB-CG1 4.13Å; V162-I242 CarbonylContact O-C 3.53Å; V162-I242 WeakPolarHBondContact O-CA 3.32Å; V164-I242 HydrophobicContact CG2-CG2 3.93Å; V228-I242 HydrophobicContact CG1-CD1 3.97Å; V228-I242 HydrophobicContact CG1-CG1 4.45Å; P239-I242 WeakPolarHBondContact O-CD1 3.38Å; I242-V244 HydrophobicContact CG2-CG2 4.42Å; I242-L266 WeakPolarHBondContact CD1-O 3.46Å; I242-F267 HydrophobicContact CB-CB 4.07Å; I242-F267 HydrophobicContact CG2-CB 3.71Å; I242-Q268 PolarHBondContact O-N 3.4Å; I242-Q268 PolarHBondContact O-OE1 3.22Å; I242-R269 PolarHBondContact O-N 2.02Å
243	T	98.9	Very high	97.7	Very high	19 Å²	19	29 Å²	29	12%	0.117	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.3	170.2	-60.2	0	0	0	0	108.4	V162 M163 V164 R269 I271	V162-T243 PolarHBondContact O-N 2.72Å; M163-T243 CarbonylContact C-O 3.55Å; M163-T243 VanDerWaalsContact CA-O 3.32Å; M163-T243 WeakPolarHBondContact CA-O 3.49Å; V164-T243 PolarHBondContact N-O 2.78Å; T243-R269 CarbonylContact C-O 3.54Å; T243-R269 WeakPolarHBondContact CA-O 3.32Å; T243-R269 HydrophobicContact CG2-CB 3.96Å; T243-I271 HydrophobicContact CG2-CD1 3.99Å; T243-I271 HydrophobicContact CG2-CG1 3.86Å
244	V	98.9	Very high	97.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.3	173.8	-167.6	0	0	0	0	108.7	V164 I166 L225 I242 V254 F267 R269 A270 I271	V164-V244 CarbonylContact O-C 3.41Å; V164-V244 WeakPolarHBondContact O-CA 3.28Å; I166-V244 HydrophobicContact CD1-CG1 3.58Å; I166-V244 HydrophobicContact CG1-CG1 3.9Å; L225-V244 HydrophobicContact CD1-CG2 4.3Å; L225-V244 HydrophobicContact CD2-CG2 3.61Å; I242-V244 HydrophobicContact CG2-CG2 4.42Å; V244-V254 HydrophobicContact CG1-CG2 3.77Å; V244-F267 HydrophobicContact CB-CD2 4.43Å; V244-F267 HydrophobicContact CB-CG 4.5Å; V244-F267 HydrophobicContact CG2-CB 3.61Å; V244-F267 HydrophobicContact CG2-CD1 3.72Å; V244-F267 HydrophobicContact CG2-CD2 3.81Å; V244-F267 HydrophobicContact CG2-CE1 4.29Å; V244-F267 HydrophobicContact CG2-CE2 4.39Å; V244-F267 HydrophobicContact CG2-CG 3.44Å; V244-F267 VanDerWaalsContact CG2-CG 3.44Å; V244-R269 PolarHBondContact N-O 3.43Å; V244-A270 CarbonylContact O-C 3.11Å; V244-A270 VanDerWaalsContact O-CA 3.26Å; V244-A270 WeakPolarHBondContact O-CA 3.3Å; V244-I271 PolarHBondContact O-N 2.85Å
245	F	98.9	Very high	97.8	Very high	21 Å²	21	21.8 Å²	21.8	9%	0.092	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	154.2	178.4	73.2	-62.7	0	0	0	112.1	M163 V164 Y165 I166 L184 I271	M163-F245 HydrophobicContact CB-CD1 4.23Å; M163-F245 HydrophobicContact CB-CE1 3.8Å; M163-F245 HydrophobicContact CE-CD1 4.14Å; M163-F245 HydrophobicContact CE-CE1 4.19Å; M163-F245 HydrophobicContact CE-CG 4.36Å; M163-F245 HydrophobicContact CE-CZ 4.42Å; V164-F245 VanDerWaalsContact O-CD1 3.31Å; V164-F245 WeakPolarHBondContact O-CD1 3.32Å; V164-F245 PolarHBondContact O-N 2.89Å; Y165-F245 CarbonylContact C-O 3.49Å; Y165-F245 VanDerWaalsContact CA-O 3.28Å; Y165-F245 WeakPolarHBondContact CA-O 3.48Å; Y165-F245 HydrophobicContact CD2-CD1 4.3Å; Y165-F245 AromaticContact CD2-CD2 3.66Å; Y165-F245 HydrophobicContact CD2-CD2 3.66Å; Y165-F245 HydrophobicContact CD2-CE1 4.06Å; Y165-F245 AromaticContact CD2-CE2 3.4Å; Y165-F245 HydrophobicContact CD2-CE2 3.4Å; Y165-F245 VanDerWaalsContact CD2-CE2 3.4Å; Y165-F245 HydrophobicContact CD2-CG 4.1Å; Y165-F245 AromaticContact CD2-CZ 3.61Å; Y165-F245 HydrophobicContact CD2-CZ 3.61Å; Y165-F245 HydrophobicContact CE2-CD2 4.26Å; Y165-F245 HydrophobicContact CE2-CE2 4.1Å; Y165-F245 HydrophobicContact CG-CE1 4.3Å; Y165-F245 HydrophobicContact CG-CE2 4.26Å; Y165-F245 HydrophobicContact CG-CZ 4.01Å; I166-F245 PolarHBondContact N-O 3.23Å; L184-F245 HydrophobicContact CD2-CZ 4.13Å; F245-I271 VanDerWaalsContact CA-O 3.26Å; F245-I271 WeakPolarHBondContact CA-O 3.39Å; F245-I271 HydrophobicContact CB-CB 3.64Å; F245-I271 HydrophobicContact CB-CD1 4.45Å; F245-I271 HydrophobicContact CB-CG1 4.27Å
246	G	98.4	Very high	97.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	166.7	-179.2	0	0	0	0	0	111.2	I166 A251 I271 Q273	I166-G246 VanDerWaalsContact O-CA 3.29Å; I166-G246 WeakPolarHBondContact O-CA 3.48Å; G246-A251 WeakPolarHBondContact O-CB 3.31Å; G246-I271 PolarHBondContact N-O 3.48Å; G246-Q273 VanDerWaalsContact O-CB 3.3Å; G246-Q273 WeakPolarHBondContact O-CB 3.35Å; G246-Q273 PolarHBondContact O-N 3.02Å; G246-Q273 VanDerWaalsContact O-N 3.1Å
247	S	96.8	Very high	98	Very high	26 Å²	26	19.4 Å²	19.4	18%	0.182	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.2	176.4	-173.9	0	0	0	0	112.5	I249 G250 Q273	S247-I249 PolarHBondContact O-N 3.16Å; S247-G250 PolarHBondContact O-N 3.19Å; S247-Q273 CarbonylContact C-O 3.6Å; S247-Q273 WeakPolarHBondContact CA-O 3.46Å; S247-Q273 PolarHBondContact OG-O 2.91Å
248	G	95.4	Very high	98.1	Very high	18 Å²	18	19.5 Å²	19.5	19%	0.186	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-125.9	-177.8	0	0	0	0	0	110.6	G250 A251 S252 Q273 S274	G248-G250 PolarHBondContact O-N 3.16Å; G248-A251 WeakPolarHBondContact O-CA 3.35Å; G248-A251 VanDerWaalsContact O-CB 3.26Å; G248-A251 WeakPolarHBondContact O-CB 3.5Å; G248-A251 PolarHBondContact O-N 2.66Å; G248-S252 PolarHBondContact O-N 3.21Å; G248-Q273 PolarHBondContact N-O 3.25Å; G248-S274 VanDerWaalsContact CA-O 3.32Å; G248-S274 WeakPolarHBondContact CA-O 3.12Å
249	I	95.1	Very high	98.1	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.026	9%	0.089	C	C	.	.	H	α-helix	trans	-56.6	-32.7	171.7	-71.8	-48.3	0	0	0	113.2	G169 Y171 S247 A251 S252 C253	G169-I249 WeakPolarHBondContact O-CB 3.46Å; G169-I249 WeakPolarHBondContact O-CG1 3.35Å; Y171-I249 HydrophobicContact CD1-CG2 3.38Å; Y171-I249 HydrophobicContact CD2-CD1 3.96Å; Y171-I249 HydrophobicContact CD2-CG1 4.26Å; Y171-I249 HydrophobicContact CD2-CG2 3.86Å; Y171-I249 HydrophobicContact CE1-CG2 3.3Å; Y171-I249 HydrophobicContact CE2-CD1 3.43Å; Y171-I249 VanDerWaalsContact CE2-CD1 3.43Å; Y171-I249 HydrophobicContact CE2-CG1 4.12Å; Y171-I249 HydrophobicContact CE2-CG2 3.77Å; Y171-I249 HydrophobicContact CG-CG2 3.66Å; Y171-I249 VanDerWaalsContact CZ-CG2 3.47Å; S247-I249 PolarHBondContact O-N 3.16Å; I249-A251 PolarHBondContact O-N 3.07Å; I249-S252 WeakPolarHBondContact O-CB 3.22Å; I249-S252 PolarHBondContact O-N 3.01Å; I249-C253 PolarHBondContact O-N 3.49Å; I249-C253 PolarHBondContact O-SG 2.85Å; I249-C253 VanDerWaalsContact O-SG 3.37Å
250	G	98	Very high	98.1	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.7	-35.4	173.9	0	0	0	0	0	111.7	I166 H167 S247 G248 C253 V254	I166-G250 WeakPolarHBondContact O-CA 3.26Å; H167-G250 WeakPolarHBondContact O-CA 3.2Å; S247-G250 PolarHBondContact O-N 3.19Å; G248-G250 PolarHBondContact O-N 3.16Å; G250-C253 WeakPolarHBondContact O-CB 3.44Å; G250-C253 PolarHBondContact O-N 3.42Å; G250-V254 WeakPolarHBondContact O-CG2 3.46Å; G250-V254 PolarHBondContact O-N 3.06Å
251	A	98.6	Very high	98	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-71.3	-37.8	174.1	0	0	0	0	0	111.9	G246 G248 I249 C253 V254 S255 I272 Q273	G246-A251 WeakPolarHBondContact O-CB 3.31Å; G248-A251 WeakPolarHBondContact O-CA 3.35Å; G248-A251 VanDerWaalsContact O-CB 3.26Å; G248-A251 WeakPolarHBondContact O-CB 3.5Å; G248-A251 PolarHBondContact O-N 2.66Å; I249-A251 PolarHBondContact O-N 3.07Å; A251-C253 VanDerWaalsContact C-N 3.33Å; A251-C253 PolarHBondContact O-N 2.87Å; A251-V254 PolarHBondContact O-N 3.37Å; A251-S255 WeakPolarHBondContact O-CB 3.26Å; A251-S255 PolarHBondContact O-N 2.91Å; A251-I272 HydrophobicContact CB-CG2 3.76Å; A251-Q273 WeakPolarHBondContact CB-O 3.41Å
252	S	98.6	Very high	98	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.2	-42	170.6	-63	0	0	0	0	111.6	Y171 G248 I249 S255 L256 S276	Y171-S252 VanDerWaalsContact OH-CB 3.29Å; Y171-S252 WeakPolarHBondContact OH-CB 3.32Å; G248-S252 PolarHBondContact O-N 3.21Å; I249-S252 WeakPolarHBondContact O-CB 3.22Å; I249-S252 PolarHBondContact O-N 3.01Å; S252-S255 PolarHBondContact O-N 3.22Å; S252-L256 WeakPolarHBondContact O-CB 3.4Å; S252-L256 VanDerWaalsContact O-CG 3.28Å; S252-L256 WeakPolarHBondContact O-CG 3.41Å; S252-L256 PolarHBondContact O-N 3.38Å; S252-S276 WeakPolarHBondContact CB-O 3.14Å; S252-S276 PolarHBondContact OG-O 3.23Å
253	C	98.8	Very high	97.9	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-57.7	-49.5	170.7	-68.4	0	0	0	0	111.6	I166 Y171 L218 Q221 I249 G250 A251 S255 L256 L257	I166-C253 HydrophobicContact CG2-CB 3.86Å; Y171-C253 VanDerWaalsContact CE1-SG 3.57Å; L218-C253 HydrophobicContact CD2-CB 4.26Å; Q221-C253 PolarHBondContact NE2-SG 3.18Å; Q221-C253 VanDerWaalsContact NE2-SG 3.38Å; I249-C253 PolarHBondContact O-N 3.49Å; I249-C253 PolarHBondContact O-SG 2.85Å; I249-C253 VanDerWaalsContact O-SG 3.37Å; G250-C253 WeakPolarHBondContact O-CB 3.44Å; G250-C253 PolarHBondContact O-N 3.42Å; A251-C253 VanDerWaalsContact C-N 3.33Å; A251-C253 PolarHBondContact O-N 2.87Å; C253-S255 VanDerWaalsContact C-N 3.31Å; C253-S255 PolarHBondContact O-N 2.96Å; C253-L256 PolarHBondContact O-N 2.58Å; C253-L256 VanDerWaalsContact O-N 3.15Å; C253-L257 VanDerWaalsContact O-CG 3.27Å; C253-L257 WeakPolarHBondContact O-CG 3.38Å; C253-L257 PolarHBondContact O-N 2.79Å
254	V	98.8	Very high	97.7	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.3	-45.2	177.3	174.3	0	0	0	0	111.4	I166 V244 G250 A251 L256 L257 T258 A270 I272	I166-V254 HydrophobicContact CB-CG2 4.44Å; I166-V254 HydrophobicContact CD1-CG2 4.02Å; I166-V254 HydrophobicContact CG1-CG2 4.44Å; V244-V254 HydrophobicContact CG1-CG2 3.77Å; G250-V254 WeakPolarHBondContact O-CG2 3.46Å; G250-V254 PolarHBondContact O-N 3.06Å; A251-V254 PolarHBondContact O-N 3.37Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 2.9Å; V254-L257 PolarHBondContact O-N 3.25Å; V254-T258 PolarHBondContact O-N 2.83Å; V254-T258 VanDerWaalsContact O-N 3.09Å; V254-A270 HydrophobicContact CG1-CB 3.66Å; V254-I272 HydrophobicContact CB-CG1 4.47Å; V254-I272 HydrophobicContact CG1-CG1 3.89Å
255	S	98.6	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-39.1	176.9	-170.3	0	0	0	0	112.4	A251 S252 C253 T258 L259 A277	A251-S255 WeakPolarHBondContact O-CB 3.26Å; A251-S255 PolarHBondContact O-N 2.91Å; S252-S255 PolarHBondContact O-N 3.22Å; C253-S255 VanDerWaalsContact C-N 3.31Å; C253-S255 PolarHBondContact O-N 2.96Å; S255-T258 PolarHBondContact O-N 3.37Å; S255-T258 PolarHBondContact O-OG1 3.41Å; S255-L259 WeakPolarHBondContact O-CG 3.39Å; S255-A277 WeakPolarHBondContact OG-CB 3.44Å; S255-A277 PolarHBondContact OG-N 3.37Å
256	L	98.8	Very high	97.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-70.5	-37.4	176.3	-72.1	164.5	0	0	0	111.8	L218 S252 C253 V254 T258 L259 S260 A277 V283 P336 I343 P347	L218-L256 HydrophobicContact CD1-CB 4.42Å; L218-L256 HydrophobicContact CD1-CD1 4.4Å; S252-L256 WeakPolarHBondContact O-CB 3.4Å; S252-L256 VanDerWaalsContact O-CG 3.28Å; S252-L256 WeakPolarHBondContact O-CG 3.41Å; S252-L256 PolarHBondContact O-N 3.38Å; C253-L256 PolarHBondContact O-N 2.58Å; C253-L256 VanDerWaalsContact O-N 3.15Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 2.9Å; L256-T258 VanDerWaalsContact C-N 3.29Å; L256-T258 PolarHBondContact O-N 3.25Å; L256-L259 PolarHBondContact O-N 3.02Å; L256-S260 PolarHBondContact O-N 3.23Å; L256-A277 HydrophobicContact CD2-CB 3.81Å; L256-A277 HydrophobicContact CG-CB 3.93Å; L256-V283 HydrophobicContact CD2-CG2 4.3Å; L256-P336 HydrophobicContact CD1-CB 3.65Å; L256-P336 HydrophobicContact CD1-CG 3.51Å; L256-I343 HydrophobicContact CB-CD1 4.03Å; L256-I343 HydrophobicContact CD2-CD1 3.88Å; L256-I343 HydrophobicContact CD2-CG1 4.43Å; L256-P347 HydrophobicContact CD2-CG 3.97Å
257	L	98.8	Very high	97.5	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-63	-35.7	175.7	-70.5	173.6	0	0	0	111.8	I166 Q221 I222 L225 C253 V254 L259 S260 S263 F267	I166-L257 HydrophobicContact CD1-CD1 3.39Å; Q221-L257 HydrophobicContact CB-CD1 4.25Å; I222-L257 HydrophobicContact CD1-CD2 3.95Å; I222-L257 HydrophobicContact CG1-CD2 3.46Å; I222-L257 VanDerWaalsContact CG1-CD2 3.46Å; L225-L257 HydrophobicContact CD1-CD1 4.08Å; C253-L257 VanDerWaalsContact O-CG 3.27Å; C253-L257 WeakPolarHBondContact O-CG 3.38Å; C253-L257 PolarHBondContact O-N 2.79Å; V254-L257 PolarHBondContact O-N 3.25Å; L257-L259 PolarHBondContact O-N 3.32Å; L257-S260 PolarHBondContact O-N 2.83Å; L257-S263 WeakPolarHBondContact O-CB 3.31Å; L257-S263 PolarHBondContact O-OG 3.47Å; L257-F267 HydrophobicContact CB-CE1 4.27Å; L257-F267 HydrophobicContact CB-CZ 4.27Å
258	T	98.3	Very high	97.6	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.012	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.2	174.4	56.7	0	0	0	0	113.8	V254 S255 L256 F267 A270 F356 Y359	V254-T258 PolarHBondContact O-N 2.83Å; V254-T258 VanDerWaalsContact O-N 3.09Å; S255-T258 PolarHBondContact O-N 3.37Å; S255-T258 PolarHBondContact O-OG1 3.41Å; L256-T258 VanDerWaalsContact C-N 3.29Å; L256-T258 PolarHBondContact O-N 3.25Å; T258-F267 HydrophobicContact CG2-CE2 3.85Å; T258-F267 HydrophobicContact CG2-CZ 3.89Å; T258-A270 HydrophobicContact CG2-CB 3.94Å; T258-F356 WeakPolarHBondContact O-CA 3.39Å; T258-F356 VanDerWaalsContact O-CB 3.3Å; T258-F356 WeakPolarHBondContact O-CB 3.35Å; T258-Y359 HydrophobicContact CG2-CD2 3.87Å; T258-Y359 HydrophobicContact CG2-CE2 4.16Å; T258-Y359 HydrophobicContact CG2-CG 4.24Å; T258-Y359 WeakPolarHBondContact O-CE2 3.45Å
259	L	98.1	Very high	97.8	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.4	178.9	-61.4	169.7	0	0	0	112.8	S255 L256 L257 A277 P347 L350 M351 F356	S255-L259 WeakPolarHBondContact O-CG 3.39Å; L256-L259 PolarHBondContact O-N 3.02Å; L257-L259 PolarHBondContact O-N 3.32Å; L259-A277 HydrophobicContact CD1-CB 4.14Å; L259-P347 HydrophobicContact CD1-CB 3.87Å; L259-L350 HydrophobicContact CB-CB 4.38Å; L259-L350 HydrophobicContact CB-CD1 4.07Å; L259-L350 HydrophobicContact CD1-CB 4.49Å; L259-L350 HydrophobicContact CD2-CB 3.95Å; L259-M351 HydrophobicContact CD1-CE 3.87Å; L259-M351 HydrophobicContact CD1-CG 4.12Å; L259-M351 HydrophobicContact CD2-CG 3.66Å; L259-M351 HydrophobicContact CG-CG 4.49Å; L259-F356 HydrophobicContact CD2-CB 3.82Å; L259-F356 HydrophobicContact CD2-CD1 4.44Å; L259-F356 HydrophobicContact CD2-CD2 4.17Å; L259-F356 HydrophobicContact CD2-CG 3.9Å
260	S	97.9	Very high	97.9	Very high	4 Å²	4	23 Å²	23	3%	0.028	12%	0.122	C	C	.	.			trans	-96.8	125.6	-177.9	-172.1	0	0	0	0	111.1	L256 L257 H262 S263 V342	L256-S260 PolarHBondContact O-N 3.23Å; L257-S260 PolarHBondContact O-N 2.83Å; S260-H262 PolarHBondContact O-N 2.82Å; S260-H262 VanDerWaalsContact O-N 3.13Å; S260-H262 PolarHBondContact OG-N 2.77Å; S260-S263 WeakPolarHBondContact O-CB 3.28Å; S260-S263 PolarHBondContact O-N 3.26Å; S260-V342 WeakPolarHBondContact CB-O 3.41Å; S260-V342 PolarHBondContact OG-O 2.93Å
261	H	96.4	Very high	98	Very high	84 Å²	84	24.4 Å²	24.4	39%	0.389	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-60.6	-22.7	174.5	72.3	-91.3	0	0	0	112.9	S263 E264 D341	H261-S263 PolarHBondContact O-N 2.95Å; H261-E264 PolarHBondContact O-N 2.9Å; H261-D341 PolarHBondContact CE1-O 3.16Å; H261-D341 IonicContact CE1-OD1 2.73Å; H261-D341 PolarHBondContact CE1-OD1 2.6Å; H261-D341 PolarHBondContact ND1-O 3.2Å; H261-D341 IonicContact NE2-OD1 3.77Å
262	H	97.3	Very high	98	Very high	49 Å²	49	24.5 Å²	24.5	23%	0.227	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-68.4	-16.2	176.3	-75	-88.9	0	0	0	113.9	I222 R226 S260 D341	I222-H262 HydrophobicContact CD1-CB 3.81Å; I222-H262 HydrophobicContact CG2-CB 4.37Å; R226-H262 PolarHBondContact NH2-O 2.53Å; S260-H262 PolarHBondContact O-N 2.82Å; S260-H262 VanDerWaalsContact O-N 3.13Å; S260-H262 PolarHBondContact OG-N 2.77Å; H262-D341 IonicContact CD2-OD1 2.83Å; H262-D341 IonicContact CE1-OD1 3.5Å; H262-D341 IonicContact NE2-OD1 2.82Å; H262-D341 PolarHBondContact NE2-OD1 2.79Å
263	S	96.6	Very high	98	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-94.2	-8.4	-178.7	-60.9	0	0	0	0	113.9	L257 S260 H261 G265 L266	L257-S263 WeakPolarHBondContact O-CB 3.31Å; L257-S263 PolarHBondContact O-OG 3.47Å; S260-S263 WeakPolarHBondContact O-CB 3.28Å; S260-S263 PolarHBondContact O-N 3.26Å; H261-S263 PolarHBondContact O-N 2.95Å; S263-G265 PolarHBondContact O-N 3.37Å; S263-L266 WeakPolarHBondContact O-CB 3.25Å; S263-L266 PolarHBondContact O-N 3.3Å; S263-L266 VanDerWaalsContact O-N 3.11Å
264	E	94.9	Very high	97.9	Very high	121 Å²	121	26.9 Å²	26.9	57%	0.565	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	131.1	-176.1	-74.1	-179.8	-160.2	0	0	111.9	H261 L266	H261-E264 PolarHBondContact O-N 2.9Å; E264-L266 PolarHBondContact O-N 3.33Å
265	G	95.5	Very high	97.8	Very high	62 Å²	62	27 Å²	27	64%	0.639	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	-4.1	179.3	0	0	0	0	0	115.7	S263	S263-G265 PolarHBondContact O-N 3.37Å
266	L	98.2	Very high	97.8	Very high	20 Å²	20	27 Å²	27	11%	0.105	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-25.5	180	-58.3	-174.5	0	0	0	113.7	I222 L225 R226 I242 S263 E264	I222-L266 HydrophobicContact CG2-CD1 3.89Å; L225-L266 HydrophobicContact CB-CB 4.11Å; L225-L266 HydrophobicContact CB-CD1 4.07Å; R226-L266 HydrophobicContact CG-CD1 3.69Å; R226-L266 HydrophobicContact CG-CD2 3.69Å; R226-L266 HydrophobicContact CG-CG 4.38Å; I242-L266 WeakPolarHBondContact CD1-O 3.46Å; S263-L266 WeakPolarHBondContact O-CB 3.25Å; S263-L266 PolarHBondContact O-N 3.3Å; S263-L266 VanDerWaalsContact O-N 3.11Å; E264-L266 PolarHBondContact O-N 3.33Å
267	F	98.6	Very high	97.7	Very high	5 Å²	5	27 Å²	27	2%	0.022	14%	0.142	C	C	.	.			trans	-150.7	167.5	174.8	63.9	-88.4	0	0	0	110.8	L225 I242 V244 L257 T258 Y359	L225-F267 HydrophobicContact CD1-CD1 3.94Å; L225-F267 HydrophobicContact CD1-CE1 4.16Å; I242-F267 HydrophobicContact CB-CB 4.07Å; I242-F267 HydrophobicContact CG2-CB 3.71Å; V244-F267 HydrophobicContact CB-CD2 4.43Å; V244-F267 HydrophobicContact CB-CG 4.5Å; V244-F267 HydrophobicContact CG2-CB 3.61Å; V244-F267 HydrophobicContact CG2-CD1 3.72Å; V244-F267 HydrophobicContact CG2-CD2 3.81Å; V244-F267 HydrophobicContact CG2-CE1 4.29Å; V244-F267 HydrophobicContact CG2-CE2 4.39Å; V244-F267 HydrophobicContact CG2-CG 3.44Å; V244-F267 VanDerWaalsContact CG2-CG 3.44Å; L257-F267 HydrophobicContact CB-CE1 4.27Å; L257-F267 HydrophobicContact CB-CZ 4.27Å; T258-F267 HydrophobicContact CG2-CE2 3.85Å; T258-F267 HydrophobicContact CG2-CZ 3.89Å; F267-Y359 AromaticContact CD2-CD1 3.84Å; F267-Y359 HydrophobicContact CD2-CD1 3.84Å; F267-Y359 AromaticContact CD2-CE1 3.8Å; F267-Y359 HydrophobicContact CD2-CE1 3.8Å; F267-Y359 HydrophobicContact CE1-CE1 4.48Å; F267-Y359 AromaticContact CE2-CD1 3.58Å; F267-Y359 HydrophobicContact CE2-CD1 3.58Å; F267-Y359 AromaticContact CE2-CE1 3.47Å; F267-Y359 HydrophobicContact CE2-CE1 3.47Å; F267-Y359 VanDerWaalsContact CE2-CE1 3.47Å; F267-Y359 HydrophobicContact CE2-CG 4.25Å; F267-Y359 HydrophobicContact CG-CE1 4.42Å; F267-Y359 HydrophobicContact CZ-CD1 4.37Å; F267-Y359 AromaticContact CZ-CE1 3.85Å; F267-Y359 HydrophobicContact CZ-CE1 3.85Å; F267-Y359 WeakPolarHBondContact O-CE1 3.03Å
268	Q	98.3	Very high	97.7	Very high	47 Å²	47	28.9 Å²	28.9	22%	0.22	15%	0.152	C	C	.	.	S	Bend	trans	-120.1	-20.4	-173.4	-59.7	79	40.1	0	0	113.1	P239 R240 I242 Y359 D360	P239-Q268 PolarHBondContact O-NE2 3.03Å; R240-Q268 VanDerWaalsContact C-CD 3.48Å; R240-Q268 PolarHBondContact O-OE1 2.85Å; I242-Q268 PolarHBondContact O-N 3.4Å; I242-Q268 PolarHBondContact O-OE1 3.22Å; Q268-Y359 WeakPolarHBondContact O-CA 3.32Å; Q268-D360 PolarHBondContact O-N 3.13Å
269	R	98.8	Very high	97.6	Very high	81 Å²	81	29 Å²	29	31%	0.306	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.3	-176	-46	-172.9	-175.4	77.3	8.6	111.6	I242 T243 V244 D360	I242-R269 PolarHBondContact O-N 2.02Å; T243-R269 CarbonylContact C-O 3.54Å; T243-R269 WeakPolarHBondContact CA-O 3.32Å; T243-R269 HydrophobicContact CG2-CB 3.96Å; V244-R269 PolarHBondContact N-O 3.43Å; R269-D360 CarbonylContact C-O 3.59Å; R269-D360 VanDerWaalsContact CA-O 3.23Å; R269-D360 WeakPolarHBondContact CA-O 3.2Å; R269-D360 HydrophobicContact CB-CB 4.27Å; R269-D360 HydrophobicContact CG-CB 3.9Å; R269-D360 IonicContact NE-OD2 3.36Å; R269-D360 PolarHBondContact NE-OD2 3.3Å
270	A	98.8	Very high	97.5	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139	177.1	0	0	0	0	0	111.3	V244 V254 T258 I272 D360 I361 M362	V244-A270 CarbonylContact O-C 3.11Å; V244-A270 VanDerWaalsContact O-CA 3.26Å; V244-A270 WeakPolarHBondContact O-CA 3.3Å; V254-A270 HydrophobicContact CG1-CB 3.66Å; T258-A270 HydrophobicContact CG2-CB 3.94Å; A270-I272 HydrophobicContact CB-CG1 4.38Å; A270-D360 PolarHBondContact N-O 3.42Å; A270-I361 HydrophobicContact CB-CG1 4.27Å; A270-I361 WeakPolarHBondContact O-CA 3.47Å; A270-M362 PolarHBondContact O-N 3.25Å
271	I	98.9	Very high	97.3	Very high	30 Å²	30	30 Å²	30	15%	0.154	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	113.7	167	-47.2	176.8	0	0	0	109.2	M163 T243 V244 F245 G246 Q273 M362	M163-I271 HydrophobicContact CE-CD1 4.04Å; T243-I271 HydrophobicContact CG2-CD1 3.99Å; T243-I271 HydrophobicContact CG2-CG1 3.86Å; V244-I271 PolarHBondContact O-N 2.85Å; F245-I271 VanDerWaalsContact CA-O 3.26Å; F245-I271 WeakPolarHBondContact CA-O 3.39Å; F245-I271 HydrophobicContact CB-CB 3.64Å; F245-I271 HydrophobicContact CB-CD1 4.45Å; F245-I271 HydrophobicContact CB-CG1 4.27Å; G246-I271 PolarHBondContact N-O 3.48Å; I271-Q273 HydrophobicContact CG2-CG 3.93Å; I271-M362 CarbonylContact C-O 3.56Å; I271-M362 WeakPolarHBondContact CA-O 3.48Å; I271-M362 HydrophobicContact CG1-CB 4.24Å; I271-M362 HydrophobicContact CG2-CB 4.19Å; I271-M362 HydrophobicContact CG2-CG 4.25Å; I271-M362 HydrophobicContact CG2-SD 4.36Å
272	I	98.8	Very high	97.4	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	94.5	-169.9	-55.2	175.5	0	0	0	108.4	A251 V254 A270 G275 I361 M362 L363 G364	A251-I272 HydrophobicContact CB-CG2 3.76Å; V254-I272 HydrophobicContact CB-CG1 4.47Å; V254-I272 HydrophobicContact CG1-CG1 3.89Å; A270-I272 HydrophobicContact CB-CG1 4.38Å; I272-G275 WeakPolarHBondContact CG2-O 3.29Å; I272-I361 HydrophobicContact CD1-CG2 3.95Å; I272-I361 HydrophobicContact CG1-CG2 4.43Å; I272-M362 PolarHBondContact N-O 3.01Å; I272-L363 HydrophobicContact CB-CB 3.92Å; I272-L363 VanDerWaalsContact O-CA 3.28Å; I272-L363 WeakPolarHBondContact O-CA 3.48Å; I272-G364 PolarHBondContact O-N 3.5Å
273	Q	98.6	Very high	97.4	Very high	46 Å²	46	23.9 Å²	23.9	22%	0.215	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.3	-172.3	-54.3	172.2	-161.6	0	0	111.6	G246 S247 G248 A251 I271 G275 Y464	G246-Q273 VanDerWaalsContact O-CB 3.3Å; G246-Q273 WeakPolarHBondContact O-CB 3.35Å; G246-Q273 PolarHBondContact O-N 3.02Å; G246-Q273 VanDerWaalsContact O-N 3.1Å; S247-Q273 CarbonylContact C-O 3.6Å; S247-Q273 WeakPolarHBondContact CA-O 3.46Å; S247-Q273 PolarHBondContact OG-O 2.91Å; G248-Q273 PolarHBondContact N-O 3.25Å; A251-Q273 WeakPolarHBondContact CB-O 3.41Å; I271-Q273 HydrophobicContact CG2-CG 3.93Å; Q273-G275 VanDerWaalsContact C-N 3.34Å; Q273-G275 PolarHBondContact O-N 3.49Å; Q273-Y464 WeakPolarHBondContact CA-OH 3.42Å; Q273-Y464 VanDerWaalsContact CB-OH 3.32Å; Q273-Y464 WeakPolarHBondContact CB-OH 3.33Å; Q273-Y464 WeakPolarHBondContact CG-OH 2.93Å
274	S	97.6	Very high	97.5	Very high	5 Å²	5	24.1 Å²	24.1	4%	0.035	13%	0.133	C	C	.	.	S	Bend	trans	57.2	44.7	173.4	-54.4	0	0	0	0	113.2	G248 G364 N366 E369 W443	G248-S274 VanDerWaalsContact CA-O 3.32Å; G248-S274 WeakPolarHBondContact CA-O 3.12Å; S274-G364 PolarHBondContact N-O 3.41Å; S274-N366 PolarHBondContact OG-ND2 3.46Å; S274-E369 WeakPolarHBondContact CB-OE1 3.18Å; S274-E369 PolarHBondContact OG-OE1 3.03Å; S274-W443 VanDerWaalsContact C-CD1 3.49Å; S274-W443 PolarHBondContact O-NE1 2.95Å
275	G	96.8	Very high	97.6	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.01	13%	0.129	C	C	.	.			trans	-169.9	166.3	174.3	0	0	0	0	0	111.3	I272 Q273	I272-G275 WeakPolarHBondContact CG2-O 3.29Å; Q273-G275 VanDerWaalsContact C-N 3.34Å; Q273-G275 PolarHBondContact O-N 3.49Å
276	S	97.4	Very high	97.7	Very high	1 Å²	1	26 Å²	26	1%	0.007	12%	0.12	C	C	.	.			trans	-155.2	160.3	179.9	179.3	0	0	0	0	109.3	S252 L278 A282 P446 T450	S252-S276 WeakPolarHBondContact CB-O 3.14Å; S252-S276 PolarHBondContact OG-O 3.23Å; S276-L278 PolarHBondContact O-N 3.23Å; S276-L278 PolarHBondContact OG-N 2.89Å; S276-A282 VanDerWaalsContact O-CB 3.32Å; S276-A282 WeakPolarHBondContact O-CB 3.31Å; S276-P446 PolarHBondContact OG-O 2.92Å; S276-T450 PolarHBondContact OG-OG1 3.38Å
277	A	97.9	Very high	97.7	Very high	1 Å²	1	26 Å²	26	1%	0.008	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-11.5	168	0	0	0	0	0	112.9	S255 L256 L259 A282 P347 M351	S255-A277 WeakPolarHBondContact OG-CB 3.44Å; S255-A277 PolarHBondContact OG-N 3.37Å; L256-A277 HydrophobicContact CD2-CB 3.81Å; L256-A277 HydrophobicContact CG-CB 3.93Å; L259-A277 HydrophobicContact CD1-CB 4.14Å; A277-A282 WeakPolarHBondContact O-CB 3.43Å; A277-P347 HydrophobicContact CB-CB 3.78Å; A277-P347 HydrophobicContact CB-CG 4.26Å; A277-M351 HydrophobicContact CB-CE 3.99Å
278	L	98.1	Very high	97.7	Very high	41 Å²	41	29.4 Å²	29.4	22%	0.215	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-10.7	-175.8	-54.3	178.8	0	0	0	114.3	S276 P347 E348 M351 P446 V449	S276-L278 PolarHBondContact O-N 3.23Å; S276-L278 PolarHBondContact OG-N 2.89Å; L278-P347 HydrophobicContact CD2-CB 4.09Å; L278-E348 HydrophobicContact CD2-CB 3.83Å; L278-E348 HydrophobicContact CD2-CG 4.48Å; L278-M351 HydrophobicContact CD1-CE 4.46Å; L278-M351 HydrophobicContact CD1-SD 3.95Å; L278-M351 HydrophobicContact CD2-CE 4.25Å; L278-M351 HydrophobicContact CD2-SD 4.17Å; L278-M351 HydrophobicContact CG-CE 4.08Å; L278-M351 HydrophobicContact CG-SD 4.13Å; L278-P446 HydrophobicContact CB-CB 4.11Å; L278-V449 HydrophobicContact CD1-CB 4Å; L278-V449 HydrophobicContact CD1-CG1 3.59Å
279	S	96.1	Very high	97.6	Very high	5 Å²	5	31.9 Å²	31.9	4%	0.035	15%	0.153	C	C	.	.	S	Bend	trans	-65.6	148.5	177.9	-55.5	0	0	0	0	111	W281 A282 Q442	S279-W281 VanDerWaalsContact CB-CD1 3.46Å; S279-W281 PolarHBondContact O-N 3.26Å; S279-A282 VanDerWaalsContact O-CB 3.3Å; S279-A282 WeakPolarHBondContact O-CB 3.41Å; S279-A282 PolarHBondContact O-N 3.5Å; S279-Q442 PolarHBondContact OG-O 2.8Å
280	S	95.5	Very high	97.6	Very high	22 Å²	22	28.2 Å²	28.2	15%	0.154	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.5	-179.1	65.6	0	0	0	0	115.2	Y330 H331 Q442	S280-Y330 CarbonylContact C-O 3.54Å; S280-Y330 WeakPolarHBondContact CB-O 3.33Å; S280-Y330 PolarHBondContact OG-O 2.65Å; S280-H331 PolarHBondContact O-CD2 2.99Å; S280-Q442 PolarHBondContact OG-NE2 3.28Å
281	W	94.9	Very high	97.6	Very high	7 Å²	7	28.3 Å²	28.3	3%	0.027	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	2.8	179.7	49	48.6	0	0	0	114.3	M118 Y171 S279 V332 F438 Q442 W443	M118-W281 HydrophobicContact CE-CB 3.94Å; M118-W281 HydrophobicContact CE-CD2 4.3Å; M118-W281 HydrophobicContact CE-CE3 3.57Å; M118-W281 HydrophobicContact CE-CZ3 4.37Å; M118-W281 HydrophobicContact CG-CD2 4.07Å; M118-W281 HydrophobicContact CG-CE3 3.51Å; M118-W281 HydrophobicContact CG-CH2 4.45Å; M118-W281 HydrophobicContact CG-CZ3 3.71Å; M118-W281 HydrophobicContact SD-CB 3.94Å; M118-W281 HydrophobicContact SD-CD2 4.2Å; M118-W281 HydrophobicContact SD-CE3 3.87Å; M118-W281 HydrophobicContact SD-CG 4.3Å; Y171-W281 WeakPolarHBondContact CE2-O 3.42Å; S279-W281 VanDerWaalsContact CB-CD1 3.46Å; S279-W281 PolarHBondContact O-N 3.26Å; W281-V332 HydrophobicContact CB-CG1 4.03Å; W281-V332 VanDerWaalsContact O-CG1 3.31Å; W281-V332 WeakPolarHBondContact O-CG1 3.35Å; W281-F438 HydrophobicContact CH2-CE1 4.14Å; W281-F438 HydrophobicContact CH2-CZ 4.23Å; W281-F438 HydrophobicContact CZ3-CE1 4.24Å; W281-F438 AromaticContact CZ3-CZ 3.92Å; W281-F438 HydrophobicContact CZ3-CZ 3.92Å; W281-Q442 HydrophobicContact CH2-CB 3.47Å; W281-Q442 VanDerWaalsContact CH2-CB 3.47Å; W281-Q442 HydrophobicContact CH2-CG 3.63Å; W281-Q442 HydrophobicContact CZ2-CB 3.6Å; W281-Q442 HydrophobicContact CZ2-CG 4.2Å; W281-Q442 HydrophobicContact CZ3-CB 4.28Å; W281-Q442 HydrophobicContact CZ3-CG 3.95Å; W281-W443 HydrophobicContact CH2-CE3 4.45Å; W281-W443 AromaticContact CH2-CH2 3.43Å; W281-W443 HydrophobicContact CH2-CH2 3.43Å; W281-W443 VanDerWaalsContact CH2-CH2 3.43Å; W281-W443 AromaticContact CH2-CZ2 3.51Å; W281-W443 HydrophobicContact CH2-CZ2 3.51Å; W281-W443 AromaticContact CH2-CZ3 3.92Å; W281-W443 HydrophobicContact CH2-CZ3 3.92Å; W281-W443 HydrophobicContact CZ2-CD2 4.19Å; W281-W443 AromaticContact CZ2-CE2 3.64Å; W281-W443 HydrophobicContact CZ2-CE3 4.48Å; W281-W443 AromaticContact CZ2-CH2 3.88Å; W281-W443 HydrophobicContact CZ2-CH2 3.88Å; W281-W443 AromaticContact CZ2-CZ2 3.48Å; W281-W443 HydrophobicContact CZ2-CZ2 3.48Å; W281-W443 VanDerWaalsContact CZ2-CZ2 3.48Å; W281-W443 HydrophobicContact CZ2-CZ3 4.35Å
282	A	97	Very high	97.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-33.9	-178.7	0	0	0	0	0	112.7	Y171 S276 A277 S279 P336	Y171-A282 PolarHBondContact OH-O 3.34Å; S276-A282 VanDerWaalsContact O-CB 3.32Å; S276-A282 WeakPolarHBondContact O-CB 3.31Å; A277-A282 WeakPolarHBondContact O-CB 3.43Å; S279-A282 VanDerWaalsContact O-CB 3.3Å; S279-A282 WeakPolarHBondContact O-CB 3.41Å; S279-A282 PolarHBondContact O-N 3.5Å; A282-P336 WeakPolarHBondContact O-CD 3.19Å
283	V	98.2	Very high	97.5	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	16%	0.162	C	C	.	.	S	Bend	trans	-128	140.3	-176.5	177.9	0	0	0	0	110.2	L256 Y285 P336 I338 P347	L256-V283 HydrophobicContact CD2-CG2 4.3Å; V283-Y285 HydrophobicContact CB-CD2 4.48Å; V283-Y285 HydrophobicContact CB-CE2 3.87Å; V283-Y285 HydrophobicContact CG1-CD1 4.36Å; V283-Y285 HydrophobicContact CG1-CD2 4.34Å; V283-Y285 HydrophobicContact CG1-CE1 4.06Å; V283-Y285 HydrophobicContact CG1-CE2 4.02Å; V283-Y285 HydrophobicContact CG1-CG 4.5Å; V283-P336 CarbonylContact C-O 3.56Å; V283-P336 WeakPolarHBondContact CA-O 3.49Å; V283-I338 HydrophobicContact CG1-CG1 4.17Å; V283-P347 HydrophobicContact CG2-CG 3.88Å
284	N	97.9	Very high	97.5	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.032	15%	0.152	C	C	.	.			trans	-92.8	106.5	170.1	179.5	11.9	0	0	0	110.5	Q286 P287 V332 A333 P336 V337	N284-Q286 VanDerWaalsContact C-N 3.33Å; N284-Q286 VanDerWaalsContact OD1-C 3.32Å; N284-Q286 PolarHBondContact OD1-N 3.41Å; N284-P287 WeakPolarHBondContact ND2-CA 3.27Å; N284-V332 HydrophobicContact CB-CG2 4.2Å; N284-A333 PolarHBondContact ND2-O 3.46Å; N284-P336 PolarHBondContact N-O 2.75Å; N284-V337 HydrophobicContact CB-CG1 4.2Å
285	Y	97.4	Very high	97.5	Very high	123 Å²	123	29.7 Å²	29.7	48%	0.482	15%	0.151	S	C	.	.	S	Bend	trans	-84.3	-3.2	176.4	-63.2	-83.4	0	0	0	114	V283 I338 D346	V283-Y285 HydrophobicContact CB-CD2 4.48Å; V283-Y285 HydrophobicContact CB-CE2 3.87Å; V283-Y285 HydrophobicContact CG1-CD1 4.36Å; V283-Y285 HydrophobicContact CG1-CD2 4.34Å; V283-Y285 HydrophobicContact CG1-CE1 4.06Å; V283-Y285 HydrophobicContact CG1-CE2 4.02Å; V283-Y285 HydrophobicContact CG1-CG 4.5Å; Y285-I338 HydrophobicContact CD1-CD1 4.14Å; Y285-I338 HydrophobicContact CE1-CD1 3.58Å; Y285-D346 PolarHBondContact OH-OD2 2.9Å
286	Q	97.8	Very high	97.6	Very high	100 Å²	100	33.7 Å²	33.7	47%	0.467	17%	0.172	S	C	.	.			trans	-128.7	48.7	-178.3	-59.6	-169.9	-34	0	0	113.2	N284 V288 K289 Y290	N284-Q286 VanDerWaalsContact C-N 3.33Å; N284-Q286 VanDerWaalsContact OD1-C 3.32Å; N284-Q286 PolarHBondContact OD1-N 3.41Å; Q286-V288 VanDerWaalsContact C-N 3.35Å; Q286-V288 PolarHBondContact O-N 3.11Å; Q286-K289 HydrophobicContact CB-CB 4.25Å; Q286-K289 HydrophobicContact CB-CD 4.39Å; Q286-K289 WeakPolarHBondContact O-CB 3.28Å; Q286-K289 PolarHBondContact O-N 2.99Å; Q286-Y290 HydrophobicContact CB-CD2 4.46Å; Q286-Y290 HydrophobicContact CB-CE2 4.07Å; Q286-Y290 VanDerWaalsContact O-CD2 3.23Å; Q286-Y290 WeakPolarHBondContact O-CD2 3.2Å; Q286-Y290 PolarHBondContact O-N 3.49Å
287	P	98.1	Very high	97.6	Very high	19 Å²	19	38.8 Å²	38.8	12%	0.123	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-40.4	-174.3	24.5	-33.1	0	0	0	113.1	S206 N284 K289 Y290 T291 V337	S206-P287 CarbonylContact O-C 3.5Å; N284-P287 WeakPolarHBondContact ND2-CA 3.27Å; P287-K289 VanDerWaalsContact C-N 3.28Å; P287-K289 PolarHBondContact O-N 2.77Å; P287-Y290 PolarHBondContact O-N 2.93Å; P287-T291 WeakPolarHBondContact O-CB 3.2Å; P287-T291 PolarHBondContact O-N 2.97Å; P287-T291 PolarHBondContact O-OG1 3.12Å; P287-T291 VanDerWaalsContact O-OG1 3.12Å; P287-V337 HydrophobicContact CB-CG1 3.77Å; P287-V337 HydrophobicContact CG-CG1 3.93Å
288	V	98.3	Very high	97.6	Very high	77 Å²	77	39 Å²	39	47%	0.467	20%	0.195	S	C	.	.	H	α-helix	trans	-55.1	-45.4	179.1	-170.5	0	0	0	0	111.2	T207 Q286 Y290 T291 S292	T207-V288 WeakPolarHBondContact O-CG2 3.44Å; Q286-V288 VanDerWaalsContact C-N 3.35Å; Q286-V288 PolarHBondContact O-N 3.11Å; V288-Y290 PolarHBondContact O-N 2.91Å; V288-T291 PolarHBondContact O-N 2.95Å; V288-S292 WeakPolarHBondContact O-CB 3.12Å; V288-S292 PolarHBondContact O-N 3.33Å; V288-S292 PolarHBondContact O-OG 3.33Å
289	K	97.9	Very high	97.6	Very high	99 Å²	99	40.2 Å²	40.2	43%	0.43	22%	0.217	S	C	.	.	H	α-helix	trans	-59.1	-50.1	-179.6	175.8	-171.6	172.7	-167.9	0	111.5	Q286 P287 L293	Q286-K289 HydrophobicContact CB-CB 4.25Å; Q286-K289 HydrophobicContact CB-CD 4.39Å; Q286-K289 WeakPolarHBondContact O-CB 3.28Å; Q286-K289 PolarHBondContact O-N 2.99Å; P287-K289 VanDerWaalsContact C-N 3.28Å; P287-K289 PolarHBondContact O-N 2.77Å; K289-L293 HydrophobicContact CG-CD1 4.33Å; K289-L293 VanDerWaalsContact O-CG 3.31Å; K289-L293 WeakPolarHBondContact O-CG 3.24Å; K289-L293 PolarHBondContact O-N 2.88Å; K289-L293 VanDerWaalsContact O-N 3.09Å
290	Y	97.9	Very high	97.7	Very high	4 Å²	4	40 Å²	40	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-74.7	-34.2	-175.5	-61.7	-60.9	0	0	0	112.4	Q286 P287 V288 L293 L294 I325 P327 A328 A333	Q286-Y290 HydrophobicContact CB-CD2 4.46Å; Q286-Y290 HydrophobicContact CB-CE2 4.07Å; Q286-Y290 VanDerWaalsContact O-CD2 3.23Å; Q286-Y290 WeakPolarHBondContact O-CD2 3.2Å; Q286-Y290 PolarHBondContact O-N 3.49Å; P287-Y290 PolarHBondContact O-N 2.93Å; V288-Y290 PolarHBondContact O-N 2.91Å; Y290-L293 HydrophobicContact CD1-CD1 4.25Å; Y290-L293 PolarHBondContact O-N 3.12Å; Y290-L294 WeakPolarHBondContact O-CB 3.3Å; Y290-L294 PolarHBondContact O-N 2.87Å; Y290-I325 HydrophobicContact CD1-CG2 3.86Å; Y290-I325 HydrophobicContact CG-CG2 4.45Å; Y290-P327 HydrophobicContact CE1-CB 4.26Å; Y290-P327 WeakPolarHBondContact OH-CA 3.47Å; Y290-A328 PolarHBondContact OH-N 3.46Å; Y290-A333 WeakPolarHBondContact CB-O 3.45Å; Y290-A333 HydrophobicContact CD1-CB 3.88Å; Y290-A333 HydrophobicContact CD2-CB 4.15Å; Y290-A333 WeakPolarHBondContact CD2-O 3.34Å; Y290-A333 HydrophobicContact CE1-CB 4.24Å; Y290-A333 HydrophobicContact CE2-CB 4.46Å; Y290-A333 HydrophobicContact CG-CB 3.84Å
291	T	98.4	Very high	97.6	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-44.3	172.6	-63.5	0	0	0	0	111.6	L205 S206 T207 P287 V288 L294 A295 M308	L205-T291 HydrophobicContact CD1-CG2 4.11Å; L205-T291 HydrophobicContact CD2-CG2 4.07Å; L205-T291 HydrophobicContact CG-CG2 3.99Å; S206-T291 WeakPolarHBondContact O-CB 3.33Å; S206-T291 PolarHBondContact O-OG1 3.48Å; T207-T291 HydrophobicContact CG2-CG2 4.06Å; P287-T291 WeakPolarHBondContact O-CB 3.2Å; P287-T291 PolarHBondContact O-N 2.97Å; P287-T291 PolarHBondContact O-OG1 3.12Å; P287-T291 VanDerWaalsContact O-OG1 3.12Å; V288-T291 PolarHBondContact O-N 2.95Å; T291-L294 PolarHBondContact O-N 2.89Å; T291-A295 WeakPolarHBondContact O-CB 3.31Å; T291-A295 PolarHBondContact O-N 2.92Å; T291-M308 HydrophobicContact CG2-SD 4.24Å
292	S	97.9	Very high	97.5	Very high	40 Å²	40	45.7 Å²	45.7	28%	0.28	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-42.9	175.2	-61.9	0	0	0	0	112.3	V288 L294 A295 D296	V288-S292 WeakPolarHBondContact O-CB 3.12Å; V288-S292 PolarHBondContact O-N 3.33Å; V288-S292 PolarHBondContact O-OG 3.33Å; S292-L294 VanDerWaalsContact C-N 3.32Å; S292-L294 PolarHBondContact O-N 3.18Å; S292-A295 PolarHBondContact O-N 3.01Å; S292-D296 PolarHBondContact O-N 3.16Å
293	L	97.6	Very high	97.3	Very high	72 Å²	72	54.4 Å²	54.4	38%	0.377	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-40.4	176	-74.6	170.9	0	0	0	112.4	K289 Y290 K297 I325	K289-L293 HydrophobicContact CG-CD1 4.33Å; K289-L293 VanDerWaalsContact O-CG 3.31Å; K289-L293 WeakPolarHBondContact O-CG 3.24Å; K289-L293 PolarHBondContact O-N 2.88Å; K289-L293 VanDerWaalsContact O-N 3.09Å; Y290-L293 HydrophobicContact CD1-CD1 4.25Å; Y290-L293 PolarHBondContact O-N 3.12Å; L293-K297 WeakPolarHBondContact O-CG 3.47Å; L293-K297 PolarHBondContact O-N 3.13Å; L293-I325 HydrophobicContact CB-CD1 4.13Å
294	L	98.2	Very high	97.3	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-48.8	174.1	175	68.6	0	0	0	111.1	V201 L205 Y290 T291 S292 D296 K297 V298 Q323 I325 F334	V201-L294 HydrophobicContact CB-CD2 4.32Å; V201-L294 HydrophobicContact CG1-CD2 3.41Å; V201-L294 VanDerWaalsContact CG1-CD2 3.41Å; V201-L294 HydrophobicContact CG2-CD2 3.88Å; L205-L294 HydrophobicContact CD1-CD2 3.86Å; Y290-L294 WeakPolarHBondContact O-CB 3.3Å; Y290-L294 PolarHBondContact O-N 2.87Å; T291-L294 PolarHBondContact O-N 2.89Å; S292-L294 VanDerWaalsContact C-N 3.32Å; S292-L294 PolarHBondContact O-N 3.18Å; L294-D296 VanDerWaalsContact C-N 3.26Å; L294-D296 PolarHBondContact O-N 3.26Å; L294-K297 PolarHBondContact O-N 2.91Å; L294-V298 HydrophobicContact CD1-CG1 4.34Å; L294-V298 WeakPolarHBondContact O-CG2 3.45Å; L294-V298 PolarHBondContact O-N 3.09Å; L294-V298 VanDerWaalsContact O-N 3.1Å; L294-Q323 HydrophobicContact CD1-CB 3.75Å; L294-Q323 HydrophobicContact CD1-CG 3.65Å; L294-I325 HydrophobicContact CB-CD1 4.29Å; L294-I325 HydrophobicContact CB-CG1 4.41Å; L294-I325 HydrophobicContact CD1-CG1 4.44Å; L294-F334 HydrophobicContact CB-CZ 4.09Å; L294-F334 HydrophobicContact CD2-CE1 4.42Å; L294-F334 HydrophobicContact CD2-CZ 4.01Å
295	A	98.4	Very high	97.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.1	-40.7	179.5	0	0	0	0	0	111.5	T291 S292 V298 G299 C300 N301 M308	T291-A295 WeakPolarHBondContact O-CB 3.31Å; T291-A295 PolarHBondContact O-N 2.92Å; S292-A295 PolarHBondContact O-N 3.01Å; A295-V298 PolarHBondContact O-N 2.8Å; A295-G299 PolarHBondContact O-N 3.05Å; A295-C300 HydrophobicContact CB-CB 4.28Å; A295-C300 PolarHBondContact O-N 2.04Å; A295-N301 PolarHBondContact O-N 3.41Å; A295-M308 HydrophobicContact CB-CE 4.29Å; A295-M308 HydrophobicContact CB-CG 3.93Å; A295-M308 HydrophobicContact CB-SD 3.7Å
296	D	98	Very high	97.3	Very high	85 Å²	85	57.1 Å²	57.1	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-57.2	-50.7	171.8	-83.1	-37.4	0	0	0	112.4	S292 L294 V298 G299 N301	S292-D296 PolarHBondContact O-N 3.16Å; L294-D296 VanDerWaalsContact C-N 3.26Å; L294-D296 PolarHBondContact O-N 3.26Å; D296-V298 VanDerWaalsContact C-N 3.27Å; D296-V298 PolarHBondContact O-N 3.01Å; D296-G299 PolarHBondContact O-N 3.2Å; D296-N301 WeakPolarHBondContact OD1-CB 3.43Å; D296-N301 PolarHBondContact OD1-ND2 2.97Å
297	K	97.9	Very high	97.4	Very high	108 Å²	108	57 Å²	57	47%	0.47	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-31.5	-176.1	-74.9	-164.9	175.7	-156.2	0	113.7	L293 L294 Q323 D324 I325	L293-K297 WeakPolarHBondContact O-CG 3.47Å; L293-K297 PolarHBondContact O-N 3.13Å; L294-K297 PolarHBondContact O-N 2.91Å; K297-Q323 HydrophobicContact CB-CG 4.41Å; K297-Q323 HydrophobicContact CD-CB 4.4Å; K297-D324 PolarHBondContact NZ-O 3.07Å; K297-I325 HydrophobicContact CD-CD1 3.84Å
298	V	98.3	Very high	97.4	Very high	7 Å²	7	56.5 Å²	56.5	4%	0.042	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	5.8	179.7	-53.5	0	0	0	0	113.2	L294 A295 D296 C300 L312 K315 E319 L320 Q323	L294-V298 HydrophobicContact CD1-CG1 4.34Å; L294-V298 WeakPolarHBondContact O-CG2 3.45Å; L294-V298 PolarHBondContact O-N 3.09Å; L294-V298 VanDerWaalsContact O-N 3.1Å; A295-V298 PolarHBondContact O-N 2.8Å; D296-V298 VanDerWaalsContact C-N 3.27Å; D296-V298 PolarHBondContact O-N 3.01Å; V298-C300 HydrophobicContact CG2-CB 4.18Å; V298-L312 HydrophobicContact CG2-CD2 3.58Å; V298-K315 HydrophobicContact CB-CG 4.48Å; V298-K315 HydrophobicContact CG2-CG 4.27Å; V298-K315 WeakPolarHBondContact O-CE 3.47Å; V298-K315 PolarHBondContact O-NZ 3.34Å; V298-E319 HydrophobicContact CG1-CG 4.27Å; V298-L320 HydrophobicContact CG1-CD2 4.3Å; V298-L320 HydrophobicContact CG2-CD2 4.24Å; V298-Q323 HydrophobicContact CG1-CG 3.74Å
299	G	98.1	Very high	97.4	Very high	65 Å²	65	52.9 Å²	52.9	67%	0.67	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	32	177.2	0	0	0	0	0	114.5	A295 D296	A295-G299 PolarHBondContact O-N 3.05Å; D296-G299 PolarHBondContact O-N 3.2Å
300	C	98.3	Very high	97.4	Very high	1 Å²	1	51 Å²	51	1%	0.007	29%	0.291	C	S	.	.			trans	-109.8	15.9	173.9	-70.5	0	0	0	0	113.2	A295 V298 V302 M308 C311 L312 K315	A295-C300 HydrophobicContact CB-CB 4.28Å; A295-C300 PolarHBondContact O-N 2.04Å; V298-C300 HydrophobicContact CG2-CB 4.18Å; C300-V302 PolarHBondContact O-N 2.73Å; C300-M308 WeakPolarHBondContact O-CG 3.17Å; C300-C311 WeakPolarHBondContact CA-SG 3.31Å; C300-C311 HydrophobicContact CB-CB 3.64Å; C300-C311 WeakPolarHBondContact CB-SG 3.29Å; C300-C311 WeakPolarHBondContact SG-CB 3.36Å; C300-C311 CovalentContact SG-SG 2.04Å; C300-C311 PolarHBondContact SG-SG 3.32Å; C300-L312 HydrophobicContact CB-CD2 4.03Å; C300-L312 HydrophobicContact CB-CG 4.1Å; C300-K315 VanDerWaalsContact SG-CE 3.59Å
301	N	92.4	Very high	97.4	Very high	90 Å²	90	52.4 Å²	52.4	48%	0.481	30%	0.3	S	S	.	.			trans	-72.8	92.8	178.2	-176	19.1	0	0	0	111.4	A295 D296	A295-N301 PolarHBondContact O-N 3.41Å; D296-N301 WeakPolarHBondContact OD1-CB 3.43Å; D296-N301 PolarHBondContact OD1-ND2 2.97Å
302	V	93.9	Very high	97.4	Very high	59 Å²	59	52.3 Å²	52.3	36%	0.358	30%	0.3	S	S	.	.			trans	-121.7	154	172.4	-64	0	0	0	0	109.1	C300 D307 M308	C300-V302 PolarHBondContact O-N 2.73Å; V302-D307 HydrophobicContact CG2-CB 3.81Å; V302-M308 VanDerWaalsContact CG2-CA 3.45Å; V302-M308 HydrophobicContact CG2-CB 3.72Å; V302-M308 WeakPolarHBondContact O-CE 3.32Å
303	L	92.6	Very high	97.5	Very high	183 Å²	183	52.1 Å²	52.1	96%	0.958	29%	0.293	S	S	*	.	S	Bend	trans	-71.1	-34.3	-173.8	-68.3	174.7	0	0	0	113.1
304	D	97.8	Very high	97.5	Very high	79 Å²	79	56.6 Å²	56.6	42%	0.422	31%	0.312	S	S	.	.	S	Bend	trans	-81.6	126.2	177.5	-176.2	-85.7	0	0	0	110.1	V306 D307 M308	D304-V306 VanDerWaalsContact C-N 3.32Å; D304-V306 PolarHBondContact O-N 3.1Å; D304-V306 WeakPolarHBondContact OD1-CA 3.36Å; D304-V306 VanDerWaalsContact OD1-CB 3.25Å; D304-V306 WeakPolarHBondContact OD1-CB 3.37Å; D304-V306 PolarHBondContact OD1-N 3.48Å; D304-D307 HydrophobicContact CB-CB 4.17Å; D304-D307 PolarHBondContact O-N 3.08Å; D304-D307 PolarHBondContact OD1-N 3.44Å; D304-M308 WeakPolarHBondContact O-CB 3.43Å; D304-M308 PolarHBondContact O-N 3.19Å
305	T	97.9	Very high	97.5	Very high	35 Å²	35	58.8 Å²	58.8	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-72.5	-26.2	-174.5	48	0	0	0	0	112.5	T207 D209 A211 V309	T207-T305 HydrophobicContact CG2-CG2 4.27Å; D209-T305 WeakPolarHBondContact OD2-CB 3.34Å; D209-T305 WeakPolarHBondContact OD2-CG2 3.2Å; D209-T305 PolarHBondContact OD2-OG1 3.32Å; A211-T305 WeakPolarHBondContact CB-O 3.24Å; T305-V309 VanDerWaalsContact O-CG2 3.24Å; T305-V309 WeakPolarHBondContact O-CG2 3.02Å; T305-V309 PolarHBondContact O-N 2.98Å
306	V	98.3	Very high	97.5	Very high	74 Å²	74	61.8 Å²	61.8	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-69.2	-49.5	174.5	-177.5	0	0	0	0	109.5	A211 D304 M308 V309 D310	A211-V306 HydrophobicContact CB-CG2 3.96Å; D304-V306 VanDerWaalsContact C-N 3.32Å; D304-V306 PolarHBondContact O-N 3.1Å; D304-V306 WeakPolarHBondContact OD1-CA 3.36Å; D304-V306 VanDerWaalsContact OD1-CB 3.25Å; D304-V306 WeakPolarHBondContact OD1-CB 3.37Å; D304-V306 PolarHBondContact OD1-N 3.48Å; V306-M308 VanDerWaalsContact C-N 3.26Å; V306-M308 PolarHBondContact O-N 3.37Å; V306-V309 PolarHBondContact O-N 3.03Å; V306-D310 PolarHBondContact O-N 2.85Å
307	D	98.4	Very high	97.4	Very high	98 Å²	98	58.3 Å²	58.3	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-60.2	-36.8	175.7	-70.9	-24.2	0	0	0	111.8	V302 D304 D310 C311	V302-D307 HydrophobicContact CG2-CB 3.81Å; D304-D307 HydrophobicContact CB-CB 4.17Å; D304-D307 PolarHBondContact O-N 3.08Å; D304-D307 PolarHBondContact OD1-N 3.44Å; D307-D310 PolarHBondContact O-N 3.04Å; D307-C311 WeakPolarHBondContact O-CB 3.07Å; D307-C311 PolarHBondContact O-N 3.27Å
308	M	98.6	Very high	97.3	Very high	9 Å²	9	59.6 Å²	59.6	4%	0.044	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-49.7	175.5	-179.7	-176.9	-58.6	0	0	111.2	T291 A295 C300 V302 D304 V306 D310 C311 L312	T291-M308 HydrophobicContact CG2-SD 4.24Å; A295-M308 HydrophobicContact CB-CE 4.29Å; A295-M308 HydrophobicContact CB-CG 3.93Å; A295-M308 HydrophobicContact CB-SD 3.7Å; C300-M308 WeakPolarHBondContact O-CG 3.17Å; V302-M308 VanDerWaalsContact CG2-CA 3.45Å; V302-M308 HydrophobicContact CG2-CB 3.72Å; V302-M308 WeakPolarHBondContact O-CE 3.32Å; D304-M308 WeakPolarHBondContact O-CB 3.43Å; D304-M308 PolarHBondContact O-N 3.19Å; V306-M308 VanDerWaalsContact C-N 3.26Å; V306-M308 PolarHBondContact O-N 3.37Å; M308-D310 VanDerWaalsContact C-N 3.33Å; M308-D310 PolarHBondContact O-N 2.62Å; M308-C311 WeakPolarHBondContact O-CB 3.47Å; M308-C311 PolarHBondContact O-N 3.09Å; M308-L312 HydrophobicContact CG-CD1 4.09Å; M308-L312 VanDerWaalsContact O-CG 3.28Å; M308-L312 WeakPolarHBondContact O-CG 3.33Å; M308-L312 PolarHBondContact O-N 2.89Å
309	V	98.5	Very high	97.2	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-39.7	179.7	175.3	0	0	0	0	110.6	F84 T207 A211 A212 T305 V306 C311 L312 R313	F84-V309 HydrophobicContact CD2-CG1 4.01Å; T207-V309 HydrophobicContact CG2-CG2 3.76Å; A211-V309 HydrophobicContact CB-CG2 4.11Å; A212-V309 HydrophobicContact CB-CG1 4.42Å; A212-V309 HydrophobicContact CB-CG2 3.7Å; T305-V309 VanDerWaalsContact O-CG2 3.24Å; T305-V309 WeakPolarHBondContact O-CG2 3.02Å; T305-V309 PolarHBondContact O-N 2.98Å; V306-V309 PolarHBondContact O-N 3.03Å; V309-C311 PolarHBondContact O-N 3.06Å; V309-L312 PolarHBondContact O-N 2.96Å; V309-L312 VanDerWaalsContact O-N 3.16Å; V309-R313 WeakPolarHBondContact O-CG 3.25Å; V309-R313 PolarHBondContact O-N 3.19Å
310	D	98.3	Very high	97.2	Very high	59 Å²	59	59.5 Å²	59.5	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-41.4	175	-75.3	-13.5	0	0	0	112.1	V306 D307 M308 R313 Q314	V306-D310 PolarHBondContact O-N 2.85Å; D307-D310 PolarHBondContact O-N 3.04Å; M308-D310 VanDerWaalsContact C-N 3.33Å; M308-D310 PolarHBondContact O-N 2.62Å; D310-R313 PolarHBondContact O-N 2.57Å; D310-R313 IonicContact OD1-CZ 3.24Å; D310-R313 IonicContact OD1-NH1 2.78Å; D310-R313 PolarHBondContact OD1-NH1 2.7Å; D310-Q314 WeakPolarHBondContact O-CG 3.06Å; D310-Q314 PolarHBondContact O-N 2.94Å
311	C	98.6	Very high	97	Very high	33 Å²	33	60.4 Å²	60.4	22%	0.223	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-44.1	171.7	-179.2	0	0	0	0	111.9	C300 D307 M308 V309 R313 Q314	C300-C311 WeakPolarHBondContact CA-SG 3.31Å; C300-C311 HydrophobicContact CB-CB 3.64Å; C300-C311 WeakPolarHBondContact CB-SG 3.29Å; C300-C311 WeakPolarHBondContact SG-CB 3.36Å; C300-C311 CovalentContact SG-SG 2.04Å; C300-C311 PolarHBondContact SG-SG 3.32Å; D307-C311 WeakPolarHBondContact O-CB 3.07Å; D307-C311 PolarHBondContact O-N 3.27Å; M308-C311 WeakPolarHBondContact O-CB 3.47Å; M308-C311 PolarHBondContact O-N 3.09Å; V309-C311 PolarHBondContact O-N 3.06Å; C311-R313 VanDerWaalsContact C-N 3.34Å; C311-R313 PolarHBondContact O-N 3.2Å; C311-Q314 WeakPolarHBondContact O-CB 3.34Å; C311-Q314 PolarHBondContact O-N 3.47Å; C311-Q314 VanDerWaalsContact O-N 3.13Å
312	L	98.6	Very high	97	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-34.3	178.6	-69.6	168.4	0	0	0	112.5	R83 F84 L205 V298 C300 M308 V309 Q314 K315 L320	R83-L312 PolarHBondContact NH1-O 3.18Å; R83-L312 VanDerWaalsContact NH1-O 3.1Å; F84-L312 HydrophobicContact CE2-CB 3.97Å; L205-L312 HydrophobicContact CD1-CD1 3.83Å; V298-L312 HydrophobicContact CG2-CD2 3.58Å; C300-L312 HydrophobicContact CB-CD2 4.03Å; C300-L312 HydrophobicContact CB-CG 4.1Å; M308-L312 HydrophobicContact CG-CD1 4.09Å; M308-L312 VanDerWaalsContact O-CG 3.28Å; M308-L312 WeakPolarHBondContact O-CG 3.33Å; M308-L312 PolarHBondContact O-N 2.89Å; V309-L312 PolarHBondContact O-N 2.96Å; V309-L312 VanDerWaalsContact O-N 3.16Å; L312-Q314 PolarHBondContact O-N 2.9Å; L312-K315 WeakPolarHBondContact O-CB 3.23Å; L312-K315 PolarHBondContact O-N 3.49Å; L312-L320 HydrophobicContact CD2-CD2 3.84Å
313	R	98.4	Very high	97	Very high	36 Å²	36	60.5 Å²	60.5	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-31.9	172.8	-73.6	-176.8	-176.2	112.9	4	112.4	R83 F84 V309 D310 C311 K315	R83-R313 HydrophobicContact CB-CG 4.37Å; R83-R313 PolarHBondContact NH1-O 3Å; R83-R313 PolarHBondContact O-NE 2.92Å; F84-R313 HydrophobicContact CD2-CG 3.87Å; F84-R313 HydrophobicContact CE2-CG 4.19Å; V309-R313 WeakPolarHBondContact O-CG 3.25Å; V309-R313 PolarHBondContact O-N 3.19Å; D310-R313 PolarHBondContact O-N 2.57Å; D310-R313 IonicContact OD1-CZ 3.24Å; D310-R313 IonicContact OD1-NH1 2.78Å; D310-R313 PolarHBondContact OD1-NH1 2.7Å; C311-R313 VanDerWaalsContact C-N 3.34Å; C311-R313 PolarHBondContact O-N 3.2Å; R313-K315 VanDerWaalsContact C-N 3.3Å; R313-K315 PolarHBondContact O-N 3.02Å
314	Q	97.9	Very high	96.9	Very high	167 Å²	167	55.6 Å²	55.6	78%	0.78	29%	0.286	S	S	*	.	H	α-helix	trans	-76.6	-15	179	-65.3	175.8	15.9	0	0	113.7	D310 C311 L312	D310-Q314 WeakPolarHBondContact O-CG 3.06Å; D310-Q314 PolarHBondContact O-N 2.94Å; C311-Q314 WeakPolarHBondContact O-CB 3.34Å; C311-Q314 PolarHBondContact O-N 3.47Å; C311-Q314 VanDerWaalsContact O-N 3.13Å; L312-Q314 PolarHBondContact O-N 2.9Å
315	K	98.3	Very high	96.6	Very high	46 Å²	46	52.9 Å²	52.9	20%	0.2	27%	0.272	C	S	.	.	S	Bend	trans	-72.9	153.1	176.2	-59.5	-51	-164.2	145.8	0	111.7	R83 V298 C300 L312 R313 E319 L320	R83-K315 PolarHBondContact NH1-O 3.37Å; R83-K315 PolarHBondContact NH2-O 2.81Å; R83-K315 VanDerWaalsContact NH2-O 3.12Å; V298-K315 HydrophobicContact CB-CG 4.48Å; V298-K315 HydrophobicContact CG2-CG 4.27Å; V298-K315 WeakPolarHBondContact O-CE 3.47Å; V298-K315 PolarHBondContact O-NZ 3.34Å; C300-K315 VanDerWaalsContact SG-CE 3.59Å; L312-K315 WeakPolarHBondContact O-CB 3.23Å; L312-K315 PolarHBondContact O-N 3.49Å; R313-K315 VanDerWaalsContact C-N 3.3Å; R313-K315 PolarHBondContact O-N 3.02Å; K315-E319 WeakPolarHBondContact CD-OE1 3.43Å; K315-E319 IonicContact NZ-OE1 2.84Å; K315-E319 PolarHBondContact NZ-OE1 2.65Å; K315-L320 HydrophobicContact CB-CD1 4.29Å; K315-L320 HydrophobicContact CB-CD2 3.75Å; K315-L320 HydrophobicContact CB-CG 3.85Å; K315-L320 HydrophobicContact CG-CD2 4.06Å
316	S	98	Very high	96.2	Very high	62 Å²	62	56.1 Å²	56.1	43%	0.434	28%	0.284	S	S	.	.			trans	-70.6	145.7	169.7	71.1	0	0	0	0	110.2	K318 E319 L320	S316-K318 PolarHBondContact O-N 3.5Å; S316-E319 PolarHBondContact O-N 3.32Å; S316-E319 VanDerWaalsContact O-N 3.1Å; S316-E319 VanDerWaalsContact OG-CB 3.26Å; S316-E319 WeakPolarHBondContact OG-CB 3.46Å; S316-E319 PolarHBondContact OG-N 2.92Å; S316-E319 VanDerWaalsContact OG-N 3.12Å; S316-L320 PolarHBondContact O-N 3.29Å
317	A	96.9	Very high	95.9	Very high	12 Å²	12	54.1 Å²	54.1	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-54	-38.8	174.1	0	0	0	0	0	112.4	P107 E139 L202 E319 L320 V321	P107-A317 HydrophobicContact CB-CB 4.02Å; P107-A317 HydrophobicContact CG-CB 3.91Å; E139-A317 HydrophobicContact CG-CB 3.63Å; E139-A317 WeakPolarHBondContact OE1-CB 3.32Å; L202-A317 HydrophobicContact CD1-CB 3.94Å; A317-E319 PolarHBondContact O-N 3.34Å; A317-L320 PolarHBondContact O-N 2.87Å; A317-V321 WeakPolarHBondContact O-CB 3.41Å; A317-V321 VanDerWaalsContact O-CG2 3.28Å; A317-V321 WeakPolarHBondContact O-CG2 3.43Å; A317-V321 PolarHBondContact O-N 3.37Å
318	K	95	Very high	95.5	Very high	136 Å²	136	51.5 Å²	51.5	59%	0.591	27%	0.265	S	S	*	.	H	α-helix	trans	-58.2	-49.3	176.6	-174.5	178.4	-178.9	-178	0	111.7	S316 L320 V321 E322	S316-K318 PolarHBondContact O-N 3.5Å; K318-L320 VanDerWaalsContact C-N 3.26Å; K318-L320 PolarHBondContact O-N 3.44Å; K318-V321 PolarHBondContact O-N 3.16Å; K318-E322 WeakPolarHBondContact CE-OE1 3.33Å; K318-E322 VanDerWaalsContact CE-OE2 3.29Å; K318-E322 WeakPolarHBondContact CE-OE2 3.15Å; K318-E322 VanDerWaalsContact CG-CD 3.48Å; K318-E322 HydrophobicContact CG-CG 4.14Å; K318-E322 WeakPolarHBondContact CG-OE2 3.35Å; K318-E322 IonicContact NZ-OE1 3.77Å; K318-E322 WeakPolarHBondContact O-CB 3.31Å; K318-E322 VanDerWaalsContact O-CG 3.31Å; K318-E322 WeakPolarHBondContact O-CG 3.24Å; K318-E322 PolarHBondContact O-N 3.19Å
319	E	96.6	Very high	95.1	Very high	69 Å²	69	56 Å²	56	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-36.1	178.7	-176.5	-178.6	167	0	0	112.2	V298 K315 S316 A317 Q323	V298-E319 HydrophobicContact CG1-CG 4.27Å; K315-E319 WeakPolarHBondContact CD-OE1 3.43Å; K315-E319 IonicContact NZ-OE1 2.84Å; K315-E319 PolarHBondContact NZ-OE1 2.65Å; S316-E319 PolarHBondContact O-N 3.32Å; S316-E319 VanDerWaalsContact O-N 3.1Å; S316-E319 VanDerWaalsContact OG-CB 3.26Å; S316-E319 WeakPolarHBondContact OG-CB 3.46Å; S316-E319 PolarHBondContact OG-N 2.92Å; S316-E319 VanDerWaalsContact OG-N 3.12Å; A317-E319 PolarHBondContact O-N 3.34Å; E319-Q323 VanDerWaalsContact O-CG 3.3Å; E319-Q323 WeakPolarHBondContact O-CG 3.48Å; E319-Q323 PolarHBondContact O-NE2 3.47Å
320	L	97.1	Very high	94.7	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-73.7	-45.3	177.8	-63.8	177.5	0	0	0	112.6	F84 V201 L202 V298 L312 K315 S316 A317 K318	F84-L320 HydrophobicContact CZ-CD1 4.12Å; V201-L320 HydrophobicContact CG1-CB 4.31Å; L202-L320 HydrophobicContact CD2-CD1 4.12Å; V298-L320 HydrophobicContact CG1-CD2 4.3Å; V298-L320 HydrophobicContact CG2-CD2 4.24Å; L312-L320 HydrophobicContact CD2-CD2 3.84Å; K315-L320 HydrophobicContact CB-CD1 4.29Å; K315-L320 HydrophobicContact CB-CD2 3.75Å; K315-L320 HydrophobicContact CB-CG 3.85Å; K315-L320 HydrophobicContact CG-CD2 4.06Å; S316-L320 PolarHBondContact O-N 3.29Å; A317-L320 PolarHBondContact O-N 2.87Å; K318-L320 VanDerWaalsContact C-N 3.26Å; K318-L320 PolarHBondContact O-N 3.44Å
321	V	94.2	Very high	94.5	Very high	20 Å²	20	55.8 Å²	55.8	12%	0.121	28%	0.278	C	S	.	.	H	α-helix	trans	-76.8	-26.5	-172.7	170.4	0	0	0	0	112.6	P107 Q108 N109 L202 A317 K318 Q323	P107-V321 HydrophobicContact CB-CG2 4.1Å; Q108-V321 VanDerWaalsContact C-CG1 3.49Å; N109-V321 HydrophobicContact CB-CG1 3.97Å; L202-V321 HydrophobicContact CD1-CG2 4.45Å; A317-V321 WeakPolarHBondContact O-CB 3.41Å; A317-V321 VanDerWaalsContact O-CG2 3.28Å; A317-V321 WeakPolarHBondContact O-CG2 3.43Å; A317-V321 PolarHBondContact O-N 3.37Å; K318-V321 PolarHBondContact O-N 3.16Å; V321-Q323 PolarHBondContact O-N 3.48Å
322	E	92.7	Very high	94.2	Very high	96 Å²	96	54.5 Å²	54.5	45%	0.449	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.7	178.1	-70.6	-178.3	158.3	0	0	113.7	K318 D324	K318-E322 WeakPolarHBondContact CE-OE1 3.33Å; K318-E322 VanDerWaalsContact CE-OE2 3.29Å; K318-E322 WeakPolarHBondContact CE-OE2 3.15Å; K318-E322 VanDerWaalsContact CG-CD 3.48Å; K318-E322 HydrophobicContact CG-CG 4.14Å; K318-E322 WeakPolarHBondContact CG-OE2 3.35Å; K318-E322 IonicContact NZ-OE1 3.77Å; K318-E322 WeakPolarHBondContact O-CB 3.31Å; K318-E322 VanDerWaalsContact O-CG 3.31Å; K318-E322 WeakPolarHBondContact O-CG 3.24Å; K318-E322 PolarHBondContact O-N 3.19Å; E322-D324 PolarHBondContact O-N 2.8Å
323	Q	93.9	Very high	94.1	Very high	55 Å²	55	54.9 Å²	54.9	26%	0.257	27%	0.273	S	S	.	.	S	Bend	trans	-74	129.3	178.6	-59.1	-50.8	-44.3	0	0	112.1	L294 K297 V298 E319 V321 I325	L294-Q323 HydrophobicContact CD1-CB 3.75Å; L294-Q323 HydrophobicContact CD1-CG 3.65Å; K297-Q323 HydrophobicContact CB-CG 4.41Å; K297-Q323 HydrophobicContact CD-CB 4.4Å; V298-Q323 HydrophobicContact CG1-CG 3.74Å; E319-Q323 VanDerWaalsContact O-CG 3.3Å; E319-Q323 WeakPolarHBondContact O-CG 3.48Å; E319-Q323 PolarHBondContact O-NE2 3.47Å; V321-Q323 PolarHBondContact O-N 3.48Å; Q323-I325 HydrophobicContact CB-CG1 4.26Å; Q323-I325 PolarHBondContact O-N 3.38Å; Q323-I325 VanDerWaalsContact O-N 3.11Å
324	D	90.9	Very high	94	Very high	79 Å²	79	53.3 Å²	53.3	42%	0.422	27%	0.267	S	S	.	.			trans	-78.3	93	175.2	-176.9	28.9	0	0	0	111	K297 E322 Q326	K297-D324 PolarHBondContact NZ-O 3.07Å; E322-D324 PolarHBondContact O-N 2.8Å; D324-Q326 WeakPolarHBondContact OD1-CG 2.99Å; D324-Q326 PolarHBondContact OD1-NE2 3.12Å
325	I	91.8	Very high	94	Very high	23 Å²	23	45.3 Å²	45.3	12%	0.118	23%	0.23	C	C	.	.			trans	-110.6	97.9	176.7	-55	-63	0	0	0	108.7	Y290 L293 L294 K297 Q323 P327 A333 F334	Y290-I325 HydrophobicContact CD1-CG2 3.86Å; Y290-I325 HydrophobicContact CG-CG2 4.45Å; L293-I325 HydrophobicContact CB-CD1 4.13Å; L294-I325 HydrophobicContact CB-CD1 4.29Å; L294-I325 HydrophobicContact CB-CG1 4.41Å; L294-I325 HydrophobicContact CD1-CG1 4.44Å; K297-I325 HydrophobicContact CD-CD1 3.84Å; Q323-I325 HydrophobicContact CB-CG1 4.26Å; Q323-I325 PolarHBondContact O-N 3.38Å; Q323-I325 VanDerWaalsContact O-N 3.11Å; I325-P327 WeakPolarHBondContact O-CD 3.11Å; I325-A333 HydrophobicContact CG2-CB 4Å; I325-F334 HydrophobicContact CB-CE2 4Å; I325-F334 HydrophobicContact CG1-CE2 4.12Å; I325-F334 HydrophobicContact CG2-CE2 3.96Å; I325-F334 HydrophobicContact CG2-CZ 4.38Å
326	Q	89.4	Confident	94	Very high	102 Å²	102	43.1 Å²	43.1	48%	0.477	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-86.9	120.3	-177	-67	-61.8	-41	0	0	111.4	D324	D324-Q326 WeakPolarHBondContact OD1-CG 2.99Å; D324-Q326 PolarHBondContact OD1-NE2 3.12Å
327	P	90.9	Very high	94	Very high	33 Å²	33	40.4 Å²	40.4	21%	0.214	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-74	170.9	172	31	-32.6	0	0	0	111.9	Y290 I325 H331 A333	Y290-P327 HydrophobicContact CE1-CB 4.26Å; Y290-P327 WeakPolarHBondContact OH-CA 3.47Å; I325-P327 WeakPolarHBondContact O-CD 3.11Å; P327-H331 WeakPolarHBondContact CB-O 3.34Å; P327-H331 WeakPolarHBondContact CG-O 3.25Å; P327-A333 HydrophobicContact CB-CB 4.01Å; P327-A333 HydrophobicContact CG-CB 4.29Å
328	A	90.8	Very high	94.1	Very high	43 Å²	43	42.8 Å²	42.8	36%	0.355	21%	0.211	S	C	.	.	S	Bend	trans	-56.1	147	161	0	0	0	0	0	109.9	Y290 Y330 H331	Y290-A328 PolarHBondContact OH-N 3.46Å; A328-Y330 PolarHBondContact O-N 3.06Å; A328-H331 HydrophobicContact CB-CB 4.39Å; A328-H331 WeakPolarHBondContact O-CB 3.33Å; A328-H331 PolarHBondContact O-N 2.73Å; A328-H331 VanDerWaalsContact O-N 3.07Å
329	R	89.3	Confident	94.3	Very high	103 Å²	103	38.2 Å²	38.2	39%	0.389	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	139.6	179.8	-161.8	179.8	-175.7	-174.8	-1.6	109.7	H331 N395 N399	R329-H331 PolarHBondContact O-N 3.1Å; R329-H331 PolarHBondContact O-ND1 2.83Å; R329-N395 PolarHBondContact NH1-OD1 2.88Å; R329-N399 HydrophobicContact CB-CB 4.17Å; R329-N399 VanDerWaalsContact CB-OD1 3.31Å; R329-N399 WeakPolarHBondContact CB-OD1 3.31Å
330	Y	91.8	Very high	94.3	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.012	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	9.4	-177.7	-40.8	-57	0	0	0	116	M118 S280 A328 F373 N399 L400 F438	M118-Y330 VanDerWaalsContact CE-C 3.48Å; M118-Y330 VanDerWaalsContact CE-CA 3.48Å; S280-Y330 CarbonylContact C-O 3.54Å; S280-Y330 WeakPolarHBondContact CB-O 3.33Å; S280-Y330 PolarHBondContact OG-O 2.65Å; A328-Y330 PolarHBondContact O-N 3.06Å; Y330-F373 VanDerWaalsContact OH-CE2 3.31Å; Y330-F373 WeakPolarHBondContact OH-CE2 3.35Å; Y330-N399 HydrophobicContact CD2-CB 3.66Å; Y330-N399 HydrophobicContact CE2-CB 3.7Å; Y330-L400 HydrophobicContact CD2-CD1 4.22Å; Y330-L400 HydrophobicContact CD2-CD2 4.1Å; Y330-L400 HydrophobicContact CD2-CG 3.84Å; Y330-L400 HydrophobicContact CG-CD2 4.3Å; Y330-L400 HydrophobicContact CG-CG 4.48Å; Y330-F438 AromaticContact CD1-CE2 3.65Å; Y330-F438 HydrophobicContact CD1-CE2 3.65Å; Y330-F438 AromaticContact CD1-CZ 3.55Å; Y330-F438 HydrophobicContact CD1-CZ 3.55Å; Y330-F438 HydrophobicContact CE1-CD2 4.49Å; Y330-F438 AromaticContact CE1-CE2 3.32Å; Y330-F438 HydrophobicContact CE1-CE2 3.32Å; Y330-F438 AromaticContact CE1-CZ 3.42Å; Y330-F438 HydrophobicContact CE1-CZ 3.42Å; Y330-F438 VanDerWaalsContact CE1-CZ 3.42Å; Y330-F438 HydrophobicContact CE2-CE2 4.48Å; Y330-F438 HydrophobicContact CG-CE2 4.34Å; Y330-F438 AromaticContact CZ-CE2 3.78Å
331	H	93.2	Very high	94.4	Very high	52 Å²	52	40.3 Å²	40.3	24%	0.241	22%	0.22	C	C	.	.	S	Bend	trans	-120.8	169.8	175.3	-60.1	79.4	0	0	0	110.4	S280 P327 A328 R329 N399	S280-H331 PolarHBondContact O-CD2 2.99Å; P327-H331 WeakPolarHBondContact CB-O 3.34Å; P327-H331 WeakPolarHBondContact CG-O 3.25Å; A328-H331 HydrophobicContact CB-CB 4.39Å; A328-H331 WeakPolarHBondContact O-CB 3.33Å; A328-H331 PolarHBondContact O-N 2.73Å; A328-H331 VanDerWaalsContact O-N 3.07Å; R329-H331 PolarHBondContact O-N 3.1Å; R329-H331 PolarHBondContact O-ND1 2.83Å; H331-N399 PolarHBondContact CE1-O 2.89Å
332	V	93.4	Very high	94.5	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.042	22%	0.215	C	C	.	.			trans	-113.2	144.9	179.5	-67.5	0	0	0	0	111.3	Y171 W281 N284	Y171-V332 HydrophobicContact CD2-CG1 4.19Å; W281-V332 HydrophobicContact CB-CG1 4.03Å; W281-V332 VanDerWaalsContact O-CG1 3.31Å; W281-V332 WeakPolarHBondContact O-CG1 3.35Å; N284-V332 HydrophobicContact CB-CG2 4.2Å
333	A	94.6	Very high	94.8	Very high	7 Å²	7	35 Å²	35	6%	0.058	19%	0.194	C	C	.	.	S	Bend	trans	-87.7	-39.6	178.4	0	0	0	0	0	112.4	N284 Y290 I325 P327	N284-A333 PolarHBondContact ND2-O 3.46Å; Y290-A333 WeakPolarHBondContact CB-O 3.45Å; Y290-A333 HydrophobicContact CD1-CB 3.88Å; Y290-A333 HydrophobicContact CD2-CB 4.15Å; Y290-A333 WeakPolarHBondContact CD2-O 3.34Å; Y290-A333 HydrophobicContact CE1-CB 4.24Å; Y290-A333 HydrophobicContact CE2-CB 4.46Å; Y290-A333 HydrophobicContact CG-CB 3.84Å; I325-A333 HydrophobicContact CG2-CB 4Å; P327-A333 HydrophobicContact CB-CB 4.01Å; P327-A333 HydrophobicContact CG-CB 4.29Å
334	F	97.4	Very high	95	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.013	20%	0.197	C	C	.	.	S	Bend	trans	-131.4	105.9	175.9	-59.3	-76	0	0	0	108.2	M172 V201 F204 L294 I325	M172-F334 HydrophobicContact CE-CD2 4.18Å; M172-F334 HydrophobicContact SD-CB 3.88Å; M172-F334 HydrophobicContact SD-CD2 4.14Å; V201-F334 HydrophobicContact CG2-CD1 4.49Å; V201-F334 HydrophobicContact CG2-CD2 3.87Å; V201-F334 HydrophobicContact CG2-CE1 4.35Å; V201-F334 HydrophobicContact CG2-CE2 3.71Å; V201-F334 HydrophobicContact CG2-CG 4.27Å; V201-F334 HydrophobicContact CG2-CZ 3.97Å; F204-F334 HydrophobicContact CB-CB 4.16Å; L294-F334 HydrophobicContact CB-CZ 4.09Å; L294-F334 HydrophobicContact CD2-CE1 4.42Å; L294-F334 HydrophobicContact CD2-CZ 4.01Å; I325-F334 HydrophobicContact CB-CE2 4Å; I325-F334 HydrophobicContact CG1-CE2 4.12Å; I325-F334 HydrophobicContact CG2-CE2 3.96Å; I325-F334 HydrophobicContact CG2-CZ 4.38Å
335	G	97.4	Very high	95.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-160	-174.5	179.4	0	0	0	0	0	109.2	F204	F204-G335 WeakPolarHBondContact CB-O 3.33Å
336	P	98.7	Very high	95.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.199	C	C	.	.			trans	-49.7	143.4	177.8	-29.2	36.8	0	0	0	113	Y171 F204 N215 L218 L256 A282 V283 N284	Y171-P336 HydrophobicContact CD1-CG 4.36Å; Y171-P336 HydrophobicContact CE1-CG 3.62Å; Y171-P336 HydrophobicContact CE2-CG 4.45Å; F204-P336 HydrophobicContact CD1-CG 4.46Å; F204-P336 HydrophobicContact CE1-CG 4.06Å; N215-P336 VanDerWaalsContact OD1-CA 3.28Å; N215-P336 WeakPolarHBondContact OD1-CA 3.24Å; L218-P336 HydrophobicContact CD1-CB 4.03Å; L218-P336 HydrophobicContact CD1-CG 4.15Å; L218-P336 HydrophobicContact CG-CG 4.42Å; L256-P336 HydrophobicContact CD1-CB 3.65Å; L256-P336 HydrophobicContact CD1-CG 3.51Å; A282-P336 WeakPolarHBondContact O-CD 3.19Å; V283-P336 CarbonylContact C-O 3.56Å; V283-P336 WeakPolarHBondContact CA-O 3.49Å; N284-P336 PolarHBondContact N-O 2.75Å
337	V	98.8	Very high	96.1	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.024	18%	0.176	C	C	.	.			trans	-126.7	153.5	178.4	-62.5	0	0	0	0	109.9	K213 N215 N284 P287 D339	K213-V337 VanDerWaalsContact O-CG2 3.31Å; K213-V337 WeakPolarHBondContact O-CG2 3.43Å; N215-V337 PolarHBondContact ND2-O 3.38Å; N215-V337 PolarHBondContact OD1-N 3.18Å; N215-V337 PolarHBondContact OD1-O 2.69Å; N284-V337 HydrophobicContact CB-CG1 4.2Å; P287-V337 HydrophobicContact CB-CG1 3.77Å; P287-V337 HydrophobicContact CG-CG1 3.93Å; V337-D339 HydrophobicContact CG2-CB 4.29Å; V337-D339 PolarHBondContact O-N 2.93Å
338	I	98.8	Very high	96.4	Very high	63 Å²	63	33.5 Å²	33.5	32%	0.323	19%	0.189	S	C	.	.			trans	-79.5	98.5	169.6	-57.3	166.4	0	0	0	107	V283 Y285 I343 D346	V283-I338 HydrophobicContact CG1-CG1 4.17Å; Y285-I338 HydrophobicContact CD1-CD1 4.14Å; Y285-I338 HydrophobicContact CE1-CD1 3.58Å; I338-I343 HydrophobicContact CG1-CG2 4.29Å; I338-D346 HydrophobicContact CD1-CB 4.22Å
339	D	98.1	Very high	96.7	Very high	39 Å²	39	34.5 Å²	34.5	21%	0.209	19%	0.187	C	C	.	.			trans	-98.8	-6.2	-175.3	64.2	-24.6	0	0	0	113.3	N215 V337 D341 V342 I343	N215-D339 PolarHBondContact ND2-OD1 3.25Å; N215-D339 PolarHBondContact ND2-OD2 2.74Å; V337-D339 HydrophobicContact CG2-CB 4.29Å; V337-D339 PolarHBondContact O-N 2.93Å; D339-D341 PolarHBondContact O-N 3.21Å; D339-D341 PolarHBondContact OD1-N 2.87Å; D339-V342 PolarHBondContact OD1-N 3.26Å; D339-V342 WeakPolarHBondContact OD2-CB 3.21Å; D339-V342 WeakPolarHBondContact OD2-CG2 3.37Å; D339-V342 PolarHBondContact OD2-N 2.95Å; D339-I343 PolarHBondContact N-O 3.07Å; D339-I343 PolarHBondContact OD1-N 3.43Å
340	G	97.9	Very high	97	Very high	55 Å²	55	29.8 Å²	29.8	57%	0.567	17%	0.17	S	C	*	.	S	Bend	trans	76.6	10.4	-176.9	0	0	0	0	0	113.7	I343	G340-I343 PolarHBondContact N-O 3.35Å; G340-I343 VanDerWaalsContact N-O 3.12Å
341	D	97.6	Very high	97.3	Very high	60 Å²	60	29.6 Å²	29.6	32%	0.321	17%	0.169	S	C	.	.	S	Bend	trans	-137.5	-77.6	-179.2	-177.8	11.2	0	0	0	110.6	H261 H262 D339 I343	H261-D341 PolarHBondContact CE1-O 3.16Å; H261-D341 IonicContact CE1-OD1 2.73Å; H261-D341 PolarHBondContact CE1-OD1 2.6Å; H261-D341 PolarHBondContact ND1-O 3.2Å; H261-D341 IonicContact NE2-OD1 3.77Å; H262-D341 IonicContact CD2-OD1 2.83Å; H262-D341 IonicContact CE1-OD1 3.5Å; H262-D341 IonicContact NE2-OD1 2.82Å; H262-D341 PolarHBondContact NE2-OD1 2.79Å; D339-D341 PolarHBondContact O-N 3.21Å; D339-D341 PolarHBondContact OD1-N 2.87Å; D341-I343 VanDerWaalsContact C-N 3.33Å; D341-I343 PolarHBondContact O-N 3.17Å
342	V	98.1	Very high	97.4	Very high	4 Å²	4	32 Å²	32	2%	0.024	18%	0.18	C	C	.	.	S	Bend	trans	-62.1	-45.8	178.1	-179.7	0	0	0	0	110.2	N215 L218 L219 I222 S260 D339	N215-V342 HydrophobicContact CB-CB 4.13Å; N215-V342 HydrophobicContact CB-CG1 4.16Å; N215-V342 HydrophobicContact CB-CG2 4.28Å; L218-V342 HydrophobicContact CB-CG1 4.37Å; L218-V342 HydrophobicContact CD1-CG1 4.36Å; L219-V342 HydrophobicContact CD1-CG2 4.2Å; L219-V342 HydrophobicContact CD2-CG2 3.7Å; L219-V342 HydrophobicContact CG-CG2 3.96Å; I222-V342 HydrophobicContact CD1-CG1 4.4Å; S260-V342 WeakPolarHBondContact CB-O 3.41Å; S260-V342 PolarHBondContact OG-O 2.93Å; D339-V342 PolarHBondContact OD1-N 3.26Å; D339-V342 WeakPolarHBondContact OD2-CB 3.21Å; D339-V342 WeakPolarHBondContact OD2-CG2 3.37Å; D339-V342 PolarHBondContact OD2-N 2.95Å
343	I	98.5	Very high	97.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.204	C	C	.	.	S	Bend	trans	-118.7	97.6	171.4	-53.9	-59.6	0	0	0	106.7	L218 L256 I338 D339 G340 D341 D345 L350	L218-I343 HydrophobicContact CD1-CD1 4.17Å; L218-I343 HydrophobicContact CD1-CG1 4.22Å; L256-I343 HydrophobicContact CB-CD1 4.03Å; L256-I343 HydrophobicContact CD2-CD1 3.88Å; L256-I343 HydrophobicContact CD2-CG1 4.43Å; I338-I343 HydrophobicContact CG1-CG2 4.29Å; D339-I343 PolarHBondContact N-O 3.07Å; D339-I343 PolarHBondContact OD1-N 3.43Å; G340-I343 PolarHBondContact N-O 3.35Å; G340-I343 VanDerWaalsContact N-O 3.12Å; D341-I343 VanDerWaalsContact C-N 3.33Å; D341-I343 PolarHBondContact O-N 3.17Å; I343-D345 WeakPolarHBondContact CG2-O 3.36Å; I343-D345 PolarHBondContact O-N 3.39Å; I343-L350 HydrophobicContact CG2-CD1 4.27Å
344	P	97.8	Very high	97.3	Very high	51 Å²	51	37.5 Å²	37.5	33%	0.331	21%	0.208	S	C	.	.			trans	-66	-34.9	-170.2	-25.1	34.3	0	0	0	115.1	L350	P344-L350 HydrophobicContact CB-CD2 4.26Å
345	D	98.4	Very high	96.9	Very high	68 Å²	68	41.4 Å²	41.4	36%	0.364	23%	0.226	S	C	.	.	S	Bend	trans	-150.4	-177	-177.4	-149.7	-22.3	0	0	0	109.9	I343 I349 L350	I343-D345 WeakPolarHBondContact CG2-O 3.36Å; I343-D345 PolarHBondContact O-N 3.39Å; D345-I349 HydrophobicContact CB-CG2 4.45Å; D345-L350 HydrophobicContact CB-CD2 3.91Å; D345-L350 HydrophobicContact CB-CG 4.23Å; D345-L350 WeakPolarHBondContact O-CD1 3.49Å
346	D	98.4	Very high	96.6	Very high	39 Å²	39	41.4 Å²	41.4	21%	0.209	23%	0.226	C	C	.	.			trans	-53.1	131.4	173.6	-165.2	-67.6	0	0	0	111.1	Y285 I338 E348 I349 L350	Y285-D346 PolarHBondContact OH-OD2 2.9Å; I338-D346 HydrophobicContact CD1-CB 4.22Å; D346-E348 PolarHBondContact O-N 2.84Å; D346-E348 VanDerWaalsContact O-N 3.12Å; D346-E348 WeakPolarHBondContact OD1-CB 3.47Å; D346-E348 PolarHBondContact OD1-N 3.1Å; D346-I349 HydrophobicContact CB-CB 4.35Å; D346-I349 HydrophobicContact CB-CD1 3.91Å; D346-I349 HydrophobicContact CB-CG1 4.07Å; D346-I349 WeakPolarHBondContact O-CA 3.11Å; D346-I349 WeakPolarHBondContact O-CB 3.49Å; D346-I349 PolarHBondContact O-N 3.46Å; D346-L350 PolarHBondContact O-N 2.66Å
347	P	98.2	Very high	95.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-53.5	-32.9	-179.7	-28.3	35.6	0	0	0	114.5	L256 L259 A277 L278 V283 L350 M351	L256-P347 HydrophobicContact CD2-CG 3.97Å; L259-P347 HydrophobicContact CD1-CB 3.87Å; A277-P347 HydrophobicContact CB-CB 3.78Å; A277-P347 HydrophobicContact CB-CG 4.26Å; L278-P347 HydrophobicContact CD2-CB 4.09Å; V283-P347 HydrophobicContact CG2-CG 3.88Å; P347-L350 PolarHBondContact O-N 3.34Å; P347-M351 VanDerWaalsContact O-CG 3.28Å; P347-M351 WeakPolarHBondContact O-CG 3.41Å; P347-M351 PolarHBondContact O-N 3.3Å
348	E	96.5	Very high	95.5	Very high	102 Å²	102	49.7 Å²	49.7	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-46.5	175.9	-169.6	172.5	-168.9	0	0	110.7	L278 D346 L350 M351 E352	L278-E348 HydrophobicContact CD2-CB 3.83Å; L278-E348 HydrophobicContact CD2-CG 4.48Å; D346-E348 PolarHBondContact O-N 2.84Å; D346-E348 VanDerWaalsContact O-N 3.12Å; D346-E348 WeakPolarHBondContact OD1-CB 3.47Å; D346-E348 PolarHBondContact OD1-N 3.1Å; E348-L350 PolarHBondContact O-N 3.46Å; E348-M351 PolarHBondContact O-N 3.25Å; E348-E352 WeakPolarHBondContact O-CG 3.12Å; E348-E352 PolarHBondContact O-N 2.86Å
349	I	97.5	Very high	95.4	Very high	63 Å²	63	47.2 Å²	47.2	32%	0.323	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-44.6	177.4	-64.5	175	0	0	0	110.7	D345 D346 M351 E352 Q353	D345-I349 HydrophobicContact CB-CG2 4.45Å; D346-I349 HydrophobicContact CB-CB 4.35Å; D346-I349 HydrophobicContact CB-CD1 3.91Å; D346-I349 HydrophobicContact CB-CG1 4.07Å; D346-I349 WeakPolarHBondContact O-CA 3.11Å; D346-I349 WeakPolarHBondContact O-CB 3.49Å; D346-I349 PolarHBondContact O-N 3.46Å; I349-M351 VanDerWaalsContact C-N 3.33Å; I349-M351 PolarHBondContact O-N 3.21Å; I349-E352 PolarHBondContact O-N 3.41Å; I349-Q353 HydrophobicContact CG2-CG 4.49Å; I349-Q353 VanDerWaalsContact O-CG 3.26Å; I349-Q353 WeakPolarHBondContact O-CG 3.28Å; I349-Q353 PolarHBondContact O-N 2.95Å
350	L	96.9	Very high	95.4	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-38.1	178.9	-62.3	177.4	0	0	0	112.2	L259 I343 P344 D345 D346 P347 E348 Q353 G354 E355	L259-L350 HydrophobicContact CB-CB 4.38Å; L259-L350 HydrophobicContact CB-CD1 4.07Å; L259-L350 HydrophobicContact CD1-CB 4.49Å; L259-L350 HydrophobicContact CD2-CB 3.95Å; I343-L350 HydrophobicContact CG2-CD1 4.27Å; P344-L350 HydrophobicContact CB-CD2 4.26Å; D345-L350 HydrophobicContact CB-CD2 3.91Å; D345-L350 HydrophobicContact CB-CG 4.23Å; D345-L350 WeakPolarHBondContact O-CD1 3.49Å; D346-L350 PolarHBondContact O-N 2.66Å; P347-L350 PolarHBondContact O-N 3.34Å; E348-L350 PolarHBondContact O-N 3.46Å; L350-Q353 PolarHBondContact O-N 3.27Å; L350-G354 PolarHBondContact O-N 3.49Å; L350-E355 HydrophobicContact CB-CG 4.47Å; L350-E355 HydrophobicContact CD2-CG 4.38Å; L350-E355 PolarHBondContact O-N 2.9Å
351	M	96.5	Very high	95.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-40.5	174.8	-72.4	-174.4	-168.2	0	0	111.9	L259 A277 L278 P347 E348 I349 Q353 G354 F356 T450 L453	L259-M351 HydrophobicContact CD1-CE 3.87Å; L259-M351 HydrophobicContact CD1-CG 4.12Å; L259-M351 HydrophobicContact CD2-CG 3.66Å; L259-M351 HydrophobicContact CG-CG 4.49Å; A277-M351 HydrophobicContact CB-CE 3.99Å; L278-M351 HydrophobicContact CD1-CE 4.46Å; L278-M351 HydrophobicContact CD1-SD 3.95Å; L278-M351 HydrophobicContact CD2-CE 4.25Å; L278-M351 HydrophobicContact CD2-SD 4.17Å; L278-M351 HydrophobicContact CG-CE 4.08Å; L278-M351 HydrophobicContact CG-SD 4.13Å; P347-M351 VanDerWaalsContact O-CG 3.28Å; P347-M351 WeakPolarHBondContact O-CG 3.41Å; P347-M351 PolarHBondContact O-N 3.3Å; E348-M351 PolarHBondContact O-N 3.25Å; I349-M351 VanDerWaalsContact C-N 3.33Å; I349-M351 PolarHBondContact O-N 3.21Å; M351-Q353 VanDerWaalsContact C-N 3.29Å; M351-Q353 PolarHBondContact O-N 3.41Å; M351-G354 PolarHBondContact O-N 2.97Å; M351-G354 VanDerWaalsContact O-N 3.16Å; M351-F356 HydrophobicContact CB-CE1 4.01Å; M351-F356 HydrophobicContact CB-CE2 4.28Å; M351-F356 HydrophobicContact CB-CZ 3.76Å; M351-F356 HydrophobicContact CE-CE2 4.41Å; M351-F356 HydrophobicContact CG-CD2 4.15Å; M351-F356 HydrophobicContact CG-CE1 4.19Å; M351-F356 HydrophobicContact CG-CE2 3.67Å; M351-F356 HydrophobicContact CG-CZ 3.68Å; M351-F356 WeakPolarHBondContact O-CE1 3.42Å; M351-F356 HydrophobicContact SD-CE2 3.9Å; M351-F356 HydrophobicContact SD-CZ 4.17Å; M351-T450 HydrophobicContact CE-CG2 4.05Å; M351-T450 HydrophobicContact SD-CG2 4.21Å; M351-L453 HydrophobicContact CB-CB 4.31Å; M351-L453 HydrophobicContact CB-CD1 3.61Å; M351-L453 HydrophobicContact SD-CD1 4.27Å
352	E	95.5	Very high	95.5	Very high	102 Å²	102	46.8 Å²	46.8	48%	0.477	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-36	175.5	-72.6	-171.1	147	0	0	112.8	E348 I349 G354 L453 Y457	E348-E352 WeakPolarHBondContact O-CG 3.12Å; E348-E352 PolarHBondContact O-N 2.86Å; I349-E352 PolarHBondContact O-N 3.41Å; E352-G354 VanDerWaalsContact C-N 3.27Å; E352-G354 PolarHBondContact O-N 3.43Å; E352-L453 HydrophobicContact CG-CD2 4.1Å; E352-Y457 PolarHBondContact O-OH 3Å
353	Q	93.8	Very high	95.5	Very high	116 Å²	116	46.7 Å²	46.7	54%	0.542	24%	0.239	S	C	.	.	H	α-helix	trans	-72.5	-18.3	175.8	-70.5	172.7	7.3	0	0	113.3	I349 L350 M351	I349-Q353 HydrophobicContact CG2-CG 4.49Å; I349-Q353 VanDerWaalsContact O-CG 3.26Å; I349-Q353 WeakPolarHBondContact O-CG 3.28Å; I349-Q353 PolarHBondContact O-N 2.95Å; L350-Q353 PolarHBondContact O-N 3.27Å; M351-Q353 VanDerWaalsContact C-N 3.29Å; M351-Q353 PolarHBondContact O-N 3.41Å
354	G	92.3	Very high	95.5	Very high	13 Å²	13	46.6 Å²	46.6	13%	0.134	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	24.9	174.7	0	0	0	0	0	115	L350 M351 E352 F356 L357	L350-G354 PolarHBondContact O-N 3.49Å; M351-G354 PolarHBondContact O-N 2.97Å; M351-G354 VanDerWaalsContact O-N 3.16Å; E352-G354 VanDerWaalsContact C-N 3.27Å; E352-G354 PolarHBondContact O-N 3.43Å; G354-F356 PolarHBondContact O-N 3.38Å; G354-L357 WeakPolarHBondContact O-CD1 3.25Å; G354-L357 WeakPolarHBondContact O-CG 3.3Å; G354-L357 PolarHBondContact O-N 2.94Å
355	E	89.4	Confident	95.5	Very high	85 Å²	85	44.6 Å²	44.6	40%	0.397	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-31.1	-179.4	-66.1	-59.3	139.9	0	0	112.9	L350	L350-E355 HydrophobicContact CB-CG 4.47Å; L350-E355 HydrophobicContact CD2-CG 4.38Å; L350-E355 PolarHBondContact O-N 2.9Å
356	F	90.3	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	10.6	-179.2	69.7	-20.5	0	0	0	116.5	T258 L259 M351 G354 N358 Y359 I361 T450 L453 H454	T258-F356 WeakPolarHBondContact O-CA 3.39Å; T258-F356 VanDerWaalsContact O-CB 3.3Å; T258-F356 WeakPolarHBondContact O-CB 3.35Å; L259-F356 HydrophobicContact CD2-CB 3.82Å; L259-F356 HydrophobicContact CD2-CD1 4.44Å; L259-F356 HydrophobicContact CD2-CD2 4.17Å; L259-F356 HydrophobicContact CD2-CG 3.9Å; M351-F356 HydrophobicContact CB-CE1 4.01Å; M351-F356 HydrophobicContact CB-CE2 4.28Å; M351-F356 HydrophobicContact CB-CZ 3.76Å; M351-F356 HydrophobicContact CE-CE2 4.41Å; M351-F356 HydrophobicContact CG-CD2 4.15Å; M351-F356 HydrophobicContact CG-CE1 4.19Å; M351-F356 HydrophobicContact CG-CE2 3.67Å; M351-F356 HydrophobicContact CG-CZ 3.68Å; M351-F356 WeakPolarHBondContact O-CE1 3.42Å; M351-F356 HydrophobicContact SD-CE2 3.9Å; M351-F356 HydrophobicContact SD-CZ 4.17Å; G354-F356 PolarHBondContact O-N 3.38Å; F356-N358 PolarHBondContact O-N 3.17Å; F356-Y359 HydrophobicContact CB-CD2 4.45Å; F356-Y359 WeakPolarHBondContact O-CD2 3.49Å; F356-I361 HydrophobicContact CD2-CD1 4.25Å; F356-T450 HydrophobicContact CE2-CG2 4.14Å; F356-L453 HydrophobicContact CE1-CB 4.47Å; F356-L453 HydrophobicContact CZ-CB 3.86Å; F356-H454 HydrophobicContact CE1-CB 4.4Å; F356-H454 HydrophobicContact CE2-CB 3.89Å; F356-H454 HydrophobicContact CZ-CB 3.78Å; F356-H454 PolarHBondContact O-CD2 3.32Å; F356-H454 PolarHBondContact O-NE2 2.92Å
357	L	85.4	Confident	95.1	Very high	39 Å²	39	45.8 Å²	45.8	20%	0.204	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.4	-171.5	-64.8	175.2	0	0	0	114.9	G354 Y359 Y457 S459	G354-L357 WeakPolarHBondContact O-CD1 3.25Å; G354-L357 WeakPolarHBondContact O-CG 3.3Å; G354-L357 PolarHBondContact O-N 2.94Å; L357-Y359 VanDerWaalsContact C-N 3.26Å; L357-Y359 PolarHBondContact O-N 2.99Å; L357-Y457 HydrophobicContact CD1-CD1 4.44Å; L357-Y457 HydrophobicContact CD1-CD2 3.53Å; L357-Y457 HydrophobicContact CD1-CE2 4.23Å; L357-Y457 HydrophobicContact CD1-CG 3.61Å; L357-Y457 HydrophobicContact CD2-CD2 3.74Å; L357-Y457 HydrophobicContact CD2-CG 4.26Å; L357-Y457 HydrophobicContact CG-CD2 4.22Å; L357-S459 PolarHBondContact O-OG 3.17Å
358	N	89.2	Confident	94.7	Very high	140 Å²	140	46.2 Å²	46.2	75%	0.749	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.5	-175.4	-68.7	-34.9	0	0	0	114.3	F356	F356-N358 PolarHBondContact O-N 3.17Å
359	Y	96.9	Very high	94.5	Very high	11 Å²	11	42.9 Å²	42.9	4%	0.043	22%	0.217	C	C	.	.	S	Bend	trans	-109.7	148.6	-172.9	-54.1	-74.5	0	0	0	111.9	T258 F267 Q268 F356 L357 H454	T258-Y359 HydrophobicContact CG2-CD2 3.87Å; T258-Y359 HydrophobicContact CG2-CE2 4.16Å; T258-Y359 HydrophobicContact CG2-CG 4.24Å; T258-Y359 WeakPolarHBondContact O-CE2 3.45Å; F267-Y359 AromaticContact CD2-CD1 3.84Å; F267-Y359 HydrophobicContact CD2-CD1 3.84Å; F267-Y359 AromaticContact CD2-CE1 3.8Å; F267-Y359 HydrophobicContact CD2-CE1 3.8Å; F267-Y359 HydrophobicContact CE1-CE1 4.48Å; F267-Y359 AromaticContact CE2-CD1 3.58Å; F267-Y359 HydrophobicContact CE2-CD1 3.58Å; F267-Y359 AromaticContact CE2-CE1 3.47Å; F267-Y359 HydrophobicContact CE2-CE1 3.47Å; F267-Y359 VanDerWaalsContact CE2-CE1 3.47Å; F267-Y359 HydrophobicContact CE2-CG 4.25Å; F267-Y359 HydrophobicContact CG-CE1 4.42Å; F267-Y359 HydrophobicContact CZ-CD1 4.37Å; F267-Y359 AromaticContact CZ-CE1 3.85Å; F267-Y359 HydrophobicContact CZ-CE1 3.85Å; F267-Y359 WeakPolarHBondContact O-CE1 3.03Å; Q268-Y359 WeakPolarHBondContact O-CA 3.32Å; F356-Y359 HydrophobicContact CB-CD2 4.45Å; F356-Y359 WeakPolarHBondContact O-CD2 3.49Å; L357-Y359 VanDerWaalsContact C-N 3.26Å; L357-Y359 PolarHBondContact O-N 2.99Å; Y359-H454 PolarHBondContact O-CE1 3.01Å; Y359-H454 PolarHBondContact O-NE2 3.2Å
360	D	98.3	Very high	94.2	Very high	62 Å²	62	40 Å²	40	33%	0.332	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125.9	160.4	-56.5	-38.6	0	0	0	107.9	Q268 R269 A270 P460	Q268-D360 PolarHBondContact O-N 3.13Å; R269-D360 CarbonylContact C-O 3.59Å; R269-D360 VanDerWaalsContact CA-O 3.23Å; R269-D360 WeakPolarHBondContact CA-O 3.2Å; R269-D360 HydrophobicContact CB-CB 4.27Å; R269-D360 HydrophobicContact CG-CB 3.9Å; R269-D360 IonicContact NE-OD2 3.36Å; R269-D360 PolarHBondContact NE-OD2 3.3Å; A270-D360 PolarHBondContact N-O 3.42Å; D360-P460 HydrophobicContact CB-CB 4.43Å; D360-P460 VanDerWaalsContact OD1-CG 3.26Å; D360-P460 WeakPolarHBondContact OD1-CG 3.42Å
361	I	98.6	Very high	93.9	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.6	-177	-58.3	-170.6	0	0	0	111.3	A270 I272 F356 L363 H454 P460 T461 Y462	A270-I361 HydrophobicContact CB-CG1 4.27Å; A270-I361 WeakPolarHBondContact O-CA 3.47Å; I272-I361 HydrophobicContact CD1-CG2 3.95Å; I272-I361 HydrophobicContact CG1-CG2 4.43Å; F356-I361 HydrophobicContact CD2-CD1 4.25Å; I361-L363 HydrophobicContact CG2-CB 4.36Å; I361-L363 HydrophobicContact CG2-CD2 4.08Å; I361-H454 WeakPolarHBondContact CD1-CD2 3.31Å; I361-H454 WeakPolarHBondContact CD1-NE2 3.3Å; I361-H454 WeakPolarHBondContact CG1-NE2 3.43Å; I361-P460 PolarHBondContact N-O 2.95Å; I361-T461 CarbonylContact O-C 3.48Å; I361-T461 WeakPolarHBondContact O-CA 3.29Å; I361-Y462 PolarHBondContact O-N 3.46Å
362	M	98.9	Very high	93.5	Very high	80 Å²	80	41.8 Å²	41.8	39%	0.394	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133	161	-179.1	178.8	-67.9	0	0	109.1	A270 I271 I272 Y462 Y464	A270-M362 PolarHBondContact O-N 3.25Å; I271-M362 CarbonylContact C-O 3.56Å; I271-M362 WeakPolarHBondContact CA-O 3.48Å; I271-M362 HydrophobicContact CG1-CB 4.24Å; I271-M362 HydrophobicContact CG2-CB 4.19Å; I271-M362 HydrophobicContact CG2-CG 4.25Å; I271-M362 HydrophobicContact CG2-SD 4.36Å; I272-M362 PolarHBondContact N-O 3.01Å; M362-Y462 CarbonylContact C-O 3.58Å; M362-Y462 VanDerWaalsContact CA-O 3.27Å; M362-Y462 WeakPolarHBondContact CA-O 2.77Å; M362-Y464 HydrophobicContact CG-CD1 4.25Å
363	L	98.6	Very high	93.2	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.5	179.3	71.7	173.6	0	0	0	111.7	I272 I361 S447 T450 A451 T461 Y462 F463 Y464	I272-L363 HydrophobicContact CB-CB 3.92Å; I272-L363 VanDerWaalsContact O-CA 3.28Å; I272-L363 WeakPolarHBondContact O-CA 3.48Å; I361-L363 HydrophobicContact CG2-CB 4.36Å; I361-L363 HydrophobicContact CG2-CD2 4.08Å; L363-S447 VanDerWaalsContact CD1-O 3.28Å; L363-S447 WeakPolarHBondContact CD1-O 3.31Å; L363-T450 HydrophobicContact CD1-CG2 3.87Å; L363-A451 HydrophobicContact CD1-CB 3.99Å; L363-A451 HydrophobicContact CD2-CB 3.94Å; L363-A451 HydrophobicContact CG-CB 4.32Å; L363-T461 HydrophobicContact CD2-CG2 3.66Å; L363-Y462 PolarHBondContact N-O 3.4Å; L363-F463 HydrophobicContact CD2-CD2 4Å; L363-F463 HydrophobicContact CG-CD2 3.81Å; L363-F463 HydrophobicContact CG-CE2 4.09Å; L363-F463 CarbonylContact O-C 3.54Å; L363-F463 VanDerWaalsContact O-CA 3.25Å; L363-F463 WeakPolarHBondContact O-CA 3.49Å; L363-Y464 VanDerWaalsContact O-CD1 3.3Å; L363-Y464 WeakPolarHBondContact O-CD1 3.46Å; L363-Y464 PolarHBondContact O-N 3.21Å
364	G	98.1	Very high	93	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176	177.4	-179.5	0	0	0	0	0	114.3	I272 S274 Y464	I272-G364 PolarHBondContact O-N 3.5Å; S274-G364 PolarHBondContact N-O 3.41Å; G364-Y464 WeakPolarHBondContact CA-O 3.4Å
365	V	98.1	Very high	92.6	Very high	8 Å²	8	35 Å²	35	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	159.3	-170.2	-64.6	0	0	0	0	110.9	W443 V444 S447 F463 Y464 A465 F466	V365-W443 HydrophobicContact CG1-CB 4.06Å; V365-V444 HydrophobicContact CG2-CG2 4.21Å; V365-S447 WeakPolarHBondContact CG1-OG 3.02Å; V365-F463 HydrophobicContact CG2-CE1 4.44Å; V365-F463 HydrophobicContact CG2-CZ 4.37Å; V365-Y464 PolarHBondContact N-O 2.78Å; V365-A465 CarbonylContact O-C 3.53Å; V365-A465 WeakPolarHBondContact O-CA 3.46Å; V365-F466 PolarHBondContact O-N 2.95Å
366	N	95.8	Very high	92.5	Very high	13 Å²	13	34.7 Å²	34.7	7%	0.07	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	156.4	169.5	-51.1	-45.4	0	0	0	110.2	S274 G368 E369 F466 M482	S274-N366 PolarHBondContact OG-ND2 3.46Å; N366-G368 PolarHBondContact O-N 3.37Å; N366-E369 HydrophobicContact CB-CG 4.22Å; N366-E369 WeakPolarHBondContact CB-OE1 3.46Å; N366-E369 VanDerWaalsContact CG-OE1 3.29Å; N366-E369 PolarHBondContact N-OE1 3.32Å; N366-E369 VanDerWaalsContact ND2-CD 3.31Å; N366-E369 PolarHBondContact ND2-OE1 3.17Å; N366-E369 PolarHBondContact ND2-OE2 3.2Å; N366-F466 WeakPolarHBondContact OD1-CB 3.41Å; N366-M482 HydrophobicContact CB-SD 3.88Å
367	Q	91.8	Very high	92.4	Very high	120 Å²	120	36.3 Å²	36.3	56%	0.561	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.2	-177.1	179.3	-179.8	26.6	0	0	115.4	F466 Y467 M482	Q367-F466 PolarHBondContact N-O 3.39Å; Q367-F466 VanDerWaalsContact N-O 3.09Å; Q367-Y467 HydrophobicContact CB-CD1 3.78Å; Q367-Y467 HydrophobicContact CB-CE1 3.87Å; Q367-Y467 HydrophobicContact CB-CG 4.39Å; Q367-Y467 HydrophobicContact CG-CD1 3.77Å; Q367-Y467 HydrophobicContact CG-CE1 3.62Å; Q367-M482 HydrophobicContact CB-CE 3.72Å
368	G	90.6	Very high	92.7	Very high	8 Å²	8	36.6 Å²	36.6	8%	0.082	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-158.5	46.7	-165.3	0	0	0	0	0	112.8	N366 G370 L371 M482	N366-G368 PolarHBondContact O-N 3.37Å; G368-G370 PolarHBondContact O-N 2.91Å; G368-G370 VanDerWaalsContact O-N 3.13Å; G368-L371 PolarHBondContact O-N 3.01Å; G368-L371 VanDerWaalsContact O-N 3.17Å; G368-M482 VanDerWaalsContact CA-CE 3.5Å; G368-M482 WeakPolarHBondContact CA-SD 3.34Å; G368-M482 PolarHBondContact N-SD 3Å
369	E	92.5	Very high	92.7	Very high	33 Å²	33	32.8 Å²	32.8	15%	0.154	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-38.7	177.9	-56	-74.4	-166.5	0	0	111.7	S274 N366 L371 T439 W443	S274-E369 WeakPolarHBondContact CB-OE1 3.18Å; S274-E369 PolarHBondContact OG-OE1 3.03Å; N366-E369 HydrophobicContact CB-CG 4.22Å; N366-E369 WeakPolarHBondContact CB-OE1 3.46Å; N366-E369 VanDerWaalsContact CG-OE1 3.29Å; N366-E369 PolarHBondContact N-OE1 3.32Å; N366-E369 VanDerWaalsContact ND2-CD 3.31Å; N366-E369 PolarHBondContact ND2-OE1 3.17Å; N366-E369 PolarHBondContact ND2-OE2 3.2Å; E369-L371 PolarHBondContact O-N 2.97Å; E369-T439 HydrophobicContact CB-CG2 4.02Å; E369-T439 HydrophobicContact CG-CG2 4Å; E369-T439 PolarHBondContact N-OG1 3.42Å; E369-W443 HydrophobicContact CB-CD2 3.39Å; E369-W443 HydrophobicContact CB-CE3 3.39Å; E369-W443 HydrophobicContact CB-CG 3.93Å; E369-W443 HydrophobicContact CB-CH2 3.96Å; E369-W443 HydrophobicContact CB-CZ2 4Å; E369-W443 HydrophobicContact CB-CZ3 3.69Å; E369-W443 HydrophobicContact CG-CB 4.02Å; E369-W443 HydrophobicContact CG-CD2 3.79Å; E369-W443 HydrophobicContact CG-CE3 4.17Å; E369-W443 HydrophobicContact CG-CG 3.74Å
370	G	90.9	Very high	92.4	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.01	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	19.4	-178	0	0	0	0	0	115.9	G368 K372 F373 T439	G368-G370 PolarHBondContact O-N 2.91Å; G368-G370 VanDerWaalsContact O-N 3.13Å; G370-K372 PolarHBondContact O-N 3.34Å; G370-F373 WeakPolarHBondContact O-CB 3.39Å; G370-F373 PolarHBondContact O-N 3.46Å; G370-T439 PolarHBondContact N-OG1 2.87Å
371	L	90.2	Very high	92	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.047	25%	0.249	C	C	.	.	H	α-helix	trans	-50.4	-44.3	179.5	174.3	60.9	0	0	0	112.6	V121 G368 E369 F373 V374 P480	V121-L371 HydrophobicContact CG2-CD2 4.28Å; G368-L371 PolarHBondContact O-N 3.01Å; G368-L371 VanDerWaalsContact O-N 3.17Å; E369-L371 PolarHBondContact O-N 2.97Å; L371-F373 PolarHBondContact O-N 3.47Å; L371-V374 WeakPolarHBondContact O-CG2 3.48Å; L371-V374 PolarHBondContact O-N 3.13Å; L371-P480 HydrophobicContact CD1-CB 3.97Å; L371-P480 HydrophobicContact CD1-CG 3.68Å
372	K	88.3	Confident	91.5	Very high	33 Å²	33	45.5 Å²	45.5	14%	0.143	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-18.8	-177.8	-77.2	-78.9	175.9	179.7	0	113.8	E116 V117 G370 V374 E375	E116-K372 HydrophobicContact CB-CD 4.23Å; E116-K372 IonicContact OE2-NZ 3.32Å; E116-K372 PolarHBondContact OE2-NZ 3.39Å; V117-K372 HydrophobicContact CB-CB 4.41Å; V117-K372 HydrophobicContact CG1-CB 4.13Å; G370-K372 PolarHBondContact O-N 3.34Å; K372-V374 VanDerWaalsContact C-N 3.29Å; K372-V374 PolarHBondContact O-N 2.62Å; K372-E375 HydrophobicContact CD-CG 4.48Å; K372-E375 VanDerWaalsContact CD-OE2 3.3Å; K372-E375 WeakPolarHBondContact CD-OE2 3.44Å; K372-E375 WeakPolarHBondContact CE-OE1 3.08Å; K372-E375 WeakPolarHBondContact CE-OE2 3.39Å; K372-E375 IonicContact NZ-OE1 2.85Å; K372-E375 PolarHBondContact NZ-OE1 2.98Å; K372-E375 IonicContact NZ-OE2 2.87Å; K372-E375 PolarHBondContact NZ-OE2 3.5Å
373	F	89.8	Confident	91.3	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-32.3	179	177.4	-116.3	0	0	0	112.7	Y330 G370 L371 F396 L434 F438	Y330-F373 VanDerWaalsContact OH-CE2 3.31Å; Y330-F373 WeakPolarHBondContact OH-CE2 3.35Å; G370-F373 WeakPolarHBondContact O-CB 3.39Å; G370-F373 PolarHBondContact O-N 3.46Å; L371-F373 PolarHBondContact O-N 3.47Å; F373-F396 HydrophobicContact CZ-CB 4.27Å; F373-F396 HydrophobicContact CZ-CD2 4.46Å; F373-L434 HydrophobicContact CD1-CB 4.46Å; F373-L434 WeakPolarHBondContact CD1-O 3.39Å; F373-L434 HydrophobicContact CE1-CB 4.28Å; F373-L434 HydrophobicContact CE1-CD2 4.25Å; F373-F438 HydrophobicContact CB-CB 3.86Å; F373-F438 HydrophobicContact CB-CD1 3.6Å; F373-F438 HydrophobicContact CB-CD2 4.37Å; F373-F438 HydrophobicContact CB-CE1 4.23Å; F373-F438 HydrophobicContact CB-CG 3.68Å; F373-F438 HydrophobicContact CD1-CB 3.56Å; F373-F438 HydrophobicContact CD1-CD2 4.38Å; F373-F438 HydrophobicContact CD1-CG 4.02Å; F373-F438 HydrophobicContact CD2-CB 4.23Å; F373-F438 HydrophobicContact CD2-CD1 4.28Å; F373-F438 AromaticContact CD2-CD2 3.58Å; F373-F438 HydrophobicContact CD2-CD2 3.58Å; F373-F438 AromaticContact CD2-CE2 3.95Å; F373-F438 HydrophobicContact CD2-CE2 3.95Å; F373-F438 AromaticContact CD2-CG 3.77Å; F373-F438 HydrophobicContact CD2-CG 3.77Å; F373-F438 HydrophobicContact CD2-CZ 4.43Å; F373-F438 HydrophobicContact CE1-CB 4.11Å; F373-F438 AromaticContact CE2-CD2 3.88Å; F373-F438 HydrophobicContact CE2-CD2 3.88Å; F373-F438 HydrophobicContact CE2-CE2 4.31Å; F373-F438 HydrophobicContact CE2-CG 4.41Å; F373-F438 HydrophobicContact CG-CB 3.63Å; F373-F438 HydrophobicContact CG-CD1 4.01Å; F373-F438 AromaticContact CG-CD2 3.87Å; F373-F438 HydrophobicContact CG-CD2 3.87Å; F373-F438 AromaticContact CG-CG 3.56Å; F373-F438 HydrophobicContact CG-CG 3.56Å; F373-F438 HydrophobicContact CZ-CD2 4.38Å
374	V	89.1	Confident	91.2	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-100.5	-10.7	-174.8	-58.5	0	0	0	0	114	L371 K372 G376 V377 V378 R431 L434 V435	L371-V374 WeakPolarHBondContact O-CG2 3.48Å; L371-V374 PolarHBondContact O-N 3.13Å; K372-V374 VanDerWaalsContact C-N 3.29Å; K372-V374 PolarHBondContact O-N 2.62Å; V374-G376 PolarHBondContact O-N 2.94Å; V374-V377 HydrophobicContact CB-CG2 4.28Å; V374-V377 VanDerWaalsContact O-CG2 3.25Å; V374-V377 WeakPolarHBondContact O-CG2 3.1Å; V374-V377 PolarHBondContact O-N 3.33Å; V374-V378 HydrophobicContact CB-CG2 4.05Å; V374-V378 HydrophobicContact CG2-CG2 3.95Å; V374-V378 VanDerWaalsContact O-CG2 3.31Å; V374-V378 WeakPolarHBondContact O-CG2 3.09Å; V374-V378 PolarHBondContact O-N 2.99Å; V374-R431 HydrophobicContact CG2-CG 4.2Å; V374-L434 HydrophobicContact CG1-CB 3.51Å; V374-L434 HydrophobicContact CG1-CD1 4.29Å; V374-V435 HydrophobicContact CB-CG2 4.34Å; V374-V435 HydrophobicContact CG1-CG2 3.82Å; V374-V435 HydrophobicContact CG2-CG2 3.52Å
375	E	84.6	Confident	91.1	Very high	70 Å²	70	43.6 Å²	43.6	33%	0.327	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-32.1	-172	-77.9	-170.8	177.1	0	0	114	K372 V377 K475	K372-E375 HydrophobicContact CD-CG 4.48Å; K372-E375 VanDerWaalsContact CD-OE2 3.3Å; K372-E375 WeakPolarHBondContact CD-OE2 3.44Å; K372-E375 WeakPolarHBondContact CE-OE1 3.08Å; K372-E375 WeakPolarHBondContact CE-OE2 3.39Å; K372-E375 IonicContact NZ-OE1 2.85Å; K372-E375 PolarHBondContact NZ-OE1 2.98Å; K372-E375 IonicContact NZ-OE2 2.87Å; K372-E375 PolarHBondContact NZ-OE2 3.5Å; E375-V377 VanDerWaalsContact C-N 3.34Å; E375-K475 IonicContact OE1-NZ 2.64Å; E375-K475 PolarHBondContact OE1-NZ 2.95Å
376	G	85.6	Confident	91.1	Very high	80 Å²	80	44.9 Å²	44.9	83%	0.825	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-6.9	179.1	0	0	0	0	0	115.8	V374	V374-G376 PolarHBondContact O-N 2.94Å
377	V	89.8	Confident	91.1	Very high	34 Å²	34	49.4 Å²	49.4	21%	0.206	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	2.7	-174.9	-62.2	0	0	0	0	113.5	V374 E375 V384 D388	V374-V377 HydrophobicContact CB-CG2 4.28Å; V374-V377 VanDerWaalsContact O-CG2 3.25Å; V374-V377 WeakPolarHBondContact O-CG2 3.1Å; V374-V377 PolarHBondContact O-N 3.33Å; E375-V377 VanDerWaalsContact C-N 3.34Å; V377-V384 HydrophobicContact CG2-CG1 4.48Å; V377-V384 HydrophobicContact CG2-CG2 4.31Å; V377-D388 HydrophobicContact CB-CB 4.14Å; V377-D388 HydrophobicContact CG1-CB 4.42Å
378	V	90.6	Very high	91.3	Very high	44 Å²	44	46.5 Å²	46.5	27%	0.267	29%	0.285	S	S	.	.			trans	-83.4	130.7	176.6	171.9	0	0	0	0	110	V374 G383 V384 R431	V374-V378 HydrophobicContact CB-CG2 4.05Å; V374-V378 HydrophobicContact CG2-CG2 3.95Å; V374-V378 VanDerWaalsContact O-CG2 3.31Å; V374-V378 WeakPolarHBondContact O-CG2 3.09Å; V374-V378 PolarHBondContact O-N 2.99Å; V378-G383 WeakPolarHBondContact CA-O 3.49Å; V378-V384 HydrophobicContact CG2-CG2 3.91Å; V378-R431 HydrophobicContact CG2-CG 3.81Å
379	D	89.6	Confident	91.7	Very high	61 Å²	61	46.6 Å²	46.6	33%	0.326	28%	0.283	S	S	.	.			trans	-81.4	169.7	177.2	67.7	40.4	0	0	0	112.5	E381 D382 G383	D379-E381 PolarHBondContact O-N 3.35Å; D379-E381 VanDerWaalsContact O-N 3.11Å; D379-E381 VanDerWaalsContact OD1-C 3.27Å; D379-E381 VanDerWaalsContact OD1-CA 3.31Å; D379-E381 WeakPolarHBondContact OD1-CA 3.39Å; D379-E381 PolarHBondContact OD1-N 2.94Å; D379-D382 PolarHBondContact O-N 3.06Å; D379-D382 VanDerWaalsContact O-N 3.07Å; D379-D382 PolarHBondContact OD1-N 3.08Å; D379-G383 PolarHBondContact N-O 3.03Å; D379-G383 PolarHBondContact OD1-N 2.99Å; D379-G383 WeakPolarHBondContact OD2-CA 3.11Å
380	P	90.2	Very high	91.8	Very high	137 Å²	137	48.5 Å²	48.5	89%	0.89	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.8	179.2	-24.6	35.8	0	0	0	115.6
381	E	89.6	Confident	92.1	Very high	167 Å²	167	55.2 Å²	55.2	78%	0.78	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	18.5	176.6	-60.9	-172.4	173.3	0	0	111.6	D379 G383	D379-E381 PolarHBondContact O-N 3.35Å; D379-E381 VanDerWaalsContact O-N 3.11Å; D379-E381 VanDerWaalsContact OD1-C 3.27Å; D379-E381 VanDerWaalsContact OD1-CA 3.31Å; D379-E381 WeakPolarHBondContact OD1-CA 3.39Å; D379-E381 PolarHBondContact OD1-N 2.94Å; E381-G383 PolarHBondContact O-N 3.46Å
382	D	89.8	Confident	92.4	Very high	37 Å²	37	55.2 Å²	55.2	20%	0.198	32%	0.321	C	S	.	.	S	Bend	trans	64.2	20.2	178.3	-77.5	-68.4	0	0	0	114.1	D379 R431 T478	D379-D382 PolarHBondContact O-N 3.06Å; D379-D382 VanDerWaalsContact O-N 3.07Å; D379-D382 PolarHBondContact OD1-N 3.08Å; D382-R431 VanDerWaalsContact O-CD 3.23Å; D382-R431 WeakPolarHBondContact O-CD 3.46Å; D382-R431 PolarHBondContact O-NE 3.06Å; D382-R431 IonicContact OD1-CZ 3.78Å; D382-R431 IonicContact OD1-NH1 3.72Å; D382-R431 PolarHBondContact OD1-NH1 2.62Å; D382-T478 WeakPolarHBondContact OD2-CB 3.47Å; D382-T478 PolarHBondContact OD2-OG1 2.96Å
383	G	93.3	Very high	92.8	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.021	31%	0.314	C	S	.	.			trans	-101.2	168.1	179.4	0	0	0	0	0	114.6	V378 D379 E381	V378-G383 WeakPolarHBondContact CA-O 3.49Å; D379-G383 PolarHBondContact N-O 3.03Å; D379-G383 PolarHBondContact OD1-N 2.99Å; D379-G383 WeakPolarHBondContact OD2-CA 3.11Å; E381-G383 PolarHBondContact O-N 3.46Å
384	V	96.7	Very high	93	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	32%	0.32	C	S	.	.			trans	-127.7	135.8	166.1	175.2	0	0	0	0	109.5	V377 V378 D388 F389 P427 R430 R431 L434	V377-V384 HydrophobicContact CG2-CG1 4.48Å; V377-V384 HydrophobicContact CG2-CG2 4.31Å; V378-V384 HydrophobicContact CG2-CG2 3.91Å; V384-D388 HydrophobicContact CG1-CB 3.87Å; V384-F389 HydrophobicContact CG1-CB 4.47Å; V384-P427 PolarHBondContact N-O 3.5Å; V384-R430 HydrophobicContact CB-CB 4.42Å; V384-R430 PolarHBondContact O-NE 3.12Å; V384-R430 PolarHBondContact O-NH2 2.73Å; V384-R431 HydrophobicContact CB-CB 4.39Å; V384-R431 HydrophobicContact CG2-CB 3.75Å; V384-R431 HydrophobicContact CG2-CG 4.02Å; V384-L434 HydrophobicContact CB-CD1 4.42Å; V384-L434 HydrophobicContact CG1-CD1 3.74Å; V384-L434 HydrophobicContact CG2-CD1 4.37Å
385	S	97.1	Very high	93.2	Very high	41 Å²	41	55.5 Å²	55.5	29%	0.287	33%	0.327	S	S	.	.			trans	-72	158.1	178.4	85.5	0	0	0	0	112	T387 D388 F389	S385-T387 VanDerWaalsContact C-N 3.26Å; S385-T387 PolarHBondContact O-N 2.94Å; S385-T387 PolarHBondContact OG-N 3.14Å; S385-D388 WeakPolarHBondContact CB-OD2 3.44Å; S385-D388 PolarHBondContact O-N 3.48Å; S385-D388 WeakPolarHBondContact OG-CB 3.46Å; S385-D388 PolarHBondContact OG-N 3.26Å; S385-D388 PolarHBondContact OG-OD2 3.32Å; S385-F389 WeakPolarHBondContact O-CB 3.23Å; S385-F389 PolarHBondContact O-N 3.49Å
386	G	96.4	Very high	93.6	Very high	34 Å²	34	52.2 Å²	52.2	35%	0.351	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-36.2	174.7	0	0	0	0	0	112.7	F389 D390	G386-F389 WeakPolarHBondContact O-CB 3.43Å; G386-F389 PolarHBondContact O-N 2.93Å; G386-D390 PolarHBondContact O-N 3.22Å
387	T	96.6	Very high	94	Very high	109 Å²	109	48.4 Å²	48.4	67%	0.669	27%	0.272	S	S	*	.	H	α-helix	trans	-65.4	-44.7	177	-51.9	0	0	0	0	111.7	S385 F389 D390 Y391	S385-T387 VanDerWaalsContact C-N 3.26Å; S385-T387 PolarHBondContact O-N 2.94Å; S385-T387 PolarHBondContact OG-N 3.14Å; T387-F389 VanDerWaalsContact C-N 3.33Å; T387-D390 PolarHBondContact O-N 3.28Å; T387-Y391 WeakPolarHBondContact O-CB 3.47Å; T387-Y391 PolarHBondContact O-N 2.94Å
388	D	97	Very high	94.1	Very high	59 Å²	59	49.6 Å²	49.6	32%	0.316	28%	0.278	S	S	.	.	H	α-helix	trans	-69.8	-33.4	179.4	-64	-46.6	0	0	0	111.7	V377 V384 S385 S392	V377-D388 HydrophobicContact CB-CB 4.14Å; V377-D388 HydrophobicContact CG1-CB 4.42Å; V384-D388 HydrophobicContact CG1-CB 3.87Å; S385-D388 WeakPolarHBondContact CB-OD2 3.44Å; S385-D388 PolarHBondContact O-N 3.48Å; S385-D388 WeakPolarHBondContact OG-CB 3.46Å; S385-D388 PolarHBondContact OG-N 3.26Å; S385-D388 PolarHBondContact OG-OD2 3.32Å; D388-S392 VanDerWaalsContact O-CB 3.22Å; D388-S392 WeakPolarHBondContact O-CB 3.41Å; D388-S392 PolarHBondContact O-N 2.89Å; D388-S392 PolarHBondContact O-OG 3.31Å
389	F	97.4	Very high	94.2	Very high	10 Å²	10	50 Å²	50	4%	0.044	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-54.2	170.2	180	-85.4	0	0	0	110.9	V384 S385 G386 T387 Y391 S392 V393 K415 R430 L434	V384-F389 HydrophobicContact CG1-CB 4.47Å; S385-F389 WeakPolarHBondContact O-CB 3.23Å; S385-F389 PolarHBondContact O-N 3.49Å; G386-F389 WeakPolarHBondContact O-CB 3.43Å; G386-F389 PolarHBondContact O-N 2.93Å; T387-F389 VanDerWaalsContact C-N 3.33Å; F389-Y391 VanDerWaalsContact C-N 3.32Å; F389-Y391 PolarHBondContact O-N 3.12Å; F389-S392 PolarHBondContact O-N 3.48Å; F389-V393 HydrophobicContact CD1-CG2 4.25Å; F389-V393 HydrophobicContact CE1-CG2 3.91Å; F389-V393 HydrophobicContact CZ-CG2 4.06Å; F389-V393 WeakPolarHBondContact O-CG2 3.4Å; F389-V393 PolarHBondContact O-N 2.95Å; F389-K415 HydrophobicContact CE1-CB 4.46Å; F389-K415 HydrophobicContact CE1-CG 4.41Å; F389-R430 HydrophobicContact CD2-CB 4.17Å; F389-R430 HydrophobicContact CD2-CG 4.32Å; F389-L434 HydrophobicContact CB-CD1 4.43Å; F389-L434 HydrophobicContact CD2-CD1 3.95Å; F389-L434 HydrophobicContact CD2-CD2 3.59Å; F389-L434 HydrophobicContact CD2-CG 3.5Å; F389-L434 HydrophobicContact CE2-CD2 3.78Å; F389-L434 HydrophobicContact CE2-CG 3.87Å; F389-L434 HydrophobicContact CG-CD2 4.26Å; F389-L434 HydrophobicContact CG-CG 4.44Å
390	D	96.3	Very high	94.3	Very high	72 Å²	72	48.6 Å²	48.6	39%	0.385	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-42.8	-179.9	-80.1	-24.4	0	0	0	112	G386 T387 S394 K415	G386-D390 PolarHBondContact O-N 3.22Å; T387-D390 PolarHBondContact O-N 3.28Å; D390-S394 WeakPolarHBondContact O-CB 3.28Å; D390-S394 PolarHBondContact O-N 3.13Å; D390-S394 PolarHBondContact O-OG 2.94Å; D390-K415 WeakPolarHBondContact OD1-CD 3.31Å; D390-K415 WeakPolarHBondContact OD1-CE 3.36Å; D390-K415 IonicContact OD1-NZ 2.78Å
391	Y	96	Very high	94.2	Very high	142 Å²	142	46.8 Å²	46.8	56%	0.557	25%	0.247	S	C	*	.	H	α-helix	trans	-62.7	-46.1	175.9	178	-99.9	0	0	0	111.8	T387 F389 V393 S394 N395	T387-Y391 WeakPolarHBondContact O-CB 3.47Å; T387-Y391 PolarHBondContact O-N 2.94Å; F389-Y391 VanDerWaalsContact C-N 3.32Å; F389-Y391 PolarHBondContact O-N 3.12Å; Y391-V393 PolarHBondContact O-N 3.29Å; Y391-S394 PolarHBondContact O-N 3.35Å; Y391-N395 VanDerWaalsContact O-CB 3.26Å; Y391-N395 WeakPolarHBondContact O-CB 3.48Å; Y391-N395 PolarHBondContact O-N 3.27Å; Y391-N395 PolarHBondContact OH-ND2 3.16Å
392	S	96.1	Very high	94	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-44.4	-179	-60.6	0	0	0	0	111.7	D388 F389 N395 F396	D388-S392 VanDerWaalsContact O-CB 3.22Å; D388-S392 WeakPolarHBondContact O-CB 3.41Å; D388-S392 PolarHBondContact O-N 2.89Å; D388-S392 PolarHBondContact O-OG 3.31Å; F389-S392 PolarHBondContact O-N 3.48Å; S392-N395 PolarHBondContact O-N 2.99Å; S392-F396 VanDerWaalsContact O-CB 3.22Å; S392-F396 WeakPolarHBondContact O-CB 3.46Å; S392-F396 PolarHBondContact O-N 3.31Å
393	V	96.4	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-43	176.1	177	0	0	0	0	111	F389 Y391 F396 V397 I414 K415 L434 L437	F389-V393 HydrophobicContact CD1-CG2 4.25Å; F389-V393 HydrophobicContact CE1-CG2 3.91Å; F389-V393 HydrophobicContact CZ-CG2 4.06Å; F389-V393 WeakPolarHBondContact O-CG2 3.4Å; F389-V393 PolarHBondContact O-N 2.95Å; Y391-V393 PolarHBondContact O-N 3.29Å; V393-F396 WeakPolarHBondContact O-CB 3.08Å; V393-F396 PolarHBondContact O-N 3.41Å; V393-V397 WeakPolarHBondContact O-CG2 3.46Å; V393-V397 PolarHBondContact O-N 3.23Å; V393-I414 HydrophobicContact CG1-CB 4.12Å; V393-I414 HydrophobicContact CG1-CG2 3.6Å; V393-K415 HydrophobicContact CB-CG 4.11Å; V393-K415 HydrophobicContact CG1-CG 3.73Å; V393-K415 HydrophobicContact CG2-CG 4.39Å; V393-L434 HydrophobicContact CG2-CD2 3.97Å; V393-L437 HydrophobicContact CG2-CD2 3.87Å
394	S	94.1	Very high	92.7	Very high	28 Å²	28	50.3 Å²	50.3	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-49.2	178.3	-55.3	0	0	0	0	111.4	D390 Y391 F396 V397 D398 R411	D390-S394 WeakPolarHBondContact O-CB 3.28Å; D390-S394 PolarHBondContact O-N 3.13Å; D390-S394 PolarHBondContact O-OG 2.94Å; Y391-S394 PolarHBondContact O-N 3.35Å; S394-F396 VanDerWaalsContact C-N 3.33Å; S394-F396 PolarHBondContact O-N 3.37Å; S394-V397 PolarHBondContact O-N 2.66Å; S394-D398 PolarHBondContact O-N 2.92Å; S394-R411 WeakPolarHBondContact OG-CD 3.45Å
395	N	93.3	Very high	92	Very high	28 Å²	28	60.1 Å²	60.1	15%	0.15	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-39.2	179.6	-169.2	-60.2	0	0	0	111.5	R329 Y391 S392 D398 N399	R329-N395 PolarHBondContact NH1-OD1 2.88Å; Y391-N395 VanDerWaalsContact O-CB 3.26Å; Y391-N395 WeakPolarHBondContact O-CB 3.48Å; Y391-N395 PolarHBondContact O-N 3.27Å; Y391-N395 PolarHBondContact OH-ND2 3.16Å; S392-N395 PolarHBondContact O-N 2.99Å; N395-D398 PolarHBondContact O-N 3.47Å; N395-N399 PolarHBondContact O-N 2.98Å; N395-N399 VanDerWaalsContact O-N 3.12Å; N395-N399 PolarHBondContact O-ND2 3.4Å; N395-N399 PolarHBondContact OD1-ND2 3.38Å
396	F	94.5	Very high	91.4	Very high	1 Å²	1	60.1 Å²	60.1	0%	0.004	32%	0.318	C	S	.	.	H	α-helix	trans	-58.1	-50.9	173.4	171.1	-91.3	0	0	0	111.8	F373 S392 V393 S394 D398 N399 L400 Y401 L437 F438 H441	F373-F396 HydrophobicContact CZ-CB 4.27Å; F373-F396 HydrophobicContact CZ-CD2 4.46Å; S392-F396 VanDerWaalsContact O-CB 3.22Å; S392-F396 WeakPolarHBondContact O-CB 3.46Å; S392-F396 PolarHBondContact O-N 3.31Å; V393-F396 WeakPolarHBondContact O-CB 3.08Å; V393-F396 PolarHBondContact O-N 3.41Å; S394-F396 VanDerWaalsContact C-N 3.33Å; S394-F396 PolarHBondContact O-N 3.37Å; F396-D398 VanDerWaalsContact C-N 3.34Å; F396-D398 PolarHBondContact O-N 2.96Å; F396-N399 PolarHBondContact O-N 3.23Å; F396-L400 HydrophobicContact CD1-CD1 4.39Å; F396-L400 HydrophobicContact CD2-CD1 3.56Å; F396-L400 HydrophobicContact CE1-CD1 4.03Å; F396-L400 HydrophobicContact CE2-CD1 3.13Å; F396-L400 HydrophobicContact CG-CD1 4.18Å; F396-L400 HydrophobicContact CZ-CD1 3.39Å; F396-L400 PolarHBondContact O-N 2.99Å; F396-L400 VanDerWaalsContact O-N 3.15Å; F396-Y401 HydrophobicContact CE1-CE2 4.27Å; F396-L437 HydrophobicContact CD1-CD2 4.36Å; F396-L437 HydrophobicContact CE1-CD1 4.04Å; F396-L437 HydrophobicContact CE1-CG 4.44Å; F396-L437 HydrophobicContact CG-CD2 4.5Å; F396-L437 HydrophobicContact CZ-CD1 4.26Å; F396-L437 HydrophobicContact CZ-CG 4.47Å; F396-F438 AromaticContact CD2-CD2 3.81Å; F396-F438 HydrophobicContact CD2-CD2 3.81Å; F396-F438 HydrophobicContact CD2-CE2 4.23Å; F396-F438 AromaticContact CE2-CD2 3.75Å; F396-F438 HydrophobicContact CE2-CD2 3.75Å; F396-F438 HydrophobicContact CE2-CE2 4.23Å; F396-H441 HydrophobicContact CE2-CB 4.16Å; F396-H441 HydrophobicContact CZ-CB 3.62Å; F396-H441 AromaticContact CZ-CD2 3.68Å; F396-H441 AromaticContact CZ-CG 3.48Å; F396-H441 VanDerWaalsContact CZ-CG 3.48Å; F396-H441 AromaticContact CZ-ND1 3.93Å
397	V	94.3	Very high	90.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-42.8	178.5	174.4	0	0	0	0	111.4	V393 S394 N399 Y401 K407 L410 R411 I414	V393-V397 WeakPolarHBondContact O-CG2 3.46Å; V393-V397 PolarHBondContact O-N 3.23Å; S394-V397 PolarHBondContact O-N 2.66Å; V397-N399 VanDerWaalsContact C-N 3.31Å; V397-N399 PolarHBondContact O-N 3.29Å; V397-Y401 HydrophobicContact CG1-CD2 4.48Å; V397-Y401 WeakPolarHBondContact O-CB 3.45Å; V397-Y401 PolarHBondContact O-N 3.27Å; V397-K407 HydrophobicContact CG1-CG 4.05Å; V397-L410 HydrophobicContact CG1-CD2 4.13Å; V397-R411 HydrophobicContact CG2-CB 4.49Å; V397-R411 HydrophobicContact CG2-CG 4.43Å; V397-I414 HydrophobicContact CG2-CD1 3.56Å
398	D	91.8	Very high	90.6	Very high	60 Å²	60	59 Å²	59	32%	0.321	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-40.5	179.9	-68.8	-10.1	0	0	0	112.6	S394 N395 F396 G402 K407	S394-D398 PolarHBondContact O-N 2.92Å; N395-D398 PolarHBondContact O-N 3.47Å; F396-D398 VanDerWaalsContact C-N 3.34Å; F396-D398 PolarHBondContact O-N 2.96Å; D398-G402 WeakPolarHBondContact O-CA 3.48Å; D398-G402 PolarHBondContact O-N 3.43Å; D398-K407 WeakPolarHBondContact OD1-CE 3.43Å; D398-K407 IonicContact OD1-NZ 2.7Å; D398-K407 PolarHBondContact OD1-NZ 3.28Å
399	N	91.5	Very high	90.4	Very high	53 Å²	53	60.9 Å²	60.9	28%	0.283	31%	0.313	S	S	.	.	H	α-helix	trans	-82.1	-30.7	-175.6	-76	-77.1	0	0	0	114	R329 Y330 H331 N395 F396 V397	R329-N399 HydrophobicContact CB-CB 4.17Å; R329-N399 VanDerWaalsContact CB-OD1 3.31Å; R329-N399 WeakPolarHBondContact CB-OD1 3.31Å; Y330-N399 HydrophobicContact CD2-CB 3.66Å; Y330-N399 HydrophobicContact CE2-CB 3.7Å; H331-N399 PolarHBondContact CE1-O 2.89Å; N395-N399 PolarHBondContact O-N 2.98Å; N395-N399 VanDerWaalsContact O-N 3.12Å; N395-N399 PolarHBondContact O-ND2 3.4Å; N395-N399 PolarHBondContact OD1-ND2 3.38Å; F396-N399 PolarHBondContact O-N 3.23Å; V397-N399 VanDerWaalsContact C-N 3.31Å; V397-N399 PolarHBondContact O-N 3.29Å
400	L	91.4	Very high	90.2	Very high	30 Å²	30	63 Å²	63	16%	0.157	33%	0.325	C	S	.	.	H	α-helix	trans	-96.5	-34.8	-176.3	-72.6	164.8	0	0	0	113.4	Y330 F396	Y330-L400 HydrophobicContact CD2-CD1 4.22Å; Y330-L400 HydrophobicContact CD2-CD2 4.1Å; Y330-L400 HydrophobicContact CD2-CG 3.84Å; Y330-L400 HydrophobicContact CG-CD2 4.3Å; Y330-L400 HydrophobicContact CG-CG 4.48Å; F396-L400 HydrophobicContact CD1-CD1 4.39Å; F396-L400 HydrophobicContact CD2-CD1 3.56Å; F396-L400 HydrophobicContact CE1-CD1 4.03Å; F396-L400 HydrophobicContact CE2-CD1 3.13Å; F396-L400 HydrophobicContact CG-CD1 4.18Å; F396-L400 HydrophobicContact CZ-CD1 3.39Å; F396-L400 PolarHBondContact O-N 2.99Å; F396-L400 VanDerWaalsContact O-N 3.15Å
401	Y	88.5	Confident	90.1	Very high	100 Å²	100	61.3 Å²	61.3	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-106.4	-12.8	-175.8	-63.2	-92.1	0	0	0	112.6	F396 V397 Y403 P404 L410 H441	F396-Y401 HydrophobicContact CE1-CE2 4.27Å; V397-Y401 HydrophobicContact CG1-CD2 4.48Å; V397-Y401 WeakPolarHBondContact O-CB 3.45Å; V397-Y401 PolarHBondContact O-N 3.27Å; Y401-Y403 PolarHBondContact O-N 3.03Å; Y401-P404 VanDerWaalsContact O-CD 3.3Å; Y401-P404 WeakPolarHBondContact O-CD 3.3Å; Y401-L410 HydrophobicContact CD1-CD2 3.77Å; Y401-L410 HydrophobicContact CD2-CD2 4.15Å; Y401-L410 HydrophobicContact CE1-CD2 4.2Å; Y401-L410 HydrophobicContact CG-CD2 3.72Å; Y401-H441 AromaticContact CE2-NE2 3.6Å; Y401-H441 AromaticContact CZ-NE2 3.41Å; Y401-H441 PolarHBondContact OH-CD2 3.21Å; Y401-H441 PolarHBondContact OH-NE2 3.1Å
402	G	85.3	Confident	90.1	Very high	27 Å²	27	59.4 Å²	59.4	28%	0.278	31%	0.309	S	S	.	.			trans	67	-125.7	-177.6	0	0	0	0	0	111.7	D398 P404 K407	D398-G402 WeakPolarHBondContact O-CA 3.48Å; D398-G402 PolarHBondContact O-N 3.43Å; G402-P404 VanDerWaalsContact C-CD 3.49Å; G402-K407 WeakPolarHBondContact O-CE 3.42Å; G402-K407 PolarHBondContact O-NZ 3.07Å
403	Y	78.1	Confident	90.2	Very high	202 Å²	202	62.2 Å²	62.2	79%	0.792	33%	0.326	S	S	*	.	S	Bend	trans	-125.3	68.1	178.4	-64.6	-93.8	0	0	0	111.8	Y401 K407	Y401-Y403 PolarHBondContact O-N 3.03Å; Y403-K407 HydrophobicContact CD1-CD 3.92Å; Y403-K407 HydrophobicContact CE1-CD 4.49Å
404	P	78	Confident	90.2	Very high	51 Å²	51	63.1 Å²	63.1	33%	0.331	33%	0.33	S	S	.	.			trans	-73.8	158.5	179.3	33.6	-33.8	0	0	0	110.6	Y401 G402 G406 K407	Y401-P404 VanDerWaalsContact O-CD 3.3Å; Y401-P404 WeakPolarHBondContact O-CD 3.3Å; G402-P404 VanDerWaalsContact C-CD 3.49Å; P404-G406 PolarHBondContact O-N 3.15Å; P404-K407 HydrophobicContact CG-CB 4.17Å; P404-K407 WeakPolarHBondContact O-CB 3.43Å; P404-K407 PolarHBondContact O-N 3.32Å; P404-K407 VanDerWaalsContact O-N 3.14Å
405	E	81.2	Confident	90.3	Very high	206 Å²	206	63 Å²	63	96%	0.963	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	129.2	166.8	-166.6	174.5	-176.3	0	0	109
406	G	84.7	Confident	90.6	Very high	41 Å²	41	67.2 Å²	67.2	42%	0.423	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	15.1	-175.7	0	0	0	0	0	115.7	P404 D408 T409 L410	P404-G406 PolarHBondContact O-N 3.15Å; G406-D408 PolarHBondContact O-N 3.49Å; G406-D408 VanDerWaalsContact O-N 3.16Å; G406-T409 WeakPolarHBondContact O-CA 3.5Å; G406-T409 VanDerWaalsContact O-CB 3.31Å; G406-T409 WeakPolarHBondContact O-CB 3.49Å; G406-T409 PolarHBondContact O-N 2.91Å; G406-L410 PolarHBondContact O-N 3.31Å
407	K	86.4	Confident	90.7	Very high	14 Å²	14	73.4 Å²	73.4	6%	0.061	37%	0.374	C	S	.	.	H	α-helix	trans	-47.9	-42.5	176.5	-170.7	-175.4	-171.6	167.4	0	114.3	V397 D398 G402 Y403 P404 T409 L410 R411	V397-K407 HydrophobicContact CG1-CG 4.05Å; D398-K407 WeakPolarHBondContact OD1-CE 3.43Å; D398-K407 IonicContact OD1-NZ 2.7Å; D398-K407 PolarHBondContact OD1-NZ 3.28Å; G402-K407 WeakPolarHBondContact O-CE 3.42Å; G402-K407 PolarHBondContact O-NZ 3.07Å; Y403-K407 HydrophobicContact CD1-CD 3.92Å; Y403-K407 HydrophobicContact CE1-CD 4.49Å; P404-K407 HydrophobicContact CG-CB 4.17Å; P404-K407 WeakPolarHBondContact O-CB 3.43Å; P404-K407 PolarHBondContact O-N 3.32Å; P404-K407 VanDerWaalsContact O-N 3.14Å; K407-T409 VanDerWaalsContact C-N 3.34Å; K407-L410 WeakPolarHBondContact O-CB 3.25Å; K407-L410 PolarHBondContact O-N 3.25Å; K407-R411 WeakPolarHBondContact O-CB 3.39Å; K407-R411 PolarHBondContact O-N 2.86Å
408	D	89.6	Confident	90.9	Very high	104 Å²	104	75.9 Å²	75.9	56%	0.556	38%	0.384	S	S	*	.	H	α-helix	trans	-66.6	-39.9	-179.5	-66.9	-22.1	0	0	0	111.3	G406 R411 E412	G406-D408 PolarHBondContact O-N 3.49Å; G406-D408 VanDerWaalsContact O-N 3.16Å; D408-R411 PolarHBondContact O-N 3.5Å; D408-R411 IonicContact OD1-CZ 2.69Å; D408-R411 VanDerWaalsContact OD1-CZ 3.24Å; D408-R411 IonicContact OD1-NH1 2.8Å; D408-R411 PolarHBondContact OD1-NH1 3.42Å; D408-R411 IonicContact OD1-NH2 2.61Å; D408-R411 PolarHBondContact OD1-NH2 3.34Å; D408-E412 WeakPolarHBondContact O-CB 3.21Å; D408-E412 WeakPolarHBondContact O-CG 3.47Å; D408-E412 PolarHBondContact O-N 3.1Å
409	T	93.3	Very high	91.2	Very high	100 Å²	100	74.5 Å²	74.5	61%	0.613	38%	0.377	S	S	*	.	H	α-helix	trans	-61.5	-44.7	172	-54.1	0	0	0	0	111.2	G406 K407 T413	G406-T409 WeakPolarHBondContact O-CA 3.5Å; G406-T409 VanDerWaalsContact O-CB 3.31Å; G406-T409 WeakPolarHBondContact O-CB 3.49Å; G406-T409 PolarHBondContact O-N 2.91Å; K407-T409 VanDerWaalsContact C-N 3.34Å; T409-T413 VanDerWaalsContact O-CB 3.25Å; T409-T413 WeakPolarHBondContact O-CB 3.46Å; T409-T413 PolarHBondContact O-N 2.99Å; T409-T413 PolarHBondContact O-OG1 3.17Å
410	L	93.3	Very high	91.5	Very high	54 Å²	54	75.1 Å²	75.1	28%	0.283	38%	0.381	S	S	.	.	H	α-helix	trans	-59.2	-49	176.8	179	62.4	0	0	0	111.2	V397 Y401 G406 K407 T413 I414	V397-L410 HydrophobicContact CG1-CD2 4.13Å; Y401-L410 HydrophobicContact CD1-CD2 3.77Å; Y401-L410 HydrophobicContact CD2-CD2 4.15Å; Y401-L410 HydrophobicContact CE1-CD2 4.2Å; Y401-L410 HydrophobicContact CG-CD2 3.72Å; G406-L410 PolarHBondContact O-N 3.31Å; K407-L410 WeakPolarHBondContact O-CB 3.25Å; K407-L410 PolarHBondContact O-N 3.25Å; L410-T413 PolarHBondContact O-N 3.21Å; L410-I414 HydrophobicContact CD1-CD1 3.91Å; L410-I414 HydrophobicContact CD1-CG1 4.3Å; L410-I414 HydrophobicContact CG-CD1 3.93Å; L410-I414 WeakPolarHBondContact O-CG1 3.36Å; L410-I414 PolarHBondContact O-N 3.18Å
411	R	94.1	Very high	91.8	Very high	37 Å²	37	80.1 Å²	80.1	14%	0.14	40%	0.398	C	S	.	.	H	α-helix	trans	-61.2	-48.8	-179	-167.2	-169.7	-49.7	103.6	3.8	112.2	S394 V397 K407 D408 T413 I414 K415	S394-R411 WeakPolarHBondContact OG-CD 3.45Å; V397-R411 HydrophobicContact CG2-CB 4.49Å; V397-R411 HydrophobicContact CG2-CG 4.43Å; K407-R411 WeakPolarHBondContact O-CB 3.39Å; K407-R411 PolarHBondContact O-N 2.86Å; D408-R411 PolarHBondContact O-N 3.5Å; D408-R411 IonicContact OD1-CZ 2.69Å; D408-R411 VanDerWaalsContact OD1-CZ 3.24Å; D408-R411 IonicContact OD1-NH1 2.8Å; D408-R411 PolarHBondContact OD1-NH1 3.42Å; D408-R411 IonicContact OD1-NH2 2.61Å; D408-R411 PolarHBondContact OD1-NH2 3.34Å; R411-T413 VanDerWaalsContact C-N 3.29Å; R411-T413 PolarHBondContact O-N 3.31Å; R411-I414 PolarHBondContact O-N 2.94Å; R411-K415 WeakPolarHBondContact O-CG 3.38Å; R411-K415 PolarHBondContact O-N 3Å
412	E	96.1	Very high	92.2	Very high	101 Å²	101	80.1 Å²	80.1	47%	0.472	42%	0.418	S	S	.	.	H	α-helix	trans	-68	-32.5	179.6	-66.1	-54.3	124.9	0	0	111.7	D408 K415 F416	D408-E412 WeakPolarHBondContact O-CB 3.21Å; D408-E412 WeakPolarHBondContact O-CG 3.47Å; D408-E412 PolarHBondContact O-N 3.1Å; E412-K415 IonicContact OE1-NZ 3.67Å; E412-K415 PolarHBondContact OE1-NZ 3.12Å; E412-F416 VanDerWaalsContact O-CB 3.3Å; E412-F416 WeakPolarHBondContact O-CB 3.35Å; E412-F416 PolarHBondContact O-N 3.33Å
413	T	97.4	Very high	92.7	Very high	69 Å²	69	82 Å²	82	42%	0.423	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-45.5	173	-56.9	0	0	0	0	111.3	T409 L410 R411 K415 F416 M417	T409-T413 VanDerWaalsContact O-CB 3.25Å; T409-T413 WeakPolarHBondContact O-CB 3.46Å; T409-T413 PolarHBondContact O-N 2.99Å; T409-T413 PolarHBondContact O-OG1 3.17Å; L410-T413 PolarHBondContact O-N 3.21Å; R411-T413 VanDerWaalsContact C-N 3.29Å; R411-T413 PolarHBondContact O-N 3.31Å; T413-K415 PolarHBondContact O-N 3Å; T413-F416 WeakPolarHBondContact O-CB 3.26Å; T413-F416 PolarHBondContact O-N 2.95Å; T413-F416 VanDerWaalsContact O-N 3.17Å; T413-M417 HydrophobicContact CG2-CG 4.26Å; T413-M417 VanDerWaalsContact O-CG 3.28Å; T413-M417 WeakPolarHBondContact O-CG 3.45Å; T413-M417 PolarHBondContact O-N 3.45Å
414	I	97.2	Very high	93.5	Very high	19 Å²	19	79.6 Å²	79.6	10%	0.097	41%	0.411	C	S	.	.	H	α-helix	trans	-61.7	-47.2	177.4	-69.7	166.6	0	0	0	110.4	V393 V397 L410 R411 F416 M417 Y418 L437	V393-I414 HydrophobicContact CG1-CB 4.12Å; V393-I414 HydrophobicContact CG1-CG2 3.6Å; V397-I414 HydrophobicContact CG2-CD1 3.56Å; L410-I414 HydrophobicContact CD1-CD1 3.91Å; L410-I414 HydrophobicContact CD1-CG1 4.3Å; L410-I414 HydrophobicContact CG-CD1 3.93Å; L410-I414 WeakPolarHBondContact O-CG1 3.36Å; L410-I414 PolarHBondContact O-N 3.18Å; R411-I414 PolarHBondContact O-N 2.94Å; I414-F416 PolarHBondContact O-N 2.68Å; I414-M417 PolarHBondContact O-N 3.09Å; I414-Y418 HydrophobicContact CG2-CD2 4Å; I414-Y418 HydrophobicContact CG2-CE2 4.43Å; I414-Y418 WeakPolarHBondContact O-CD2 3.28Å; I414-Y418 PolarHBondContact O-N 3.5Å; I414-L437 HydrophobicContact CG2-CD1 3.66Å; I414-L437 HydrophobicContact CG2-CD2 4.1Å
415	K	97.3	Very high	94.2	Very high	27 Å²	27	83.1 Å²	83.1	12%	0.117	43%	0.428	C	S	.	.	H	α-helix	trans	-55.3	-44	174.5	-71.2	176.4	-178.7	174.2	0	111.4	F389 D390 V393 R411 E412 T413 T419	F389-K415 HydrophobicContact CE1-CB 4.46Å; F389-K415 HydrophobicContact CE1-CG 4.41Å; D390-K415 WeakPolarHBondContact OD1-CD 3.31Å; D390-K415 WeakPolarHBondContact OD1-CE 3.36Å; D390-K415 IonicContact OD1-NZ 2.78Å; V393-K415 HydrophobicContact CB-CG 4.11Å; V393-K415 HydrophobicContact CG1-CG 3.73Å; V393-K415 HydrophobicContact CG2-CG 4.39Å; R411-K415 WeakPolarHBondContact O-CG 3.38Å; R411-K415 PolarHBondContact O-N 3Å; E412-K415 IonicContact OE1-NZ 3.67Å; E412-K415 PolarHBondContact OE1-NZ 3.12Å; T413-K415 PolarHBondContact O-N 3Å; K415-T419 WeakPolarHBondContact O-CB 3.48Å; K415-T419 PolarHBondContact O-N 2.74Å; K415-T419 VanDerWaalsContact O-N 3.09Å; K415-T419 PolarHBondContact O-OG1 3.19Å
416	F	98	Very high	95	Very high	116 Å²	116	75.6 Å²	75.6	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-45.6	178.9	173.7	-88	0	0	0	112.5	E412 T413 I414 T419 W421	E412-F416 VanDerWaalsContact O-CB 3.3Å; E412-F416 WeakPolarHBondContact O-CB 3.35Å; E412-F416 PolarHBondContact O-N 3.33Å; T413-F416 WeakPolarHBondContact O-CB 3.26Å; T413-F416 PolarHBondContact O-N 2.95Å; T413-F416 VanDerWaalsContact O-N 3.17Å; I414-F416 PolarHBondContact O-N 2.68Å; F416-T419 PolarHBondContact O-N 2.82Å; F416-W421 HydrophobicContact CB-CZ2 4.32Å; F416-W421 AromaticContact CD2-CE2 3.7Å; F416-W421 HydrophobicContact CD2-CH2 4.29Å; F416-W421 AromaticContact CD2-CZ2 3.3Å; F416-W421 HydrophobicContact CD2-CZ2 3.3Å; F416-W421 AromaticContact CD2-NE1 3.75Å; F416-W421 AromaticContact CE2-CE2 3.76Å; F416-W421 AromaticContact CE2-CZ2 3.78Å; F416-W421 HydrophobicContact CE2-CZ2 3.78Å; F416-W421 AromaticContact CE2-NE1 3.63Å; F416-W421 HydrophobicContact CG-CZ2 4.04Å; F416-W421 AromaticContact CZ-NE1 3.96Å; F416-W421 PolarHBondContact O-NE1 2.9Å
417	M	98.3	Very high	95.6	Very high	131 Å²	131	76.1 Å²	76.1	65%	0.645	39%	0.39	S	S	*	.	H	α-helix	trans	-68.6	-34.3	-177.6	-69.1	-58.1	-65.2	0	0	112.9	T413 I414	T413-M417 HydrophobicContact CG2-CG 4.26Å; T413-M417 VanDerWaalsContact O-CG 3.28Å; T413-M417 WeakPolarHBondContact O-CG 3.45Å; T413-M417 PolarHBondContact O-N 3.45Å; I414-M417 PolarHBondContact O-N 3.09Å
418	Y	98	Very high	96	Very high	51 Å²	51	79.6 Å²	79.6	20%	0.2	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	11.5	-179.6	-71.9	-89.3	0	0	0	113.5	I414 T433 A436 L437 D440	I414-Y418 HydrophobicContact CG2-CD2 4Å; I414-Y418 HydrophobicContact CG2-CE2 4.43Å; I414-Y418 WeakPolarHBondContact O-CD2 3.28Å; I414-Y418 PolarHBondContact O-N 3.5Å; Y418-T433 WeakPolarHBondContact CD1-O 3.25Å; Y418-T433 WeakPolarHBondContact O-CB 3.3Å; Y418-T433 WeakPolarHBondContact O-CG2 3.41Å; Y418-T433 PolarHBondContact O-OG1 3.28Å; Y418-A436 HydrophobicContact CE1-CB 4.34Å; Y418-L437 HydrophobicContact CD1-CB 3.74Å; Y418-L437 HydrophobicContact CD2-CB 4.38Å; Y418-L437 HydrophobicContact CD2-CD1 3.75Å; Y418-L437 HydrophobicContact CE1-CB 3.77Å; Y418-L437 HydrophobicContact CE1-CD1 4.3Å; Y418-L437 HydrophobicContact CE2-CB 4.4Å; Y418-L437 HydrophobicContact CE2-CD1 3.44Å; Y418-L437 VanDerWaalsContact CE2-CD1 3.44Å; Y418-L437 HydrophobicContact CG-CB 4.04Å; Y418-L437 HydrophobicContact CG-CD1 4.28Å; Y418-D440 WeakPolarHBondContact OH-CB 3.4Å; Y418-D440 PolarHBondContact OH-OD2 2.99Å
419	T	98.1	Very high	96.3	Very high	31 Å²	31	75.6 Å²	75.6	19%	0.19	39%	0.386	C	S	.	.	S	Bend	trans	-92	122.8	167.1	-64.8	0	0	0	0	109.1	K415 F416 W421 R424	K415-T419 WeakPolarHBondContact O-CB 3.48Å; K415-T419 PolarHBondContact O-N 2.74Å; K415-T419 VanDerWaalsContact O-N 3.09Å; K415-T419 PolarHBondContact O-OG1 3.19Å; F416-T419 PolarHBondContact O-N 2.82Å; T419-W421 HydrophobicContact CG2-CD2 3.85Å; T419-W421 HydrophobicContact CG2-CE3 3.92Å; T419-W421 HydrophobicContact CG2-CG 4.46Å; T419-W421 HydrophobicContact CG2-CH2 4.05Å; T419-W421 HydrophobicContact CG2-CZ2 3.96Å; T419-W421 HydrophobicContact CG2-CZ3 4.03Å; T419-W421 VanDerWaalsContact O-CD1 3.23Å; T419-W421 PolarHBondContact O-N 2.9Å; T419-W421 VanDerWaalsContact O-N 3.07Å; T419-W421 PolarHBondContact O-NE1 2.92Å; T419-R424 HydrophobicContact CG2-CB 4.49Å; T419-R424 HydrophobicContact CG2-CG 4.01Å
420	D	97.2	Very high	96.5	Very high	66 Å²	66	72.9 Å²	72.9	35%	0.353	36%	0.364	S	S	.	.			trans	-73.2	99	166.6	-173.8	-14.9	0	0	0	109.3	A422 D423 R424 T429	D420-A422 PolarHBondContact O-N 3.47Å; D420-A422 WeakPolarHBondContact OD1-CB 3.22Å; D420-A422 PolarHBondContact OD1-N 3.04Å; D420-D423 CarbonylContact O-C 3.47Å; D420-D423 PolarHBondContact O-N 3.07Å; D420-D423 PolarHBondContact OD1-N 2.96Å; D420-R424 WeakPolarHBondContact O-CA 3.5Å; D420-R424 PolarHBondContact O-N 3.33Å; D420-T429 HydrophobicContact CB-CG2 3.5Å
421	W	97.3	Very high	96.6	Very high	136 Å²	136	71 Å²	71	52%	0.515	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.6	-178.2	-63.7	103.7	0	0	0	114	F416 T419	F416-W421 HydrophobicContact CB-CZ2 4.32Å; F416-W421 AromaticContact CD2-CE2 3.7Å; F416-W421 HydrophobicContact CD2-CH2 4.29Å; F416-W421 AromaticContact CD2-CZ2 3.3Å; F416-W421 HydrophobicContact CD2-CZ2 3.3Å; F416-W421 AromaticContact CD2-NE1 3.75Å; F416-W421 AromaticContact CE2-CE2 3.76Å; F416-W421 AromaticContact CE2-CZ2 3.78Å; F416-W421 HydrophobicContact CE2-CZ2 3.78Å; F416-W421 AromaticContact CE2-NE1 3.63Å; F416-W421 HydrophobicContact CG-CZ2 4.04Å; F416-W421 AromaticContact CZ-NE1 3.96Å; F416-W421 PolarHBondContact O-NE1 2.9Å; T419-W421 HydrophobicContact CG2-CD2 3.85Å; T419-W421 HydrophobicContact CG2-CE3 3.92Å; T419-W421 HydrophobicContact CG2-CG 4.46Å; T419-W421 HydrophobicContact CG2-CH2 4.05Å; T419-W421 HydrophobicContact CG2-CZ2 3.96Å; T419-W421 HydrophobicContact CG2-CZ3 4.03Å; T419-W421 VanDerWaalsContact O-CD1 3.23Å; T419-W421 PolarHBondContact O-N 2.9Å; T419-W421 VanDerWaalsContact O-N 3.07Å; T419-W421 PolarHBondContact O-NE1 2.92Å
422	A	97.6	Very high	96.7	Very high	99 Å²	99	74.9 Å²	74.9	82%	0.818	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-23.6	175.5	0	0	0	0	0	112.3	D420	D420-A422 PolarHBondContact O-N 3.47Å; D420-A422 WeakPolarHBondContact OD1-CB 3.22Å; D420-A422 PolarHBondContact OD1-N 3.04Å
423	D	96.1	Very high	96.8	Very high	68 Å²	68	71.3 Å²	71.3	36%	0.364	36%	0.356	S	S	.	.	S	Bend	trans	-139.6	42.2	-176.5	-165	26.2	0	0	0	112.4	D420 D425 N426 T429	D420-D423 CarbonylContact O-C 3.47Å; D420-D423 PolarHBondContact O-N 3.07Å; D420-D423 PolarHBondContact OD1-N 2.96Å; D423-D425 PolarHBondContact O-N 3.26Å; D423-D425 VanDerWaalsContact O-N 3.1Å; D423-N426 HydrophobicContact CB-CB 4.46Å; D423-N426 WeakPolarHBondContact O-CB 3.39Å; D423-N426 PolarHBondContact O-N 3.29Å; D423-N426 VanDerWaalsContact O-N 3.08Å; D423-N426 WeakPolarHBondContact OD1-CB 3.31Å; D423-N426 WeakPolarHBondContact OD2-CB 3.13Å; D423-N426 VanDerWaalsContact OD2-CG 3.3Å; D423-N426 PolarHBondContact OD2-ND2 3.1Å; D423-T429 PolarHBondContact OD2-OG1 3.35Å
424	R	94	Very high	96.8	Very high	150 Å²	150	68 Å²	68	57%	0.566	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-37.9	-167.6	178.4	-178.8	176.3	-130.1	-0.6	114.5	T419 D420 N426 R430	T419-R424 HydrophobicContact CG2-CB 4.49Å; T419-R424 HydrophobicContact CG2-CG 4.01Å; D420-R424 WeakPolarHBondContact O-CA 3.5Å; D420-R424 PolarHBondContact O-N 3.33Å; R424-N426 VanDerWaalsContact C-N 3.34Å; R424-R430 PolarHBondContact O-NH1 3.33Å; R424-R430 VanDerWaalsContact O-NH1 3.17Å
425	D	93.9	Very high	96.7	Very high	126 Å²	126	67.6 Å²	67.6	67%	0.674	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.9	-172.3	-64.3	-37.4	0	0	0	112.7	D423 P427 R430	D423-D425 PolarHBondContact O-N 3.26Å; D423-D425 VanDerWaalsContact O-N 3.1Å; D425-P427 VanDerWaalsContact O-CD 3.27Å; D425-P427 WeakPolarHBondContact O-CD 3.4Å; D425-R430 VanDerWaalsContact C-NH1 3.25Å; D425-R430 PolarHBondContact O-NH1 3.44Å; D425-R430 PolarHBondContact O-NH2 3.08Å
426	N	97.1	Very high	96.7	Very high	47 Å²	47	67.9 Å²	67.9	25%	0.251	34%	0.342	S	S	.	.			trans	-70.6	115.6	-177.9	-174.3	-26.3	0	0	0	112.9	D423 R424 E428 T429 R430	D423-N426 HydrophobicContact CB-CB 4.46Å; D423-N426 WeakPolarHBondContact O-CB 3.39Å; D423-N426 PolarHBondContact O-N 3.29Å; D423-N426 VanDerWaalsContact O-N 3.08Å; D423-N426 WeakPolarHBondContact OD1-CB 3.31Å; D423-N426 WeakPolarHBondContact OD2-CB 3.13Å; D423-N426 VanDerWaalsContact OD2-CG 3.3Å; D423-N426 PolarHBondContact OD2-ND2 3.1Å; R424-N426 VanDerWaalsContact C-N 3.34Å; N426-E428 PolarHBondContact O-N 3.43Å; N426-E428 WeakPolarHBondContact OD1-CB 3.4Å; N426-E428 PolarHBondContact OD1-N 2.73Å; N426-T429 PolarHBondContact ND2-OG1 3.32Å; N426-T429 PolarHBondContact O-N 3.4Å; N426-T429 PolarHBondContact OD1-N 2.82Å; N426-R430 PolarHBondContact O-N 3.27Å; N426-R430 VanDerWaalsContact O-N 3.12Å
427	P	96.6	Very high	96.7	Very high	53 Å²	53	62.5 Å²	62.5	34%	0.344	32%	0.318	S	S	.	.	H	α-helix	trans	-63.2	-35.9	179.7	-20.9	32.9	0	0	0	114.6	V384 D425 R430 R431	V384-P427 PolarHBondContact N-O 3.5Å; D425-P427 VanDerWaalsContact O-CD 3.27Å; D425-P427 WeakPolarHBondContact O-CD 3.4Å; P427-R430 PolarHBondContact O-N 2.91Å; P427-R431 PolarHBondContact O-N 3.1Å
428	E	95.7	Very high	96.7	Very high	87 Å²	87	56.3 Å²	56.3	41%	0.407	29%	0.288	S	S	.	.	H	α-helix	trans	-69.5	-36.8	178.4	-68.5	-174.4	-147.1	0	0	111.4	N426 R431 K432	N426-E428 PolarHBondContact O-N 3.43Å; N426-E428 WeakPolarHBondContact OD1-CB 3.4Å; N426-E428 PolarHBondContact OD1-N 2.73Å; E428-R431 WeakPolarHBondContact O-CB 3.47Å; E428-R431 PolarHBondContact O-N 2.98Å; E428-K432 WeakPolarHBondContact O-CG 3.2Å; E428-K432 PolarHBondContact O-N 3.49Å
429	T	96.1	Very high	96.6	Very high	19 Å²	19	54 Å²	54	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-39.2	176.2	-57.7	0	0	0	0	110.6	D420 D423 N426 R431 K432 T433	D420-T429 HydrophobicContact CB-CG2 3.5Å; D423-T429 PolarHBondContact OD2-OG1 3.35Å; N426-T429 PolarHBondContact ND2-OG1 3.32Å; N426-T429 PolarHBondContact O-N 3.4Å; N426-T429 PolarHBondContact OD1-N 2.82Å; T429-R431 PolarHBondContact O-N 3.42Å; T429-K432 PolarHBondContact O-N 3.23Å; T429-T433 WeakPolarHBondContact O-CG2 3.12Å; T429-T433 PolarHBondContact O-N 2.72Å; T429-T433 PolarHBondContact O-OG1 3.34Å
430	R	97.3	Very high	96.6	Very high	44 Å²	44	55.2 Å²	55.2	17%	0.166	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-40.9	170	-74.2	-167.9	-62.7	-93.8	-2.3	112.8	V384 F389 R424 D425 N426 P427 T433 L434	V384-R430 HydrophobicContact CB-CB 4.42Å; V384-R430 PolarHBondContact O-NE 3.12Å; V384-R430 PolarHBondContact O-NH2 2.73Å; F389-R430 HydrophobicContact CD2-CB 4.17Å; F389-R430 HydrophobicContact CD2-CG 4.32Å; R424-R430 PolarHBondContact O-NH1 3.33Å; R424-R430 VanDerWaalsContact O-NH1 3.17Å; D425-R430 VanDerWaalsContact C-NH1 3.25Å; D425-R430 PolarHBondContact O-NH1 3.44Å; D425-R430 PolarHBondContact O-NH2 3.08Å; N426-R430 PolarHBondContact O-N 3.27Å; N426-R430 VanDerWaalsContact O-N 3.12Å; P427-R430 PolarHBondContact O-N 2.91Å; R430-T433 WeakPolarHBondContact CA-OG1 3.34Å; R430-T433 PolarHBondContact O-N 3.39Å; R430-T433 PolarHBondContact O-OG1 3.09Å; R430-L434 WeakPolarHBondContact O-CG 3.34Å; R430-L434 PolarHBondContact O-N 2.89Å
431	R	96.3	Very high	96.6	Very high	15 Å²	15	54.1 Å²	54.1	6%	0.057	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-50.3	173.5	-175.4	-176.6	66.1	166.1	-6.4	111.5	V374 V378 D382 V384 P427 E428 T429 T433 L434 V435 T478	V374-R431 HydrophobicContact CG2-CG 4.2Å; V378-R431 HydrophobicContact CG2-CG 3.81Å; D382-R431 VanDerWaalsContact O-CD 3.23Å; D382-R431 WeakPolarHBondContact O-CD 3.46Å; D382-R431 PolarHBondContact O-NE 3.06Å; D382-R431 IonicContact OD1-CZ 3.78Å; D382-R431 IonicContact OD1-NH1 3.72Å; D382-R431 PolarHBondContact OD1-NH1 2.62Å; V384-R431 HydrophobicContact CB-CB 4.39Å; V384-R431 HydrophobicContact CG2-CB 3.75Å; V384-R431 HydrophobicContact CG2-CG 4.02Å; P427-R431 PolarHBondContact O-N 3.1Å; E428-R431 WeakPolarHBondContact O-CB 3.47Å; E428-R431 PolarHBondContact O-N 2.98Å; T429-R431 PolarHBondContact O-N 3.42Å; R431-T433 VanDerWaalsContact C-N 3.33Å; R431-T433 PolarHBondContact O-N 3.38Å; R431-L434 PolarHBondContact O-N 3.33Å; R431-V435 PolarHBondContact O-N 3.22Å; R431-V435 VanDerWaalsContact O-N 3.1Å; R431-T478 PolarHBondContact NH2-O 2.92Å
432	K	95.3	Very high	96.6	Very high	117 Å²	117	47.7 Å²	47.7	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-41.5	-178.5	-71.4	168.9	-172.5	162.1	0	111.9	E428 T429 V435 A436	E428-K432 WeakPolarHBondContact O-CG 3.2Å; E428-K432 PolarHBondContact O-N 3.49Å; T429-K432 PolarHBondContact O-N 3.23Å; K432-V435 PolarHBondContact O-N 2.76Å; K432-A436 WeakPolarHBondContact O-CB 3.3Å; K432-A436 PolarHBondContact O-N 3.41Å
433	T	97.4	Very high	96.6	Very high	26 Å²	26	43.8 Å²	43.8	16%	0.16	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-31.4	179.7	48.4	0	0	0	0	113.2	Y418 T429 R430 R431 A436 L437	Y418-T433 WeakPolarHBondContact CD1-O 3.25Å; Y418-T433 WeakPolarHBondContact O-CB 3.3Å; Y418-T433 WeakPolarHBondContact O-CG2 3.41Å; Y418-T433 PolarHBondContact O-OG1 3.28Å; T429-T433 WeakPolarHBondContact O-CG2 3.12Å; T429-T433 PolarHBondContact O-N 2.72Å; T429-T433 PolarHBondContact O-OG1 3.34Å; R430-T433 WeakPolarHBondContact CA-OG1 3.34Å; R430-T433 PolarHBondContact O-N 3.39Å; R430-T433 PolarHBondContact O-OG1 3.09Å; R431-T433 VanDerWaalsContact C-N 3.33Å; R431-T433 PolarHBondContact O-N 3.38Å; T433-A436 PolarHBondContact O-N 2.84Å; T433-L437 WeakPolarHBondContact O-CB 3.41Å; T433-L437 PolarHBondContact O-N 2.94Å
434	L	97.2	Very high	96.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68	-40.5	169.6	-74.4	173.8	0	0	0	112.8	F373 V374 V384 F389 V393 R430 R431 A436 L437 F438	F373-L434 HydrophobicContact CD1-CB 4.46Å; F373-L434 WeakPolarHBondContact CD1-O 3.39Å; F373-L434 HydrophobicContact CE1-CB 4.28Å; F373-L434 HydrophobicContact CE1-CD2 4.25Å; V374-L434 HydrophobicContact CG1-CB 3.51Å; V374-L434 HydrophobicContact CG1-CD1 4.29Å; V384-L434 HydrophobicContact CB-CD1 4.42Å; V384-L434 HydrophobicContact CG1-CD1 3.74Å; V384-L434 HydrophobicContact CG2-CD1 4.37Å; F389-L434 HydrophobicContact CB-CD1 4.43Å; F389-L434 HydrophobicContact CD2-CD1 3.95Å; F389-L434 HydrophobicContact CD2-CD2 3.59Å; F389-L434 HydrophobicContact CD2-CG 3.5Å; F389-L434 HydrophobicContact CE2-CD2 3.78Å; F389-L434 HydrophobicContact CE2-CG 3.87Å; F389-L434 HydrophobicContact CG-CD2 4.26Å; F389-L434 HydrophobicContact CG-CG 4.44Å; V393-L434 HydrophobicContact CG2-CD2 3.97Å; R430-L434 WeakPolarHBondContact O-CG 3.34Å; R430-L434 PolarHBondContact O-N 2.89Å; R431-L434 PolarHBondContact O-N 3.33Å; L434-A436 VanDerWaalsContact C-N 3.29Å; L434-L437 PolarHBondContact O-N 2.75Å; L434-F438 PolarHBondContact O-N 3.05Å
435	V	96.2	Very high	96.9	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-44.5	172.2	172.8	0	0	0	0	109.7	V374 R431 K432 F438 T439	V374-V435 HydrophobicContact CB-CG2 4.34Å; V374-V435 HydrophobicContact CG1-CG2 3.82Å; V374-V435 HydrophobicContact CG2-CG2 3.52Å; R431-V435 PolarHBondContact O-N 3.22Å; R431-V435 VanDerWaalsContact O-N 3.1Å; K432-V435 PolarHBondContact O-N 2.76Å; V435-F438 PolarHBondContact O-N 3.2Å; V435-T439 VanDerWaalsContact O-CB 3.23Å; V435-T439 WeakPolarHBondContact O-CB 3.39Å; V435-T439 PolarHBondContact O-N 2.04Å; V435-T439 PolarHBondContact O-OG1 3.44Å
436	A	97.8	Very high	97.1	Very high	32 Å²	32	34.6 Å²	34.6	26%	0.264	18%	0.177	S	C	.	.	H	α-helix	trans	-60.1	-48.9	176.4	0	0	0	0	0	111.5	Y418 K432 T433 L434 F438 T439 D440	Y418-A436 HydrophobicContact CE1-CB 4.34Å; K432-A436 WeakPolarHBondContact O-CB 3.3Å; K432-A436 PolarHBondContact O-N 3.41Å; T433-A436 PolarHBondContact O-N 2.84Å; L434-A436 VanDerWaalsContact C-N 3.29Å; A436-F438 VanDerWaalsContact C-N 3.32Å; A436-F438 PolarHBondContact O-N 3.49Å; A436-T439 CarbonylContact O-C 3.46Å; A436-T439 PolarHBondContact O-N 2.72Å; A436-T439 VanDerWaalsContact O-N 3.1Å; A436-D440 VanDerWaalsContact O-CB 3.25Å; A436-D440 WeakPolarHBondContact O-CB 3.19Å; A436-D440 PolarHBondContact O-N 2.69Å
437	L	98.1	Very high	97.2	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-50.8	-50.1	177.6	170.5	64	0	0	0	112.8	V393 F396 I414 Y418 T433 L434 H441	V393-L437 HydrophobicContact CG2-CD2 3.87Å; F396-L437 HydrophobicContact CD1-CD2 4.36Å; F396-L437 HydrophobicContact CE1-CD1 4.04Å; F396-L437 HydrophobicContact CE1-CG 4.44Å; F396-L437 HydrophobicContact CG-CD2 4.5Å; F396-L437 HydrophobicContact CZ-CD1 4.26Å; F396-L437 HydrophobicContact CZ-CG 4.47Å; I414-L437 HydrophobicContact CG2-CD1 3.66Å; I414-L437 HydrophobicContact CG2-CD2 4.1Å; Y418-L437 HydrophobicContact CD1-CB 3.74Å; Y418-L437 HydrophobicContact CD2-CB 4.38Å; Y418-L437 HydrophobicContact CD2-CD1 3.75Å; Y418-L437 HydrophobicContact CE1-CB 3.77Å; Y418-L437 HydrophobicContact CE1-CD1 4.3Å; Y418-L437 HydrophobicContact CE2-CB 4.4Å; Y418-L437 HydrophobicContact CE2-CD1 3.44Å; Y418-L437 VanDerWaalsContact CE2-CD1 3.44Å; Y418-L437 HydrophobicContact CG-CB 4.04Å; Y418-L437 HydrophobicContact CG-CD1 4.28Å; T433-L437 WeakPolarHBondContact O-CB 3.41Å; T433-L437 PolarHBondContact O-N 2.94Å; L434-L437 PolarHBondContact O-N 2.75Å; L437-H441 WeakPolarHBondContact O-CB 3.4Å; L437-H441 PolarHBondContact O-N 2.61Å; L437-H441 VanDerWaalsContact O-N 3.16Å
438	F	96.8	Very high	97.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-73.4	-36.3	-178.4	-161.5	-108.6	0	0	0	112	V117 W281 Y330 F373 F396 L434 V435 A436 Q442 W443	V117-F438 HydrophobicContact CB-CE1 4.37Å; W281-F438 HydrophobicContact CH2-CE1 4.14Å; W281-F438 HydrophobicContact CH2-CZ 4.23Å; W281-F438 HydrophobicContact CZ3-CE1 4.24Å; W281-F438 AromaticContact CZ3-CZ 3.92Å; W281-F438 HydrophobicContact CZ3-CZ 3.92Å; Y330-F438 AromaticContact CD1-CE2 3.65Å; Y330-F438 HydrophobicContact CD1-CE2 3.65Å; Y330-F438 AromaticContact CD1-CZ 3.55Å; Y330-F438 HydrophobicContact CD1-CZ 3.55Å; Y330-F438 HydrophobicContact CE1-CD2 4.49Å; Y330-F438 AromaticContact CE1-CE2 3.32Å; Y330-F438 HydrophobicContact CE1-CE2 3.32Å; Y330-F438 AromaticContact CE1-CZ 3.42Å; Y330-F438 HydrophobicContact CE1-CZ 3.42Å; Y330-F438 VanDerWaalsContact CE1-CZ 3.42Å; Y330-F438 HydrophobicContact CE2-CE2 4.48Å; Y330-F438 HydrophobicContact CG-CE2 4.34Å; Y330-F438 AromaticContact CZ-CE2 3.78Å; F373-F438 HydrophobicContact CB-CB 3.86Å; F373-F438 HydrophobicContact CB-CD1 3.6Å; F373-F438 HydrophobicContact CB-CD2 4.37Å; F373-F438 HydrophobicContact CB-CE1 4.23Å; F373-F438 HydrophobicContact CB-CG 3.68Å; F373-F438 HydrophobicContact CD1-CB 3.56Å; F373-F438 HydrophobicContact CD1-CD2 4.38Å; F373-F438 HydrophobicContact CD1-CG 4.02Å; F373-F438 HydrophobicContact CD2-CB 4.23Å; F373-F438 HydrophobicContact CD2-CD1 4.28Å; F373-F438 AromaticContact CD2-CD2 3.58Å; F373-F438 HydrophobicContact CD2-CD2 3.58Å; F373-F438 AromaticContact CD2-CE2 3.95Å; F373-F438 HydrophobicContact CD2-CE2 3.95Å; F373-F438 AromaticContact CD2-CG 3.77Å; F373-F438 HydrophobicContact CD2-CG 3.77Å; F373-F438 HydrophobicContact CD2-CZ 4.43Å; F373-F438 HydrophobicContact CE1-CB 4.11Å; F373-F438 AromaticContact CE2-CD2 3.88Å; F373-F438 HydrophobicContact CE2-CD2 3.88Å; F373-F438 HydrophobicContact CE2-CE2 4.31Å; F373-F438 HydrophobicContact CE2-CG 4.41Å; F373-F438 HydrophobicContact CG-CB 3.63Å; F373-F438 HydrophobicContact CG-CD1 4.01Å; F373-F438 AromaticContact CG-CD2 3.87Å; F373-F438 HydrophobicContact CG-CD2 3.87Å; F373-F438 AromaticContact CG-CG 3.56Å; F373-F438 HydrophobicContact CG-CG 3.56Å; F373-F438 HydrophobicContact CZ-CD2 4.38Å; F396-F438 AromaticContact CD2-CD2 3.81Å; F396-F438 HydrophobicContact CD2-CD2 3.81Å; F396-F438 HydrophobicContact CD2-CE2 4.23Å; F396-F438 AromaticContact CE2-CD2 3.75Å; F396-F438 HydrophobicContact CE2-CD2 3.75Å; F396-F438 HydrophobicContact CE2-CE2 4.23Å; L434-F438 PolarHBondContact O-N 3.05Å; V435-F438 PolarHBondContact O-N 3.2Å; A436-F438 VanDerWaalsContact C-N 3.32Å; A436-F438 PolarHBondContact O-N 3.49Å; F438-Q442 HydrophobicContact CD1-CG 4.29Å; F438-Q442 HydrophobicContact CD2-CG 4.02Å; F438-Q442 HydrophobicContact CE1-CG 4.02Å; F438-Q442 HydrophobicContact CE2-CG 3.7Å; F438-Q442 HydrophobicContact CG-CG 4.31Å; F438-Q442 HydrophobicContact CZ-CG 3.71Å; F438-Q442 VanDerWaalsContact O-CB 3.3Å; F438-Q442 WeakPolarHBondContact O-CB 3.46Å; F438-Q442 WeakPolarHBondContact O-CG 3.08Å; F438-Q442 PolarHBondContact O-N 3.06Å; F438-Q442 VanDerWaalsContact O-N 3.09Å; F438-W443 HydrophobicContact CD1-CH2 4.17Å; F438-W443 AromaticContact CD1-CZ3 3.68Å; F438-W443 HydrophobicContact CD1-CZ3 3.68Å; F438-W443 AromaticContact CE1-CH2 3.93Å; F438-W443 HydrophobicContact CE1-CH2 3.93Å; F438-W443 AromaticContact CE1-CZ3 3.83Å; F438-W443 HydrophobicContact CE1-CZ3 3.83Å
439	T	96.9	Very high	97.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-47.4	175	-58.5	0	0	0	0	110.9	E369 G370 V435 A436 W443 V444	E369-T439 HydrophobicContact CB-CG2 4.02Å; E369-T439 HydrophobicContact CG-CG2 4Å; E369-T439 PolarHBondContact N-OG1 3.42Å; G370-T439 PolarHBondContact N-OG1 2.87Å; V435-T439 VanDerWaalsContact O-CB 3.23Å; V435-T439 WeakPolarHBondContact O-CB 3.39Å; V435-T439 PolarHBondContact O-N 2.04Å; V435-T439 PolarHBondContact O-OG1 3.44Å; A436-T439 CarbonylContact O-C 3.46Å; A436-T439 PolarHBondContact O-N 2.72Å; A436-T439 VanDerWaalsContact O-N 3.1Å; T439-W443 WeakPolarHBondContact O-CB 3.36Å; T439-W443 PolarHBondContact O-N 2.84Å; T439-V444 HydrophobicContact CG2-CG2 3.99Å; T439-V444 PolarHBondContact O-N 3.41Å; T439-V444 VanDerWaalsContact O-N 3.08Å
440	D	98.2	Very high	97.4	Very high	57 Å²	57	29.4 Å²	29.4	31%	0.305	15%	0.152	S	C	.	.	I	π-helix	trans	-63.8	-50	-175.8	-71	-12.6	0	0	0	110.4	Y418 A436 V444 E445	Y418-D440 WeakPolarHBondContact OH-CB 3.4Å; Y418-D440 PolarHBondContact OH-OD2 2.99Å; A436-D440 VanDerWaalsContact O-CB 3.25Å; A436-D440 WeakPolarHBondContact O-CB 3.19Å; A436-D440 PolarHBondContact O-N 2.69Å; D440-V444 PolarHBondContact O-N 2.74Å; D440-E445 WeakPolarHBondContact O-CB 3.38Å; D440-E445 PolarHBondContact O-N 2.77Å
441	H	97.8	Very high	97.5	Very high	44 Å²	44	27.8 Å²	27.8	20%	0.204	15%	0.147	C	C	.	.	I	π-helix	trans	-71	-42.4	-177.6	-172.3	-82.1	0	0	0	113.7	F396 Y401 L437 P446	F396-H441 HydrophobicContact CE2-CB 4.16Å; F396-H441 HydrophobicContact CZ-CB 3.62Å; F396-H441 AromaticContact CZ-CD2 3.68Å; F396-H441 AromaticContact CZ-CG 3.48Å; F396-H441 VanDerWaalsContact CZ-CG 3.48Å; F396-H441 AromaticContact CZ-ND1 3.93Å; Y401-H441 AromaticContact CE2-NE2 3.6Å; Y401-H441 AromaticContact CZ-NE2 3.41Å; Y401-H441 PolarHBondContact OH-CD2 3.21Å; Y401-H441 PolarHBondContact OH-NE2 3.1Å; L437-H441 WeakPolarHBondContact O-CB 3.4Å; L437-H441 PolarHBondContact O-N 2.61Å; L437-H441 VanDerWaalsContact O-N 3.16Å; H441-P446 VanDerWaalsContact O-CD 3.24Å; H441-P446 WeakPolarHBondContact O-CD 2.96Å; H441-P446 WeakPolarHBondContact O-CG 3.23Å
442	Q	96.2	Very high	97.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.169	C	C	.	.	I	π-helix	trans	-87.1	-23.1	-171.6	-63.6	-59.7	113.6	0	0	113.5	S279 S280 W281 F438	S279-Q442 PolarHBondContact OG-O 2.8Å; S280-Q442 PolarHBondContact OG-NE2 3.28Å; W281-Q442 HydrophobicContact CH2-CB 3.47Å; W281-Q442 VanDerWaalsContact CH2-CB 3.47Å; W281-Q442 HydrophobicContact CH2-CG 3.63Å; W281-Q442 HydrophobicContact CZ2-CB 3.6Å; W281-Q442 HydrophobicContact CZ2-CG 4.2Å; W281-Q442 HydrophobicContact CZ3-CB 4.28Å; W281-Q442 HydrophobicContact CZ3-CG 3.95Å; F438-Q442 HydrophobicContact CD1-CG 4.29Å; F438-Q442 HydrophobicContact CD2-CG 4.02Å; F438-Q442 HydrophobicContact CE1-CG 4.02Å; F438-Q442 HydrophobicContact CE2-CG 3.7Å; F438-Q442 HydrophobicContact CG-CG 4.31Å; F438-Q442 HydrophobicContact CZ-CG 3.71Å; F438-Q442 VanDerWaalsContact O-CB 3.3Å; F438-Q442 WeakPolarHBondContact O-CB 3.46Å; F438-Q442 WeakPolarHBondContact O-CG 3.08Å; F438-Q442 PolarHBondContact O-N 3.06Å; F438-Q442 VanDerWaalsContact O-N 3.09Å
443	W	97.6	Very high	97.6	Very high	17 Å²	17	26.4 Å²	26.4	6%	0.064	15%	0.147	C	C	.	.	I	π-helix	trans	-129	-51	-175.7	-67.1	-88.3	0	0	0	114.6	S274 W281 V365 E369 F438 T439 S447	S274-W443 VanDerWaalsContact C-CD1 3.49Å; S274-W443 PolarHBondContact O-NE1 2.95Å; W281-W443 HydrophobicContact CH2-CE3 4.45Å; W281-W443 AromaticContact CH2-CH2 3.43Å; W281-W443 HydrophobicContact CH2-CH2 3.43Å; W281-W443 VanDerWaalsContact CH2-CH2 3.43Å; W281-W443 AromaticContact CH2-CZ2 3.51Å; W281-W443 HydrophobicContact CH2-CZ2 3.51Å; W281-W443 AromaticContact CH2-CZ3 3.92Å; W281-W443 HydrophobicContact CH2-CZ3 3.92Å; W281-W443 HydrophobicContact CZ2-CD2 4.19Å; W281-W443 AromaticContact CZ2-CE2 3.64Å; W281-W443 HydrophobicContact CZ2-CE3 4.48Å; W281-W443 AromaticContact CZ2-CH2 3.88Å; W281-W443 HydrophobicContact CZ2-CH2 3.88Å; W281-W443 AromaticContact CZ2-CZ2 3.48Å; W281-W443 HydrophobicContact CZ2-CZ2 3.48Å; W281-W443 VanDerWaalsContact CZ2-CZ2 3.48Å; W281-W443 HydrophobicContact CZ2-CZ3 4.35Å; V365-W443 HydrophobicContact CG1-CB 4.06Å; E369-W443 HydrophobicContact CB-CD2 3.39Å; E369-W443 HydrophobicContact CB-CE3 3.39Å; E369-W443 HydrophobicContact CB-CG 3.93Å; E369-W443 HydrophobicContact CB-CH2 3.96Å; E369-W443 HydrophobicContact CB-CZ2 4Å; E369-W443 HydrophobicContact CB-CZ3 3.69Å; E369-W443 HydrophobicContact CG-CB 4.02Å; E369-W443 HydrophobicContact CG-CD2 3.79Å; E369-W443 HydrophobicContact CG-CE3 4.17Å; E369-W443 HydrophobicContact CG-CG 3.74Å; F438-W443 HydrophobicContact CD1-CH2 4.17Å; F438-W443 AromaticContact CD1-CZ3 3.68Å; F438-W443 HydrophobicContact CD1-CZ3 3.68Å; F438-W443 AromaticContact CE1-CH2 3.93Å; F438-W443 HydrophobicContact CE1-CH2 3.93Å; F438-W443 AromaticContact CE1-CZ3 3.83Å; F438-W443 HydrophobicContact CE1-CZ3 3.83Å; T439-W443 WeakPolarHBondContact O-CB 3.36Å; T439-W443 PolarHBondContact O-N 2.84Å; W443-S447 VanDerWaalsContact O-CB 3.22Å; W443-S447 WeakPolarHBondContact O-CB 3.07Å; W443-S447 PolarHBondContact O-N 3.12Å; W443-S447 VanDerWaalsContact O-N 3.07Å; W443-S447 PolarHBondContact O-OG 3.11Å
444	V	98.4	Very high	97.6	Very high	39 Å²	39	25.2 Å²	25.2	24%	0.236	14%	0.139	C	C	.	.	I	π-helix	trans	-67.8	-55.4	-172.2	-173.5	0	0	0	0	111	V365 T439 D440 S447 V448	V365-V444 HydrophobicContact CG2-CG2 4.21Å; T439-V444 HydrophobicContact CG2-CG2 3.99Å; T439-V444 PolarHBondContact O-N 3.41Å; T439-V444 VanDerWaalsContact O-N 3.08Å; D440-V444 PolarHBondContact O-N 2.74Å; V444-S447 PolarHBondContact O-N 3.45Å; V444-S447 VanDerWaalsContact O-N 3.16Å; V444-V448 HydrophobicContact CG1-CG2 4.14Å; V444-V448 WeakPolarHBondContact O-CB 3.39Å; V444-V448 VanDerWaalsContact O-CG2 3.31Å; V444-V448 WeakPolarHBondContact O-CG2 3.01Å; V444-V448 PolarHBondContact O-N 2.71Å
445	E	98.2	Very high	97.5	Very high	109 Å²	109	27.4 Å²	27.4	51%	0.509	16%	0.157	S	C	.	.	H	α-helix	trans	-59	-49.7	-179.2	-177.5	-84	175.1	0	0	111.2	D440 S447 V448 V449	D440-E445 WeakPolarHBondContact O-CB 3.38Å; D440-E445 PolarHBondContact O-N 2.77Å; E445-S447 VanDerWaalsContact C-N 3.25Å; E445-S447 PolarHBondContact O-N 2.76Å; E445-V448 PolarHBondContact O-N 3.5Å; E445-V448 VanDerWaalsContact O-N 3.16Å; E445-V449 HydrophobicContact CG-CG2 4.43Å; E445-V449 WeakPolarHBondContact O-CG2 2.83Å; E445-V449 PolarHBondContact O-N 3.37Å
446	P	98.3	Very high	97.4	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.013	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-31	176.7	-29.5	38.6	0	0	0	113.8	S276 L278 H441 T450	S276-P446 PolarHBondContact OG-O 2.92Å; L278-P446 HydrophobicContact CB-CB 4.11Å; H441-P446 VanDerWaalsContact O-CD 3.24Å; H441-P446 WeakPolarHBondContact O-CD 2.96Å; H441-P446 WeakPolarHBondContact O-CG 3.23Å; P446-T450 WeakPolarHBondContact O-CB 3.44Å; P446-T450 PolarHBondContact O-N 2.99Å; P446-T450 PolarHBondContact O-OG1 2.9Å
447	S	98.1	Very high	96.6	Very high	1 Å²	1	39 Å²	39	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-78	-37.9	177.8	-57.6	0	0	0	0	112	L363 V365 W443 V444 E445 A451	L363-S447 VanDerWaalsContact CD1-O 3.28Å; L363-S447 WeakPolarHBondContact CD1-O 3.31Å; V365-S447 WeakPolarHBondContact CG1-OG 3.02Å; W443-S447 VanDerWaalsContact O-CB 3.22Å; W443-S447 WeakPolarHBondContact O-CB 3.07Å; W443-S447 PolarHBondContact O-N 3.12Å; W443-S447 VanDerWaalsContact O-N 3.07Å; W443-S447 PolarHBondContact O-OG 3.11Å; V444-S447 PolarHBondContact O-N 3.45Å; V444-S447 VanDerWaalsContact O-N 3.16Å; E445-S447 VanDerWaalsContact C-N 3.25Å; E445-S447 PolarHBondContact O-N 2.76Å; S447-A451 WeakPolarHBondContact O-CB 3.46Å; S447-A451 PolarHBondContact O-N 3.48Å
448	V	98.4	Very high	96.1	Very high	56 Å²	56	41.9 Å²	41.9	34%	0.339	23%	0.225	S	C	.	.	H	α-helix	trans	-68.2	-44.3	177.3	171.2	0	0	0	0	110.2	V444 E445 T450 A451 D452 F463	V444-V448 HydrophobicContact CG1-CG2 4.14Å; V444-V448 WeakPolarHBondContact O-CB 3.39Å; V444-V448 VanDerWaalsContact O-CG2 3.31Å; V444-V448 WeakPolarHBondContact O-CG2 3.01Å; V444-V448 PolarHBondContact O-N 2.71Å; E445-V448 PolarHBondContact O-N 3.5Å; E445-V448 VanDerWaalsContact O-N 3.16Å; V448-T450 PolarHBondContact O-N 3.28Å; V448-A451 WeakPolarHBondContact O-CB 3.48Å; V448-A451 PolarHBondContact O-N 2.79Å; V448-D452 WeakPolarHBondContact O-CB 3.37Å; V448-D452 PolarHBondContact O-N 2.87Å; V448-F463 HydrophobicContact CG2-CE2 4.33Å; V448-F463 HydrophobicContact CG2-CZ 4.16Å
449	V	98.1	Very high	96.1	Very high	39 Å²	39	42.8 Å²	42.8	24%	0.236	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-46.7	175.7	174.3	0	0	0	0	110.8	L278 E445 A451 D452 L453	L278-V449 HydrophobicContact CD1-CB 4Å; L278-V449 HydrophobicContact CD1-CG1 3.59Å; E445-V449 HydrophobicContact CG-CG2 4.43Å; E445-V449 WeakPolarHBondContact O-CG2 2.83Å; E445-V449 PolarHBondContact O-N 3.37Å; V449-A451 PolarHBondContact O-N 2.64Å; V449-D452 PolarHBondContact O-N 3.5Å; V449-L453 HydrophobicContact CG1-CD1 3.8Å; V449-L453 HydrophobicContact CG1-CG 4.37Å; V449-L453 WeakPolarHBondContact O-CB 3.04Å; V449-L453 WeakPolarHBondContact O-CG 3.49Å; V449-L453 PolarHBondContact O-N 2.77Å
450	T	98	Very high	96.2	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-45.4	174.1	-62.9	0	0	0	0	112	S276 M351 F356 L363 P446 V448 H454	S276-T450 PolarHBondContact OG-OG1 3.38Å; M351-T450 HydrophobicContact CE-CG2 4.05Å; M351-T450 HydrophobicContact SD-CG2 4.21Å; F356-T450 HydrophobicContact CE2-CG2 4.14Å; L363-T450 HydrophobicContact CD1-CG2 3.87Å; P446-T450 WeakPolarHBondContact O-CB 3.44Å; P446-T450 PolarHBondContact O-N 2.99Å; P446-T450 PolarHBondContact O-OG1 2.9Å; V448-T450 PolarHBondContact O-N 3.28Å; T450-H454 WeakPolarHBondContact O-CB 3.38Å; T450-H454 PolarHBondContact O-N 3.39Å
451	A	97.9	Very high	96.2	Very high	9 Å²	9	44.6 Å²	44.6	7%	0.074	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-44.8	179.3	0	0	0	0	0	111.9	L363 S447 V448 V449 H454 A455 T461 F463	L363-A451 HydrophobicContact CD1-CB 3.99Å; L363-A451 HydrophobicContact CD2-CB 3.94Å; L363-A451 HydrophobicContact CG-CB 4.32Å; S447-A451 WeakPolarHBondContact O-CB 3.46Å; S447-A451 PolarHBondContact O-N 3.48Å; V448-A451 WeakPolarHBondContact O-CB 3.48Å; V448-A451 PolarHBondContact O-N 2.79Å; V449-A451 PolarHBondContact O-N 2.64Å; A451-H454 PolarHBondContact O-N 2.7Å; A451-A455 WeakPolarHBondContact O-CB 3.33Å; A451-A455 PolarHBondContact O-N 3.36Å; A451-T461 HydrophobicContact CB-CG2 4.1Å; A451-F463 HydrophobicContact CB-CD2 3.88Å; A451-F463 HydrophobicContact CB-CE2 4.35Å
452	D	97.4	Very high	96.2	Very high	96 Å²	96	49.4 Å²	49.4	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-46.2	-179.2	-80.4	-8.4	0	0	0	111.1	V448 V449 A455 R456	V448-D452 WeakPolarHBondContact O-CB 3.37Å; V448-D452 PolarHBondContact O-N 2.87Å; V449-D452 PolarHBondContact O-N 3.5Å; D452-A455 PolarHBondContact O-N 2.97Å; D452-R456 VanDerWaalsContact O-CB 3.26Å; D452-R456 WeakPolarHBondContact O-CB 3.42Å; D452-R456 PolarHBondContact O-N 3Å
453	L	96.6	Very high	96.3	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-41.4	177.5	-71.7	172.3	0	0	0	111.6	M351 E352 F356 V449	M351-L453 HydrophobicContact CB-CB 4.31Å; M351-L453 HydrophobicContact CB-CD1 3.61Å; M351-L453 HydrophobicContact SD-CD1 4.27Å; E352-L453 HydrophobicContact CG-CD2 4.1Å; F356-L453 HydrophobicContact CE1-CB 4.47Å; F356-L453 HydrophobicContact CZ-CB 3.86Å; V449-L453 HydrophobicContact CG1-CD1 3.8Å; V449-L453 HydrophobicContact CG1-CG 4.37Å; V449-L453 WeakPolarHBondContact O-CB 3.04Å; V449-L453 WeakPolarHBondContact O-CG 3.49Å; V449-L453 PolarHBondContact O-N 2.77Å
454	H	97.3	Very high	96.4	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-45.7	177.6	-171.5	-102.6	0	0	0	112.1	F356 Y359 I361 T450 A451 R456 S459 T461	F356-H454 HydrophobicContact CE1-CB 4.4Å; F356-H454 HydrophobicContact CE2-CB 3.89Å; F356-H454 HydrophobicContact CZ-CB 3.78Å; F356-H454 PolarHBondContact O-CD2 3.32Å; F356-H454 PolarHBondContact O-NE2 2.92Å; Y359-H454 PolarHBondContact O-CE1 3.01Å; Y359-H454 PolarHBondContact O-NE2 3.2Å; I361-H454 WeakPolarHBondContact CD1-CD2 3.31Å; I361-H454 WeakPolarHBondContact CD1-NE2 3.3Å; I361-H454 WeakPolarHBondContact CG1-NE2 3.43Å; T450-H454 WeakPolarHBondContact O-CB 3.38Å; T450-H454 PolarHBondContact O-N 3.39Å; A451-H454 PolarHBondContact O-N 2.7Å; H454-R456 VanDerWaalsContact C-N 3.31Å; H454-R456 PolarHBondContact O-N 3.19Å; H454-S459 WeakPolarHBondContact CE1-CB 3.33Å; H454-S459 WeakPolarHBondContact NE2-CB 3.26Å; H454-T461 PolarHBondContact ND1-OG1 3.37Å
455	A	96.2	Very high	96.4	Very high	46 Å²	46	56.3 Å²	56.3	38%	0.38	30%	0.298	S	S	.	.	H	α-helix	trans	-71.3	-24.1	-179.1	0	0	0	0	0	113.2	A451 D452 Y457 G458	A451-A455 WeakPolarHBondContact O-CB 3.33Å; A451-A455 PolarHBondContact O-N 3.36Å; D452-A455 PolarHBondContact O-N 2.97Å; A455-Y457 PolarHBondContact O-N 3.44Å; A455-Y457 VanDerWaalsContact O-N 3.09Å; A455-G458 PolarHBondContact O-N 2.69Å
456	R	92.5	Very high	96.3	Very high	158 Å²	158	55 Å²	55	60%	0.596	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-32.9	-176.4	-174.3	175.8	-65.6	177.8	2.5	113.3	D452 H454	D452-R456 VanDerWaalsContact O-CB 3.26Å; D452-R456 WeakPolarHBondContact O-CB 3.42Å; D452-R456 PolarHBondContact O-N 3Å; H454-R456 VanDerWaalsContact C-N 3.31Å; H454-R456 PolarHBondContact O-N 3.19Å
457	Y	81	Confident	96	Very high	129 Å²	129	62.4 Å²	62.4	51%	0.506	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	11.7	-178.4	-58.6	-80.6	0	0	0	113.6	E352 L357 A455	E352-Y457 PolarHBondContact O-OH 3Å; L357-Y457 HydrophobicContact CD1-CD1 4.44Å; L357-Y457 HydrophobicContact CD1-CD2 3.53Å; L357-Y457 HydrophobicContact CD1-CE2 4.23Å; L357-Y457 HydrophobicContact CD1-CG 3.61Å; L357-Y457 HydrophobicContact CD2-CD2 3.74Å; L357-Y457 HydrophobicContact CD2-CG 4.26Å; L357-Y457 HydrophobicContact CG-CD2 4.22Å; A455-Y457 PolarHBondContact O-N 3.44Å; A455-Y457 VanDerWaalsContact O-N 3.09Å
458	G	89.2	Confident	95.6	Very high	65 Å²	65	68.5 Å²	68.5	67%	0.67	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	7.7	173.9	0	0	0	0	0	115.3	A455	A455-G458 PolarHBondContact O-N 2.69Å
459	S	96	Very high	94.9	Very high	18 Å²	18	67.8 Å²	67.8	13%	0.126	34%	0.341	C	S	.	.			trans	-66.4	143.2	175.2	-57.7	0	0	0	0	111.1	L357 H454 T461	L357-S459 PolarHBondContact O-OG 3.17Å; H454-S459 WeakPolarHBondContact CE1-CB 3.33Å; H454-S459 WeakPolarHBondContact NE2-CB 3.26Å; S459-T461 PolarHBondContact O-N 2.83Å; S459-T461 VanDerWaalsContact O-N 3.11Å; S459-T461 PolarHBondContact O-OG1 2.87Å
460	P	98.1	Very high	93.9	Very high	58 Å²	58	67.7 Å²	67.7	38%	0.377	34%	0.341	S	S	.	.			trans	-64.5	113.1	-178.9	-26	38.6	0	0	0	112.2	D360 I361 Y462	D360-P460 HydrophobicContact CB-CB 4.43Å; D360-P460 VanDerWaalsContact OD1-CG 3.26Å; D360-P460 WeakPolarHBondContact OD1-CG 3.42Å; I361-P460 PolarHBondContact N-O 2.95Å; P460-Y462 HydrophobicContact CB-CE2 4.31Å
461	T	98.5	Very high	92.2	Very high	40 Å²	40	75.2 Å²	75.2	25%	0.245	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.9	-179.3	-51	0	0	0	0	110.6	I361 L363 A451 H454 S459	I361-T461 CarbonylContact O-C 3.48Å; I361-T461 WeakPolarHBondContact O-CA 3.29Å; L363-T461 HydrophobicContact CD2-CG2 3.66Å; A451-T461 HydrophobicContact CB-CG2 4.1Å; H454-T461 PolarHBondContact ND1-OG1 3.37Å; S459-T461 PolarHBondContact O-N 2.83Å; S459-T461 VanDerWaalsContact O-N 3.11Å; S459-T461 PolarHBondContact O-OG1 2.87Å
462	Y	98.7	Very high	90.5	Very high	144 Å²	144	76.8 Å²	76.8	57%	0.565	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.2	175.1	-62.1	-91.5	0	0	0	109.9	I361 M362 L363 P460	I361-Y462 PolarHBondContact O-N 3.46Å; M362-Y462 CarbonylContact C-O 3.58Å; M362-Y462 VanDerWaalsContact CA-O 3.27Å; M362-Y462 WeakPolarHBondContact CA-O 2.77Å; L363-Y462 PolarHBondContact N-O 3.4Å; P460-Y462 HydrophobicContact CB-CE2 4.31Å
463	F	98.7	Very high	88.1	Confident	93 Å²	93	81.1 Å²	81.1	41%	0.408	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136.8	178	-160	-85.7	0	0	0	111.4	L363 V365 V448 A451	L363-F463 HydrophobicContact CD2-CD2 4Å; L363-F463 HydrophobicContact CG-CD2 3.81Å; L363-F463 HydrophobicContact CG-CE2 4.09Å; L363-F463 CarbonylContact O-C 3.54Å; L363-F463 VanDerWaalsContact O-CA 3.25Å; L363-F463 WeakPolarHBondContact O-CA 3.49Å; V365-F463 HydrophobicContact CG2-CE1 4.44Å; V365-F463 HydrophobicContact CG2-CZ 4.37Å; V448-F463 HydrophobicContact CG2-CE2 4.33Å; V448-F463 HydrophobicContact CG2-CZ 4.16Å; A451-F463 HydrophobicContact CB-CD2 3.88Å; A451-F463 HydrophobicContact CB-CE2 4.35Å
464	Y	98.6	Very high	85.7	Confident	61 Å²	61	86.6 Å²	86.6	24%	0.239	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.9	171.7	76.9	-94.9	0	0	0	112.1	Q273 M362 L363 G364 V365 F466	Q273-Y464 WeakPolarHBondContact CA-OH 3.42Å; Q273-Y464 VanDerWaalsContact CB-OH 3.32Å; Q273-Y464 WeakPolarHBondContact CB-OH 3.33Å; Q273-Y464 WeakPolarHBondContact CG-OH 2.93Å; M362-Y464 HydrophobicContact CG-CD1 4.25Å; L363-Y464 VanDerWaalsContact O-CD1 3.3Å; L363-Y464 WeakPolarHBondContact O-CD1 3.46Å; L363-Y464 PolarHBondContact O-N 3.21Å; G364-Y464 WeakPolarHBondContact CA-O 3.4Å; V365-Y464 PolarHBondContact N-O 2.78Å; Y464-F466 HydrophobicContact CD2-CB 4.19Å; Y464-F466 HydrophobicContact CE2-CB 4.06Å
465	A	97.9	Very high	83.1	Confident	48 Å²	48	90 Å²	90	40%	0.397	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.4	165.9	0	0	0	0	0	108.5	V365 Y467	V365-A465 CarbonylContact O-C 3.53Å; V365-A465 WeakPolarHBondContact O-CA 3.46Å; A465-Y467 HydrophobicContact CB-CD2 4.2Å; A465-Y467 HydrophobicContact CB-CE2 3.47Å; A465-Y467 VanDerWaalsContact CB-CE2 3.47Å; A465-Y467 WeakPolarHBondContact O-CD2 3.22Å
466	F	96.4	Very high	80.1	Confident	82 Å²	82	92.6 Å²	92.6	36%	0.36	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114.6	-171.9	-162	-101.4	0	0	0	110.9	V365 N366 Q367 Y464 H468	V365-F466 PolarHBondContact O-N 2.95Å; N366-F466 WeakPolarHBondContact OD1-CB 3.41Å; Q367-F466 PolarHBondContact N-O 3.39Å; Q367-F466 VanDerWaalsContact N-O 3.09Å; Y464-F466 HydrophobicContact CD2-CB 4.19Å; Y464-F466 HydrophobicContact CE2-CB 4.06Å; F466-H468 WeakPolarHBondContact CD1-O 3.25Å; F466-H468 HydrophobicContact CE1-CB 4.13Å; F466-H468 WeakPolarHBondContact CE1-O 3.31Å; F466-H468 HydrophobicContact CZ-CB 4.14Å
467	Y	93.4	Very high	77.5	Confident	158 Å²	158	88 Å²	88	62%	0.62	46%	0.46	S	S	*	.			trans	-111.6	10.9	-174.8	-72.6	-96	0	0	0	113.4	Q367 A465	Q367-Y467 HydrophobicContact CB-CD1 3.78Å; Q367-Y467 HydrophobicContact CB-CE1 3.87Å; Q367-Y467 HydrophobicContact CB-CG 4.39Å; Q367-Y467 HydrophobicContact CG-CD1 3.77Å; Q367-Y467 HydrophobicContact CG-CE1 3.62Å; A465-Y467 HydrophobicContact CB-CD2 4.2Å; A465-Y467 HydrophobicContact CB-CE2 3.47Å; A465-Y467 VanDerWaalsContact CB-CE2 3.47Å; A465-Y467 WeakPolarHBondContact O-CD2 3.22Å
468	H	89.3	Confident	75.4	Confident	129 Å²	129	85.9 Å²	85.9	60%	0.597	46%	0.46	S	S	*	.			trans	-110.2	155.8	177.7	-169.4	63.9	0	0	0	110.9	F466	F466-H468 WeakPolarHBondContact CD1-O 3.25Å; F466-H468 HydrophobicContact CE1-CB 4.13Å; F466-H468 WeakPolarHBondContact CE1-O 3.31Å; F466-H468 HydrophobicContact CZ-CB 4.14Å
469	H	82.4	Confident	72.9	Confident	41 Å²	41	84 Å²	84	19%	0.19	44%	0.437	C	S	.	.			trans	-157.3	161.1	170.8	70.9	78.6	0	0	0	109.4	R481 M483	H469-R481 VanDerWaalsContact CD2-C 3.45Å; H469-R481 PolarHBondContact CD2-O 2.87Å; H469-R481 WeakPolarHBondContact CE1-CB 3.27Å; H469-R481 WeakPolarHBondContact NE2-CB 3.49Å; H469-M483 WeakPolarHBondContact CA-O 3.37Å; H469-M483 WeakPolarHBondContact CB-O 3.48Å
470	C	78.7	Confident	70.1	Confident	37 Å²	37	85 Å²	85	25%	0.25	44%	0.443	C	S	.	.			trans	-89.2	145.2	175.4	-62	0	0	0	0	110.6	M483 C485	C470-M483 PolarHBondContact N-O 3.05Å; C470-C485 HydrophobicContact CB-CB 4.23Å; C470-C485 WeakPolarHBondContact CB-SG 3.42Å; C470-C485 WeakPolarHBondContact SG-CB 3.34Å; C470-C485 CovalentContact SG-SG 2.02Å; C470-C485 PolarHBondContact SG-SG 3.05Å
471	Q	61.3	Low	67.4	Low	160 Å²	160	88.3 Å²	88.3	75%	0.748	45%	0.448	S	S	*	.			trans	-76.1	126.8	172.4	-75.3	-175.6	-8.5	0	0	108.8
472	S	61.5	Low	64.6	Low	41 Å²	41	88.1 Å²	88.1	29%	0.287	44%	0.444	S	S	.	.			trans	-111.9	136	173.4	174.8	0	0	0	0	110	M474 K475 M483	S472-M474 PolarHBondContact O-N 3.23Å; S472-M474 VanDerWaalsContact O-N 3.08Å; S472-M474 PolarHBondContact OG-N 3.48Å; S472-K475 PolarHBondContact O-N 3.01Å; S472-M483 VanDerWaalsContact CB-SD 3.56Å
473	L	46.8	Very low	61.6	Low	187 Å²	187	82.8 Å²	82.8	98%	0.979	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.2	175.8	-72	164.2	0	0	0	113
474	M	47.8	Very low	58.6	Low	123 Å²	123	81.7 Å²	81.7	61%	0.606	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.3	-176.1	-67.5	-179.5	146.1	0	0	114.5	N126 S472	N126-M474 PolarHBondContact OD1-SD 2.99Å; N126-M474 VanDerWaalsContact OD1-SD 3.35Å; S472-M474 PolarHBondContact O-N 3.23Å; S472-M474 VanDerWaalsContact O-N 3.08Å; S472-M474 PolarHBondContact OG-N 3.48Å
475	K	42.2	Very low	55.4	Low	71 Å²	71	82.9 Å²	82.9	31%	0.309	44%	0.439	S	S	.	.	S	Bend	trans	-137.3	132.6	165.8	-77	-169.4	174.2	-176.5	0	110.9	E375 S472	E375-K475 IonicContact OE1-NZ 2.64Å; E375-K475 PolarHBondContact OE1-NZ 2.95Å; S472-K475 PolarHBondContact O-N 3.01Å
476	P	32.2	Very low	52.3	Low	102 Å²	102	83.5 Å²	83.5	66%	0.662	44%	0.441	S	S	*	.			trans	-60.5	156.7	175.3	20.9	-27.2	0	0	0	111.7	T478 S479	P476-T478 PolarHBondContact O-N 3.25Å; P476-S479 PolarHBondContact O-N 3.22Å
477	A	38.8	Very low	49.2	Very low	62 Å²	62	84.7 Å²	84.7	51%	0.512	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-0.1	-167.4	0	0	0	0	0	116.6	R481	A477-R481 PolarHBondContact O-NE 3.11Å; A477-R481 PolarHBondContact O-NH2 2.65Å
478	T	37.4	Very low	46.1	Very low	83 Å²	83	80.8 Å²	80.8	51%	0.509	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-9.3	-173	63.4	0	0	0	0	114.8	D382 R431 P476	D382-T478 WeakPolarHBondContact OD2-CB 3.47Å; D382-T478 PolarHBondContact OD2-OG1 2.96Å; R431-T478 PolarHBondContact NH2-O 2.92Å; P476-T478 PolarHBondContact O-N 3.25Å
479	S	36.6	Very low	43	Very low	27 Å²	27	80 Å²	80	19%	0.189	45%	0.453	C	S	.	.	S	Bend	trans	-71.9	147.3	169	67.5	0	0	0	0	111.4	P476 R481	P476-S479 PolarHBondContact O-N 3.22Å; S479-R481 WeakPolarHBondContact O-CG 3.31Å; S479-R481 PolarHBondContact O-N 3.07Å
480	P	37.1	Very low	40.3	Very low	39 Å²	39	85.4 Å²	85.4	25%	0.253	50%	0.496	S	S	.	.			trans	-55.7	113.7	171.3	-14.9	25.5	0	0	0	107.7	L371 M482	L371-P480 HydrophobicContact CD1-CB 3.97Å; L371-P480 HydrophobicContact CD1-CG 3.68Å; P480-M482 PolarHBondContact O-N 3.3Å
481	R	40.4	Very low	38.4	Very low	126 Å²	126	87.9 Å²	87.9	48%	0.475	51%	0.508	S	S	.	.			trans	-82.5	109.3	-159.1	-52.6	177	173.9	172.4	-1.6	107.5	H469 A477 S479	H469-R481 VanDerWaalsContact CD2-C 3.45Å; H469-R481 PolarHBondContact CD2-O 2.87Å; H469-R481 WeakPolarHBondContact CE1-CB 3.27Å; H469-R481 WeakPolarHBondContact NE2-CB 3.49Å; A477-R481 PolarHBondContact O-NE 3.11Å; A477-R481 PolarHBondContact O-NH2 2.65Å; S479-R481 WeakPolarHBondContact O-CG 3.31Å; S479-R481 PolarHBondContact O-N 3.07Å
482	M	40.4	Very low	37.2	Very low	36 Å²	36	84.1 Å²	84.1	18%	0.177	50%	0.495	C	S	.	.			trans	-151.7	98.6	-175.6	-153.2	156.5	-79	0	0	110.5	N366 Q367 G368 P480	N366-M482 HydrophobicContact CB-SD 3.88Å; Q367-M482 HydrophobicContact CB-CE 3.72Å; G368-M482 VanDerWaalsContact CA-CE 3.5Å; G368-M482 WeakPolarHBondContact CA-SD 3.34Å; G368-M482 PolarHBondContact N-SD 3Å; P480-M482 PolarHBondContact O-N 3.3Å
483	M	35.4	Very low	35.9	Very low	32 Å²	32	86.4 Å²	86.4	16%	0.158	51%	0.507	C	S	.	.			trans	-144.9	116.4	171.2	-157.8	176.8	-85.6	0	0	106.5	V121 W122 H469 C470 S472 C485	V121-M483 HydrophobicContact CG1-CE 4.21Å; W122-M483 HydrophobicContact CB-CG 4.46Å; H469-M483 WeakPolarHBondContact CA-O 3.37Å; H469-M483 WeakPolarHBondContact CB-O 3.48Å; C470-M483 PolarHBondContact N-O 3.05Å; S472-M483 VanDerWaalsContact CB-SD 3.56Å; M483-C485 PolarHBondContact O-N 3.47Å
484	L	35.1	Very low	35.2	Very low	71 Å²	71	80.5 Å²	80.5	37%	0.372	48%	0.479	S	S	.	.			trans	-59	133.3	164.1	-94.8	108.3	0	0	0	107.8	S486	L484-S486 PolarHBondContact O-N 3.37Å
485	C	32.8	Very low	34.4	Very low	85 Å²	85	77.9 Å²	77.9	57%	0.574	47%	0.471	S	S	*	.			trans	-63.3	101.2	171.1	-112.3	0	0	0	0	108.3	C470 M483	C470-C485 HydrophobicContact CB-CB 4.23Å; C470-C485 WeakPolarHBondContact CB-SG 3.42Å; C470-C485 WeakPolarHBondContact SG-CB 3.34Å; C470-C485 CovalentContact SG-SG 2.02Å; C470-C485 PolarHBondContact SG-SG 3.05Å; M483-C485 PolarHBondContact O-N 3.47Å
486	S	32.3	Very low	33.9	Very low	62 Å²	62	78.3 Å²	78.3	43%	0.434	48%	0.482	S	S	.	.			trans	-75.1	121.3	154	53.9	0	0	0	0	106.5	L484 L488	L484-S486 PolarHBondContact O-N 3.37Å; S486-L488 PolarHBondContact O-N 2.59Å
487	V	30.9	Very low	34	Very low	107 Å²	107	76.6 Å²	76.6	65%	0.648	47%	0.469	S	S	*	.			trans	-75.1	65.7	165.1	-169.9	0	0	0	0	107	I183	I183-V487 HydrophobicContact CD1-CB 4Å; I183-V487 HydrophobicContact CD1-CG1 3.46Å; I183-V487 VanDerWaalsContact CD1-CG1 3.46Å
488	L	28.7	Very low	33.7	Very low	75 Å²	75	77.8 Å²	77.8	39%	0.393	47%	0.466	S	S	.	.			trans	-113.9	71.4	170.8	-74.9	171.6	0	0	0	107	S486	S486-L488 PolarHBondContact O-N 2.59Å
489	S	23.6	Very low	33.4	Very low	114 Å²	114	77.3 Å²	77.3	80%	0.797	46%	0.462	S	S	*	.			trans	174.1	109	148.5	39.2	0	0	0	0	111.1
490	S	27.2	Very low	33.1	Very low	154 Å²	154	81.9 Å²	81.9	100%	1.077	49%	0.487	S	S	*	.				-143.9	0	128.3	60.4	0	0	0	0	107.7	P59	P59-S490 VanDerWaalsContact CB-OG 3.27Å; P59-S490 WeakPolarHBondContact CB-OG 3.21Å; P59-S490 WeakPolarHBondContact CG-OG 3.13Å

Retrieved 490 of 490 residues in 239.7 ms (Link to these results)

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