A0A087XN40_POEFO Loading...

Xeroderma pigmentosum, complementation group A

AlphaFold DB , UniProt , Accession A0A087XN40, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 275 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	46.4	Very low	41.8	Very low	241 Å²	241	146.8 Å²	146.8	100%	1.187	88%	0.875	S	S	*	*				0	83.8	0	-73.4	-156.4	176.3	0	0	106.6
2	D	37.5	Very low	42.2	Very low	153 Å²	153	143 Å²	143	82%	0.818	87%	0.871	S	S	*	*			trans	-58.7	136.1	-173.7	-70.1	-103.5	0	0	0	113.4
3	R	44.5	Very low	42.9	Very low	248 Å²	248	139 Å²	139	94%	0.936	86%	0.862	S	S	*	*			trans	-123	96.3	159.6	-93.6	169.2	74.8	173.9	2.6	106.2
4	S	42.8	Very low	44.1	Very low	95 Å²	95	137.5 Å²	137.5	66%	0.664	86%	0.855	S	S	*	*			trans	-133.1	110.4	172.7	-57.3	0	0	0	0	108.6
5	E	42.4	Very low	45.1	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	85%	0.849	S	S	*	*			trans	42.1	115.8	139.1	-62.7	171.2	158.7	0	0	119.5
6	S	41.6	Very low	45.7	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	85%	0.846	S	S	*	*			trans	-129.8	102.7	150.8	56.5	0	0	0	0	109.8	G8	S6-G8 PolarHBondContact O-N 3.22Å
7	E	40.5	Very low	45.8	Very low	198 Å²	198	136.6 Å²	136.6	93%	0.925	85%	0.846	S	S	*	*			trans	-73.9	114.3	167.5	-68.3	-176.2	141.4	0	0	109.1
8	G	39.8	Very low	46.2	Very low	77 Å²	77	139.2 Å²	139.2	79%	0.794	85%	0.846	S	S	*	*			trans	-97.7	109.9	172	0	0	0	0	0	110.6	S6 G10	S6-G8 PolarHBondContact O-N 3.22Å; G8-G10 PolarHBondContact O-N 3.33Å; G8-G10 VanDerWaalsContact O-N 3.14Å
9	A	43.3	Very low	46.5	Very low	112 Å²	112	137.3 Å²	137.3	93%	0.926	84%	0.84	S	S	*	*			trans	-64.1	104.9	171	0	0	0	0	0	110.9
10	G	38.4	Very low	47.1	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	84%	0.839	S	S	*	*			trans	-86.9	109.9	171	0	0	0	0	0	110.8	G8 A12	G8-G10 PolarHBondContact O-N 3.33Å; G8-G10 VanDerWaalsContact O-N 3.14Å; G10-A12 PolarHBondContact O-N 3.21Å
11	A	42.9	Very low	48	Very low	103 Å²	103	139.2 Å²	139.2	85%	0.851	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-56.2	125.4	174.8	0	0	0	0	0	111.6	A13	A11-A13 PolarHBondContact O-N 3.49Å
12	A	46.4	Very low	48.9	Very low	101 Å²	101	133.6 Å²	133.6	84%	0.835	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67.9	119.1	173.9	0	0	0	0	0	110.2	G10	G10-A12 PolarHBondContact O-N 3.21Å
13	A	51.6	Low	50.7	Low	91 Å²	91	134.2 Å²	134.2	75%	0.752	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-67.9	141.6	173.7	0	0	0	0	0	111	A11	A11-A13 PolarHBondContact O-N 3.49Å
14	P	59.9	Low	52.5	Low	118 Å²	118	126.5 Å²	126.5	77%	0.766	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.8	149.4	177.6	28.6	-33.1	0	0	0	111.6
15	P	58.8	Low	54.6	Low	118 Å²	118	125.4 Å²	125.4	77%	0.766	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.9	146.3	-177.9	28.1	-33.8	0	0	0	111.7
16	P	53.8	Low	56.7	Low	122 Å²	122	120.3 Å²	120.3	79%	0.792	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71.2	136.1	-178.2	28.7	-33.5	0	0	0	112	Q18	P16-Q18 PolarHBondContact O-N 2.65Å
17	D	47.8	Very low	58.9	Low	157 Å²	157	117.9 Å²	117.9	84%	0.84	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-50.4	120.9	178.9	-157	3.2	0	0	0	112.6	S19	D17-S19 PolarHBondContact O-N 3.35Å
18	Q	54	Low	61.2	Low	184 Å²	184	113.4 Å²	113.4	86%	0.86	74%	0.744	S	S	*	*			trans	-78.2	89.7	178.4	-69.2	-177	29.3	0	0	109.5	P16	P16-Q18 PolarHBondContact O-N 2.65Å
19	S	52	Low	63.6	Low	103 Å²	103	116.1 Å²	116.1	72%	0.72	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60.6	133.9	167.5	43.8	0	0	0	0	110.9	D17 K21	D17-S19 PolarHBondContact O-N 3.35Å; S19-K21 PolarHBondContact O-N 3.13Å
20	P	58.6	Low	65.9	Low	126 Å²	126	113 Å²	113	82%	0.818	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.5	128.6	-178.5	25.8	-32.4	0	0	0	110.2
21	K	64.2	Low	68.5	Low	189 Å²	189	115.8 Å²	115.8	82%	0.822	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-55.1	137	176.6	-67.6	173.4	-177.3	169.9	0	109.4	S19 E23	S19-K21 PolarHBondContact O-N 3.13Å; K21-E23 PolarHBondContact O-N 2.88Å
22	P	65.7	Low	71	Confident	122 Å²	122	115 Å²	115	79%	0.792	68%	0.676	S	S	*	*			trans	-62.8	112.9	-179.3	24.9	-32.8	0	0	0	109.8	L24	P22-L24 PolarHBondContact O-N 3.24Å
23	E	76.6	Confident	73.3	Confident	167 Å²	167	114 Å²	114	78%	0.78	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-67.1	123.2	177.1	-69.1	-165.6	-167.8	0	0	110.2	K21 S25 R29	K21-E23 PolarHBondContact O-N 2.88Å; E23-S25 PolarHBondContact O-N 2.87Å; E23-R29 IonicContact OE2-NH2 3.52Å
24	L	80.9	Confident	75.4	Confident	86 Å²	86	117.5 Å²	117.5	45%	0.45	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-61.6	133.2	179.9	-57.6	173.8	0	0	0	110.1	P22 M28 R29 I32	P22-L24 PolarHBondContact O-N 3.24Å; L24-M28 HydrophobicContact CB-CB 4.39Å; L24-M28 HydrophobicContact CB-SD 4.37Å; L24-M28 HydrophobicContact CD2-SD 3.59Å; L24-M28 VanDerWaalsContact CD2-SD 3.59Å; L24-M28 HydrophobicContact CG-SD 4.49Å; L24-R29 HydrophobicContact CB-CG 4.1Å; L24-R29 PolarHBondContact O-NE 3.4Å; L24-R29 PolarHBondContact O-NH2 3.46Å; L24-I32 HydrophobicContact CD1-CD1 3.77Å
25	S	87	Confident	77.1	Confident	72 Å²	72	116.6 Å²	116.6	50%	0.503	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-59.8	153.3	178	73.5	0	0	0	0	111.8	E23 A27 M28 R29	E23-S25 PolarHBondContact O-N 2.87Å; S25-A27 PolarHBondContact O-N 3.1Å; S25-M28 WeakPolarHBondContact O-CA 3.27Å; S25-M28 WeakPolarHBondContact O-CB 3.34Å; S25-M28 PolarHBondContact O-N 2.84Å; S25-M28 PolarHBondContact OG-N 2.76Å; S25-R29 PolarHBondContact O-N 2.93Å
26	A	87.8	Confident	78.9	Confident	83 Å²	83	118.5 Å²	118.5	69%	0.686	63%	0.629	S	S	*	*	H	α-helix	trans	-54.8	-37.6	180	0	0	0	0	0	112.6	M28 R29 A30	A26-M28 VanDerWaalsContact C-N 3.33Å; A26-M28 PolarHBondContact O-N 2.67Å; A26-R29 PolarHBondContact O-N 2.89Å; A26-A30 WeakPolarHBondContact O-CB 3.13Å; A26-A30 PolarHBondContact O-N 2.81Å
27	A	87.4	Confident	80.9	Confident	72 Å²	72	117.8 Å²	117.8	60%	0.595	62%	0.615	S	S	*	*	H	α-helix	trans	-63.6	-37.8	175.2	0	0	0	0	0	112.6	S25 K31	S25-A27 PolarHBondContact O-N 3.1Å; A27-K31 PolarHBondContact O-N 3.35Å; A27-K31 VanDerWaalsContact O-N 3.11Å
28	M	87.8	Confident	83.1	Confident	103 Å²	103	119.1 Å²	119.1	51%	0.507	61%	0.608	S	S	.	*	H	α-helix	trans	-71	-42.3	178	-159.2	170.3	-141.3	0	0	111.2	L24 S25 A26 A30 K31 I32	L24-M28 HydrophobicContact CB-CB 4.39Å; L24-M28 HydrophobicContact CB-SD 4.37Å; L24-M28 HydrophobicContact CD2-SD 3.59Å; L24-M28 VanDerWaalsContact CD2-SD 3.59Å; L24-M28 HydrophobicContact CG-SD 4.49Å; S25-M28 WeakPolarHBondContact O-CA 3.27Å; S25-M28 WeakPolarHBondContact O-CB 3.34Å; S25-M28 PolarHBondContact O-N 2.84Å; S25-M28 PolarHBondContact OG-N 2.76Å; A26-M28 VanDerWaalsContact C-N 3.33Å; A26-M28 PolarHBondContact O-N 2.67Å; M28-A30 VanDerWaalsContact C-N 3.34Å; M28-A30 PolarHBondContact O-N 2.98Å; M28-K31 PolarHBondContact O-N 2.77Å; M28-I32 HydrophobicContact CG-CD1 4.43Å; M28-I32 VanDerWaalsContact O-CG1 3.29Å; M28-I32 WeakPolarHBondContact O-CG1 3.41Å; M28-I32 PolarHBondContact O-N 2.9Å
29	R	90.4	Very high	85.1	Confident	134 Å²	134	113.1 Å²	113.1	51%	0.506	59%	0.59	S	S	.	*	H	α-helix	trans	-59.6	-43.2	173.6	-63.1	-178.4	-166.5	-175.6	2.2	111.6	E23 L24 S25 A26 K31 I32 E33	E23-R29 IonicContact OE2-NH2 3.52Å; L24-R29 HydrophobicContact CB-CG 4.1Å; L24-R29 PolarHBondContact O-NE 3.4Å; L24-R29 PolarHBondContact O-NH2 3.46Å; S25-R29 PolarHBondContact O-N 2.93Å; A26-R29 PolarHBondContact O-N 2.89Å; R29-K31 VanDerWaalsContact C-N 3.33Å; R29-K31 PolarHBondContact O-N 2.78Å; R29-I32 PolarHBondContact O-N 2.8Å; R29-E33 PolarHBondContact O-N 3.29Å
30	A	92.6	Very high	87.1	Confident	47 Å²	47	112.5 Å²	112.5	39%	0.388	58%	0.578	S	S	.	*	H	α-helix	trans	-66.2	-31.5	176.8	0	0	0	0	0	113.6	A26 M28 R34	A26-A30 WeakPolarHBondContact O-CB 3.13Å; A26-A30 PolarHBondContact O-N 2.81Å; M28-A30 VanDerWaalsContact C-N 3.34Å; M28-A30 PolarHBondContact O-N 2.98Å; A30-R34 PolarHBondContact O-N 3.32Å; A30-R34 VanDerWaalsContact O-N 3.16Å; A30-R34 PolarHBondContact O-NE 3.1Å
31	K	92.8	Very high	88.7	Confident	133 Å²	133	112.7 Å²	112.7	58%	0.578	57%	0.57	S	S	*	*	H	α-helix	trans	-72.3	-40.4	174.4	-170	175.5	-178.3	178.2	0	111.5	A27 M28 R29 N35	A27-K31 PolarHBondContact O-N 3.35Å; A27-K31 VanDerWaalsContact O-N 3.11Å; M28-K31 PolarHBondContact O-N 2.77Å; R29-K31 VanDerWaalsContact C-N 3.33Å; R29-K31 PolarHBondContact O-N 2.78Å; K31-N35 PolarHBondContact O-N 2.89Å
32	I	94.5	Very high	90	Very high	87 Å²	87	108.3 Å²	108.3	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-45.8	175.3	-68.1	164.4	0	0	0	110.1	L24 M28 R29 N35 R36	L24-I32 HydrophobicContact CD1-CD1 3.77Å; M28-I32 HydrophobicContact CG-CD1 4.43Å; M28-I32 VanDerWaalsContact O-CG1 3.29Å; M28-I32 WeakPolarHBondContact O-CG1 3.41Å; M28-I32 PolarHBondContact O-N 2.9Å; R29-I32 PolarHBondContact O-N 2.8Å; I32-N35 PolarHBondContact O-N 3.33Å; I32-R36 WeakPolarHBondContact O-CB 3.49Å; I32-R36 PolarHBondContact O-N 3.33Å
33	E	95.1	Very high	91	Very high	79 Å²	79	110.7 Å²	110.7	37%	0.369	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-40.7	-178.9	-165.7	56.5	-148.6	0	0	112.4	R29 N35 R36 Q37	R29-E33 PolarHBondContact O-N 3.29Å; E33-N35 PolarHBondContact O-N 3.02Å; E33-R36 WeakPolarHBondContact O-CB 3.22Å; E33-R36 PolarHBondContact O-N 3.31Å; E33-R36 IonicContact OE2-NH1 3.84Å; E33-Q37 WeakPolarHBondContact O-CG 3.35Å; E33-Q37 PolarHBondContact O-N 3.36Å
34	R	94.9	Very high	91.7	Very high	165 Å²	165	108.9 Å²	108.9	62%	0.623	54%	0.539	S	S	*	.	H	α-helix	trans	-60.7	-42.8	172.9	-82.9	-175.7	-76.5	159.6	-10.4	112.7	A30 R36 Q37 R38	A30-R34 PolarHBondContact O-N 3.32Å; A30-R34 VanDerWaalsContact O-N 3.16Å; A30-R34 PolarHBondContact O-NE 3.1Å; R34-R36 VanDerWaalsContact C-N 3.33Å; R34-Q37 PolarHBondContact O-N 3.03Å; R34-R38 WeakPolarHBondContact O-CB 3.25Å; R34-R38 PolarHBondContact O-N 3.22Å
35	N	95.6	Very high	91.9	Very high	100 Å²	100	107.4 Å²	107.4	54%	0.535	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-39.2	176.3	-81.5	-5.3	0	0	0	111.6	K31 I32 E33 R38 A39	K31-N35 PolarHBondContact O-N 2.89Å; I32-N35 PolarHBondContact O-N 3.33Å; E33-N35 PolarHBondContact O-N 3.02Å; N35-R38 PolarHBondContact O-N 3.33Å; N35-A39 WeakPolarHBondContact O-CB 3.4Å; N35-A39 PolarHBondContact O-N 3.28Å
36	R	96.6	Very high	91.6	Very high	157 Å²	157	113 Å²	113	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-61.1	-48.2	175.4	-173.9	-175.4	-176.8	176.3	1.4	111.6	I32 E33 R34 R38 A39 L40	I32-R36 WeakPolarHBondContact O-CB 3.49Å; I32-R36 PolarHBondContact O-N 3.33Å; E33-R36 WeakPolarHBondContact O-CB 3.22Å; E33-R36 PolarHBondContact O-N 3.31Å; E33-R36 IonicContact OE2-NH1 3.84Å; R34-R36 VanDerWaalsContact C-N 3.33Å; R36-R38 PolarHBondContact O-N 3.45Å; R36-A39 PolarHBondContact O-N 3.41Å; R36-L40 HydrophobicContact CG-CD1 4.41Å; R36-L40 WeakPolarHBondContact O-CG 3.22Å; R36-L40 PolarHBondContact O-N 2.99Å
37	Q	96.3	Very high	91	Very high	108 Å²	108	114.8 Å²	114.8	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-60.8	-43.8	177.7	-71.5	173.6	-2.5	0	0	111.9	E33 R34 A39 L40 M41	E33-Q37 WeakPolarHBondContact O-CG 3.35Å; E33-Q37 PolarHBondContact O-N 3.36Å; R34-Q37 PolarHBondContact O-N 3.03Å; Q37-A39 VanDerWaalsContact C-N 3.34Å; Q37-A39 PolarHBondContact O-N 2.82Å; Q37-L40 PolarHBondContact O-N 3.01Å; Q37-M41 WeakPolarHBondContact O-CG 3.2Å; Q37-M41 PolarHBondContact O-N 3.18Å
38	R	94.9	Very high	90.5	Very high	185 Å²	185	115.6 Å²	115.6	70%	0.698	55%	0.554	S	S	*	*	H	α-helix	trans	-62.1	-40.5	176.7	-169.3	175.7	-176.9	175.7	1.6	112.3	R34 N35 R36 L42	R34-R38 WeakPolarHBondContact O-CB 3.25Å; R34-R38 PolarHBondContact O-N 3.22Å; N35-R38 PolarHBondContact O-N 3.33Å; R36-R38 PolarHBondContact O-N 3.45Å; R38-L42 HydrophobicContact CG-CD1 4.5Å; R38-L42 WeakPolarHBondContact O-CG 2.77Å; R38-L42 PolarHBondContact O-N 2.96Å; R38-L42 VanDerWaalsContact O-N 3.1Å
39	A	94.5	Very high	89.6	Confident	58 Å²	58	115 Å²	115	48%	0.479	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-39.5	176.9	0	0	0	0	0	112.5	N35 R36 Q37 L42 R43	N35-A39 WeakPolarHBondContact O-CB 3.4Å; N35-A39 PolarHBondContact O-N 3.28Å; R36-A39 PolarHBondContact O-N 3.41Å; Q37-A39 VanDerWaalsContact C-N 3.34Å; Q37-A39 PolarHBondContact O-N 2.82Å; A39-L42 PolarHBondContact O-N 3.4Å; A39-R43 PolarHBondContact O-N 3.11Å
40	L	95.3	Very high	88.6	Confident	89 Å²	89	116.6 Å²	116.6	47%	0.466	57%	0.566	S	S	.	*	H	α-helix	trans	-63.8	-44.2	175.6	-73	172.3	0	0	0	111.9	R36 Q37 L42 R43 Q44	R36-L40 HydrophobicContact CG-CD1 4.41Å; R36-L40 WeakPolarHBondContact O-CG 3.22Å; R36-L40 PolarHBondContact O-N 2.99Å; Q37-L40 PolarHBondContact O-N 3.01Å; L40-L42 PolarHBondContact O-N 2.98Å; L40-R43 WeakPolarHBondContact O-CB 2.98Å; L40-R43 PolarHBondContact O-N 3.19Å; L40-R43 VanDerWaalsContact O-N 3.17Å; L40-Q44 PolarHBondContact O-N 2.91Å
41	M	91.9	Very high	86.8	Confident	130 Å²	130	119.2 Å²	119.2	64%	0.64	58%	0.579	S	S	*	*	H	α-helix	trans	-59.8	-45.1	175.7	-77.5	-70	-74.6	0	0	112.1	Q37 R43 Q44 A45	Q37-M41 WeakPolarHBondContact O-CG 3.2Å; Q37-M41 PolarHBondContact O-N 3.18Å; M41-R43 VanDerWaalsContact C-N 3.29Å; M41-R43 PolarHBondContact O-N 3.43Å; M41-Q44 PolarHBondContact O-N 3.17Å; M41-A45 WeakPolarHBondContact O-CB 3.46Å; M41-A45 PolarHBondContact O-N 3.44Å
42	L	90.6	Very high	84.9	Confident	97 Å²	97	121.5 Å²	121.5	51%	0.508	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-34.9	176.2	-73.5	169.7	0	0	0	112.4	R38 A39 L40 R46	R38-L42 HydrophobicContact CG-CD1 4.5Å; R38-L42 WeakPolarHBondContact O-CG 2.77Å; R38-L42 PolarHBondContact O-N 2.96Å; R38-L42 VanDerWaalsContact O-N 3.1Å; A39-L42 PolarHBondContact O-N 3.4Å; L40-L42 PolarHBondContact O-N 2.98Å; L42-R46 WeakPolarHBondContact O-CG 3.42Å; L42-R46 PolarHBondContact O-N 3.35Å; L42-R46 VanDerWaalsContact O-N 3.12Å
43	R	87.4	Confident	82.9	Confident	173 Å²	173	122.4 Å²	122.4	65%	0.653	61%	0.611	S	S	*	*	H	α-helix	trans	-69.4	-42.7	176.2	-173.3	178.7	178	-175.4	-0.9	111.8	A39 L40 M41 R46 L47	A39-R43 PolarHBondContact O-N 3.11Å; L40-R43 WeakPolarHBondContact O-CB 2.98Å; L40-R43 PolarHBondContact O-N 3.19Å; L40-R43 VanDerWaalsContact O-N 3.17Å; M41-R43 VanDerWaalsContact C-N 3.29Å; M41-R43 PolarHBondContact O-N 3.43Å; R43-R46 PolarHBondContact O-N 2.82Å; R43-L47 WeakPolarHBondContact O-CG 3.5Å; R43-L47 PolarHBondContact O-N 2.9Å; R43-L47 VanDerWaalsContact O-N 3.11Å
44	Q	90.7	Very high	80.2	Confident	128 Å²	128	122.6 Å²	122.6	60%	0.598	63%	0.626	S	S	*	*	H	α-helix	trans	-63	-44.4	175	-75.6	-178.7	-4.1	0	0	111.4	L40 M41 R46 L47 A48	L40-Q44 PolarHBondContact O-N 2.91Å; M41-Q44 PolarHBondContact O-N 3.17Å; Q44-R46 VanDerWaalsContact C-N 3.31Å; Q44-R46 PolarHBondContact O-N 3.26Å; Q44-L47 PolarHBondContact O-N 3.03Å; Q44-L47 VanDerWaalsContact O-N 3.12Å; Q44-A48 PolarHBondContact O-N 3.26Å
45	A	86.2	Confident	77.8	Confident	56 Å²	56	121.3 Å²	121.3	46%	0.463	64%	0.636	S	S	.	*	H	α-helix	trans	-58.7	-41.8	176.6	0	0	0	0	0	112.2	M41 L47 A48 S49	M41-A45 WeakPolarHBondContact O-CB 3.46Å; M41-A45 PolarHBondContact O-N 3.44Å; A45-L47 PolarHBondContact O-N 3.35Å; A45-A48 PolarHBondContact O-N 3.45Å; A45-S49 WeakPolarHBondContact O-CB 3.46Å; A45-S49 PolarHBondContact O-N 3.45Å; A45-S49 PolarHBondContact O-OG 2.91Å
46	R	80	Confident	75.1	Confident	190 Å²	190	125.5 Å²	125.5	72%	0.717	65%	0.653	S	S	*	*	H	α-helix	trans	-66.2	-33	175.7	-74.7	176.4	-178.7	-179.1	0.4	113.8	L42 R43 Q44 S49 R50	L42-R46 WeakPolarHBondContact O-CG 3.42Å; L42-R46 PolarHBondContact O-N 3.35Å; L42-R46 VanDerWaalsContact O-N 3.12Å; R43-R46 PolarHBondContact O-N 2.82Å; Q44-R46 VanDerWaalsContact C-N 3.31Å; Q44-R46 PolarHBondContact O-N 3.26Å; R46-S49 PolarHBondContact O-OG 3.48Å; R46-R50 PolarHBondContact O-N 3.04Å
47	L	75.1	Confident	72.7	Confident	119 Å²	119	122 Å²	122	62%	0.623	67%	0.665	S	S	*	*	H	α-helix	trans	-72.9	-39.2	175.4	-73.1	171.7	0	0	0	111.3	R43 Q44 A45 R50	R43-L47 WeakPolarHBondContact O-CG 3.5Å; R43-L47 PolarHBondContact O-N 2.9Å; R43-L47 VanDerWaalsContact O-N 3.11Å; Q44-L47 PolarHBondContact O-N 3.03Å; Q44-L47 VanDerWaalsContact O-N 3.12Å; A45-L47 PolarHBondContact O-N 3.35Å; L47-R50 PolarHBondContact O-N 3.22Å
48	A	76.5	Confident	69.8	Low	90 Å²	90	121.8 Å²	121.8	74%	0.744	68%	0.682	S	S	*	*	H	α-helix	trans	-69.6	-34.3	176.1	0	0	0	0	0	112.8	Q44 A45 R50	Q44-A48 PolarHBondContact O-N 3.26Å; A45-A48 PolarHBondContact O-N 3.45Å; A48-R50 VanDerWaalsContact C-N 3.26Å; A48-R50 PolarHBondContact O-N 3.44Å
49	S	70.2	Confident	67.2	Low	91 Å²	91	119.5 Å²	119.5	64%	0.636	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	6.6	178.6	74.9	0	0	0	0	113.7	A45 R46 P51	A45-S49 WeakPolarHBondContact O-CB 3.46Å; A45-S49 PolarHBondContact O-N 3.45Å; A45-S49 PolarHBondContact O-OG 2.91Å; R46-S49 PolarHBondContact O-OG 3.48Å; S49-P51 WeakPolarHBondContact O-CD 3.27Å
50	R	68.2	Low	64.5	Low	166 Å²	166	122.4 Å²	122.4	63%	0.626	71%	0.705	S	S	*	*	S	Bend	trans	-81.1	118	177.7	-169.2	175	127.6	169	-2.6	108.4	R46 L47 A48 L52	R46-R50 PolarHBondContact O-N 3.04Å; L47-R50 PolarHBondContact O-N 3.22Å; A48-R50 VanDerWaalsContact C-N 3.26Å; A48-R50 PolarHBondContact O-N 3.44Å; R50-L52 PolarHBondContact O-N 3.29Å
51	P	54.8	Low	61.7	Low	103 Å²	103	122.5 Å²	122.5	67%	0.669	72%	0.719	S	S	*	*			trans	-61.3	128.5	174.4	25	-31.6	0	0	0	109	S49 S53	S49-P51 WeakPolarHBondContact O-CD 3.27Å; P51-S53 VanDerWaalsContact C-N 3.28Å; P51-S53 PolarHBondContact O-N 3.06Å
52	L	54	Low	59.2	Low	180 Å²	180	126 Å²	126	94%	0.942	73%	0.731	S	S	*	*			trans	-69	85.2	177.3	-71.7	165.6	0	0	0	109.5	R50	R50-L52 PolarHBondContact O-N 3.29Å
53	S	51.3	Low	56.8	Low	107 Å²	107	128.4 Å²	128.4	75%	0.748	75%	0.749	S	S	*	*			trans	-112.7	79.3	158.6	67.6	0	0	0	0	108.4	P51	P51-S53 VanDerWaalsContact C-N 3.28Å; P51-S53 PolarHBondContact O-N 3.06Å
54	A	39.7	Very low	55.1	Low	82 Å²	82	123.1 Å²	123.1	68%	0.678	74%	0.739	S	S	*	*			trans	-153.8	116.8	162.2	0	0	0	0	0	107.7
55	V	44.1	Very low	53.5	Low	139 Å²	139	125.6 Å²	125.6	84%	0.842	75%	0.747	S	S	*	*			trans	-64.3	141.2	-172.5	-176.5	0	0	0	0	110.9
56	E	38.8	Very low	52.2	Low	188 Å²	188	126 Å²	126	88%	0.879	74%	0.744	S	S	*	*				165.1	145.4	125.2	-85.7	179.2	-175.8	0	0	110.9
57	G	46	Very low	51.4	Low	82 Å²	82	121.4 Å²	121.4	85%	0.845	73%	0.733	S	S	*	*			trans	-73.6	154	-151.5	0	0	0	0	0	117.3
58	A	35.8	Very low	50.7	Low	104 Å²	104	120.3 Å²	120.3	86%	0.86	73%	0.727	S	S	*	*			trans	-150.8	135.4	148.1	0	0	0	0	0	109.8
59	T	40.2	Very low	50.2	Low	138 Å²	138	119.5 Å²	119.5	85%	0.847	72%	0.716	S	S	*	*			trans	-69.2	156.6	-166.9	49.6	0	0	0	0	116.6
60	S	37.9	Very low	49.8	Very low	118 Å²	118	118.5 Å²	118.5	83%	0.825	72%	0.72	S	S	*	*			trans	113.4	98.6	131.5	-156	0	0	0	0	115.9
61	A	37.2	Very low	49.4	Very low	91 Å²	91	114.3 Å²	114.3	75%	0.752	72%	0.722	S	S	*	*	S	Bend		179.8	126	124.4	0	0	0	0	0	111.9
62	K	38.5	Very low	49.7	Very low	205 Å²	205	112.8 Å²	112.8	89%	0.891	72%	0.724	S	S	*	*			trans	60.3	100.8	159.9	-65.8	177.8	-179.5	177.8	0	117.8	S64	K62-S64 PolarHBondContact O-N 3.16Å
63	V	40	Very low	49.4	Very low	147 Å²	147	112 Å²	112	89%	0.891	71%	0.713	S	S	*	*			trans	-67.9	105.3	169.5	178.8	0	0	0	0	109.8
64	S	51	Low	49.5	Very low	62 Å²	62	113.8 Å²	113.8	43%	0.434	71%	0.708	S	S	.	*			trans	-81.9	140.6	150.8	50.1	0	0	0	0	107.7	K62 T66	K62-S64 PolarHBondContact O-N 3.16Å; S64-T66 PolarHBondContact O-N 2.91Å; S64-T66 VanDerWaalsContact O-N 3.14Å; S64-T66 PolarHBondContact O-OG1 2.9Å
65	K	57.4	Low	50.3	Low	179 Å²	179	115.1 Å²	115.1	78%	0.778	70%	0.703	S	S	*	*			trans	-70.6	111.4	177.6	-81.6	176.4	179.8	170.8	0	108.4
66	T	59.5	Low	50.8	Low	64 Å²	64	115.7 Å²	115.7	39%	0.393	70%	0.696	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.8	129.9	179	-45.7	0	0	0	0	109.7	S64 F74	S64-T66 PolarHBondContact O-N 2.91Å; S64-T66 VanDerWaalsContact O-N 3.14Å; S64-T66 PolarHBondContact O-OG1 2.9Å; T66-F74 HydrophobicContact CG2-CB 3.39Å; T66-F74 HydrophobicContact CG2-CD1 3.35Å; T66-F74 HydrophobicContact CG2-CE1 4.39Å; T66-F74 HydrophobicContact CG2-CG 3.65Å
67	I	63.4	Low	51.2	Low	94 Å²	94	113.2 Å²	113.2	48%	0.482	69%	0.685	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.1	123.8	174	-59.1	170.5	0	0	0	108.3	E77	I67-E77 VanDerWaalsContact CD1-CD 3.47Å; I67-E77 HydrophobicContact CD1-CG 4.14Å; I67-E77 WeakPolarHBondContact CD1-OE1 3.5Å
68	D	59.4	Low	51	Low	96 Å²	96	118.6 Å²	118.6	51%	0.513	69%	0.688	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.1	118.2	177.7	-172.8	-7.9	0	0	0	109.9	G70 F74	D68-G70 PolarHBondContact O-N 3.37Å; D68-G70 PolarHBondContact OD1-N 3.14Å; D68-F74 HydrophobicContact CB-CD1 4.35Å; D68-F74 HydrophobicContact CB-CE1 3.94Å
69	S	66.2	Low	51.2	Low	73 Å²	73	123.3 Å²	123.3	51%	0.51	69%	0.692	S	S	.	*			trans	-81.7	7.8	177.9	75.5	0	0	0	0	113.4	A71	S69-A71 PolarHBondContact O-N 3.18Å
70	G	62	Low	51	Low	70 Å²	70	120.4 Å²	120.4	72%	0.722	69%	0.689	S	S	*	*	S	Bend	trans	71.6	9.8	175.3	0	0	0	0	0	115.1	D68	D68-G70 PolarHBondContact O-N 3.37Å; D68-G70 PolarHBondContact OD1-N 3.14Å
71	A	59.5	Low	50.9	Low	79 Å²	79	118.1 Å²	118.1	65%	0.653	69%	0.685	S	S	*	*	S	Bend	trans	-124.5	17.4	-178.6	0	0	0	0	0	113.5	S69	S69-A71 PolarHBondContact O-N 3.18Å
72	G	60.9	Low	51.1	Low	70 Å²	70	123.4 Å²	123.4	72%	0.722	69%	0.694	S	S	*	*	S	Bend	trans	83.8	16	173.6	0	0	0	0	0	115.9
73	F	48.5	Very low	51.5	Low	163 Å²	163	122.2 Å²	122.2	72%	0.715	69%	0.691	S	S	*	*			trans	-124.3	137.3	170.5	-79.9	-88.7	0	0	0	110.7
74	F	53.4	Low	51.7	Low	146 Å²	146	121.9 Å²	121.9	64%	0.64	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.2	123.7	177.8	-78.7	-57.4	0	0	0	109.2	T66 D68	T66-F74 HydrophobicContact CG2-CB 3.39Å; T66-F74 HydrophobicContact CG2-CD1 3.35Å; T66-F74 HydrophobicContact CG2-CE1 4.39Å; T66-F74 HydrophobicContact CG2-CG 3.65Å; D68-F74 HydrophobicContact CB-CD1 4.35Å; D68-F74 HydrophobicContact CB-CE1 3.94Å
75	I	56.8	Low	51.4	Low	110 Å²	110	130.9 Å²	130.9	56%	0.564	71%	0.705	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	128.1	179	-56.6	168.2	0	0	0	108.1
76	E	54.6	Low	51.1	Low	150 Å²	150	129.5 Å²	129.5	70%	0.701	70%	0.698	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.7	126.4	173.3	-70	-175.5	149	0	0	110	E78	E76-E78 PolarHBondContact O-N 2.94Å
77	E	46.9	Very low	50.5	Low	137 Å²	137	132.6 Å²	132.6	64%	0.64	72%	0.717	S	S	*	*			trans	-76.7	106.3	170.7	-79.9	-174.1	147.8	0	0	109.6	I67 E79	I67-E77 VanDerWaalsContact CD1-CD 3.47Å; I67-E77 HydrophobicContact CD1-CG 4.14Å; I67-E77 WeakPolarHBondContact CD1-OE1 3.5Å; E77-E79 PolarHBondContact O-N 3.17Å
78	E	41.9	Very low	50	Low	194 Å²	194	137.3 Å²	137.3	91%	0.907	74%	0.735	S	S	*	*			trans	-83.5	103.3	168.3	-151.3	173.1	-157.1	0	0	108.3	E76 G80	E76-E78 PolarHBondContact O-N 2.94Å; E78-G80 PolarHBondContact O-N 3.48Å
79	E	39.9	Very low	49.7	Very low	204 Å²	204	141.9 Å²	141.9	95%	0.953	75%	0.75	S	S	*	*			trans	-78	97.9	178.9	-153.8	177.9	-150.1	0	0	109.1	E77	E77-E79 PolarHBondContact O-N 3.17Å
80	G	36	Very low	49.2	Very low	76 Å²	76	143.7 Å²	143.7	78%	0.784	76%	0.757	S	S	*	*			trans	148.4	99.8	166.2	0	0	0	0	0	115.1	E78	E78-G80 PolarHBondContact O-N 3.48Å
81	G	36.9	Very low	49.2	Very low	71 Å²	71	146.1 Å²	146.1	73%	0.732	76%	0.758	S	S	*	*			trans	134.1	79.5	162.2	0	0	0	0	0	113.7	E83	G81-E83 PolarHBondContact O-N 3.01Å
82	E	41.5	Very low	49.4	Very low	202 Å²	202	149.9 Å²	149.9	94%	0.944	76%	0.762	S	S	*	*			trans	-69.2	59	163.9	-63.9	-177.3	151.4	0	0	111.3
83	E	45	Very low	49.6	Very low	180 Å²	180	154.5 Å²	154.5	84%	0.841	77%	0.765	S	S	*	*			trans	-143.1	131.9	164.7	-73.5	-158.5	162.9	0	0	111.2	G81	G81-E83 PolarHBondContact O-N 3.01Å
84	E	44.6	Very low	50.6	Low	140 Å²	140	152.4 Å²	152.4	65%	0.654	77%	0.767	S	S	*	*			trans	83.1	48.1	170.6	-49.7	-150.6	130.7	0	0	119.5	K86	E84-K86 PolarHBondContact O-N 3.29Å; E84-K86 IonicContact OE1-NZ 2.77Å; E84-K86 PolarHBondContact OE1-NZ 3Å
85	R	46	Very low	51.3	Low	251 Å²	251	149.3 Å²	149.3	95%	0.947	77%	0.769	S	S	*	*			trans	-74.7	53.8	136.7	-72	-173.5	179.5	180	1.9	110.5	T87	R85-T87 PolarHBondContact O-N 3.1Å; R85-T87 VanDerWaalsContact O-N 3.09Å
86	K	49.4	Very low	52.1	Low	149 Å²	149	149.6 Å²	149.6	65%	0.648	78%	0.778	S	S	*	*			trans	-67.5	108.7	157.4	-84.1	174.4	-174.3	150.6	0	104.8	E84 K88	E84-K86 PolarHBondContact O-N 3.29Å; E84-K86 IonicContact OE1-NZ 2.77Å; E84-K86 PolarHBondContact OE1-NZ 3Å; K86-K88 PolarHBondContact O-N 3.43Å
87	T	48.3	Very low	52.5	Low	129 Å²	129	148.9 Å²	148.9	79%	0.791	78%	0.783	S	S	*	*			trans	-46	100.1	160.2	41.9	0	0	0	0	106.5	R85 K89	R85-T87 PolarHBondContact O-N 3.1Å; R85-T87 VanDerWaalsContact O-N 3.09Å; T87-K89 PolarHBondContact O-N 3.02Å
88	K	52.3	Low	53.6	Low	194 Å²	194	149.4 Å²	149.4	84%	0.843	79%	0.789	S	S	*	*			trans	-57.5	102.1	168.7	-71.5	180	-178.2	175.3	0	103	K86 V90	K86-K88 PolarHBondContact O-N 3.43Å; K88-V90 PolarHBondContact O-N 3.27Å
89	K	53.6	Low	54.6	Low	191 Å²	191	147.7 Å²	147.7	83%	0.83	78%	0.781	S	S	*	*			trans	-54.5	103.6	166.1	-86.6	-177.3	177.2	179.7	0	103.4	T87 V91	T87-K89 PolarHBondContact O-N 3.02Å; K89-V91 PolarHBondContact O-N 3.47Å
90	V	54.3	Low	55.8	Low	111 Å²	111	140.5 Å²	140.5	67%	0.673	75%	0.752	S	S	*	*			trans	-64.1	92.2	170.4	177.8	0	0	0	0	103.6	K88 H92	K88-V90 PolarHBondContact O-N 3.27Å; V90-H92 PolarHBondContact O-N 2.78Å
91	V	62.4	Low	57.8	Low	122 Å²	122	143.7 Å²	143.7	74%	0.739	75%	0.751	S	S	*	*			trans	-68.9	91.6	164.4	-179.3	0	0	0	0	103.2	K89 Q93	K89-V91 PolarHBondContact O-N 3.47Å; V91-Q93 PolarHBondContact O-N 3.43Å
92	H	64.9	Low	59.8	Low	158 Å²	158	147 Å²	147	73%	0.731	74%	0.743	S	S	*	*			trans	-57.2	102	161.3	-92.1	-68.9	0	0	0	105.3	V90	V90-H92 PolarHBondContact O-N 2.78Å
93	Q	65.1	Low	61.9	Low	167 Å²	167	141.1 Å²	141.1	78%	0.78	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-55.1	126.2	160.6	-69	-164.5	-7.2	0	0	105.4	V91 A95	V91-Q93 PolarHBondContact O-N 3.43Å; Q93-A95 PolarHBondContact O-N 3.09Å
94	P	69.3	Low	64.2	Low	118 Å²	118	137.9 Å²	137.9	77%	0.766	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-54.3	132.3	174.5	24.4	-32.2	0	0	0	106.8
95	A	67.6	Low	66.5	Low	81 Å²	81	131.3 Å²	131.3	67%	0.669	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-48.5	135.1	178.7	0	0	0	0	0	108.6	Q93 V97	Q93-A95 PolarHBondContact O-N 3.09Å; A95-V97 PolarHBondContact O-N 2.93Å
96	P	73.8	Confident	68.7	Low	117 Å²	117	124.4 Å²	124.4	76%	0.76	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-47.5	120.4	173.4	-27.8	34.5	0	0	0	108.9	I98	P96-I98 VanDerWaalsContact C-N 3.26Å; P96-I98 PolarHBondContact O-N 3.47Å
97	V	62.9	Low	70.6	Confident	134 Å²	134	120.8 Å²	120.8	81%	0.812	64%	0.644	S	S	*	*			trans	-69.5	93.7	176.2	-178	0	0	0	0	105.6	A95 E99	A95-V97 PolarHBondContact O-N 2.93Å; V97-E99 PolarHBondContact O-N 3.12Å; V97-E99 VanDerWaalsContact O-N 3.09Å
98	I	69.1	Low	72.7	Confident	148 Å²	148	116.7 Å²	116.7	76%	0.759	62%	0.62	S	S	*	*			trans	-66.7	107.4	167.2	-57.9	168.4	0	0	0	103.8	P96 P100	P96-I98 VanDerWaalsContact C-N 3.26Å; P96-I98 PolarHBondContact O-N 3.47Å; I98-P100 VanDerWaalsContact O-CD 3.28Å; I98-P100 WeakPolarHBondContact O-CD 3.49Å; I98-P100 VanDerWaalsContact O-N 3.11Å
99	E	64	Low	74.6	Confident	158 Å²	158	115 Å²	115	74%	0.738	62%	0.615	S	S	*	*			trans	-53.9	119.5	169.7	-72	-177.6	179.2	0	0	106.6	V97 D101	V97-E99 PolarHBondContact O-N 3.12Å; V97-E99 VanDerWaalsContact O-N 3.09Å; E99-D101 PolarHBondContact O-N 3.36Å; E99-D101 VanDerWaalsContact O-N 3.09Å
100	P	65.4	Low	76.5	Confident	53 Å²	53	112.4 Å²	112.4	34%	0.344	60%	0.604	S	S	.	*			trans	-64.4	118.9	177.4	-10.7	23.3	0	0	0	107	I98 Y102 M113	I98-P100 VanDerWaalsContact O-CD 3.28Å; I98-P100 WeakPolarHBondContact O-CD 3.49Å; I98-P100 VanDerWaalsContact O-N 3.11Å; P100-Y102 HydrophobicContact CB-CD2 4.11Å; P100-Y102 HydrophobicContact CB-CE1 4.39Å; P100-Y102 HydrophobicContact CB-CE2 3.56Å; P100-Y102 HydrophobicContact CG-CE2 3.68Å; P100-Y102 WeakPolarHBondContact O-CD2 3.39Å; P100-Y102 PolarHBondContact O-N 3.33Å; P100-M113 HydrophobicContact CB-CE 3.45Å; P100-M113 VanDerWaalsContact CB-CE 3.45Å; P100-M113 HydrophobicContact CB-SD 3.81Å
101	D	77	Confident	78.3	Confident	144 Å²	144	111.2 Å²	111.2	77%	0.77	60%	0.598	S	S	*	*			trans	-66.1	87.3	176.4	-75.2	-26.2	0	0	0	108.8	E99 L103	E99-D101 PolarHBondContact O-N 3.36Å; E99-D101 VanDerWaalsContact O-N 3.09Å; D101-L103 PolarHBondContact O-N 3.11Å
102	Y	80.3	Confident	79.7	Confident	141 Å²	141	106.4 Å²	106.4	55%	0.553	57%	0.568	S	S	*	*			trans	-75.6	115.9	177.4	-69.1	-76.9	0	0	0	109.5	P100 P111 M113	P100-Y102 HydrophobicContact CB-CD2 4.11Å; P100-Y102 HydrophobicContact CB-CE1 4.39Å; P100-Y102 HydrophobicContact CB-CE2 3.56Å; P100-Y102 HydrophobicContact CG-CE2 3.68Å; P100-Y102 WeakPolarHBondContact O-CD2 3.39Å; P100-Y102 PolarHBondContact O-N 3.33Å; Y102-P111 HydrophobicContact CD1-CB 4.47Å; Y102-M113 HydrophobicContact CD1-CG 3.48Å; Y102-M113 VanDerWaalsContact CD1-CG 3.48Å; Y102-M113 HydrophobicContact CD1-SD 4.39Å; Y102-M113 HydrophobicContact CE1-CG 3.36Å; Y102-M113 HydrophobicContact CE1-SD 3.71Å; Y102-M113 HydrophobicContact CG-CG 4.45Å
103	L	85.3	Confident	80.7	Confident	78 Å²	78	103 Å²	103	41%	0.408	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	145	171.5	-61.5	177.3	0	0	0	110.1	D101 P111 F112	D101-L103 PolarHBondContact O-N 3.11Å; L103-P111 CarbonylContact O-C 3.51Å; L103-P111 VanDerWaalsContact O-CA 3.29Å; L103-P111 WeakPolarHBondContact O-CA 3.37Å; L103-F112 HydrophobicContact CB-CD1 4.39Å; L103-F112 HydrophobicContact CB-CE1 3.86Å; L103-F112 HydrophobicContact CB-CE2 4.2Å; L103-F112 HydrophobicContact CB-CZ 3.76Å; L103-F112 HydrophobicContact CD1-CE2 4.3Å; L103-F112 HydrophobicContact CD1-CZ 4.22Å; L103-F112 PolarHBondContact N-O 3.39Å; L103-F112 VanDerWaalsContact O-CD1 3.28Å; L103-F112 WeakPolarHBondContact O-CD1 3.35Å; L103-F112 PolarHBondContact O-N 3.25Å; L103-F112 VanDerWaalsContact O-O 3.07Å
104	L	91.9	Very high	81.8	Confident	112 Å²	112	100.4 Å²	100.4	59%	0.586	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.8	173.2	-63.1	177.6	0	0	0	109.8	P111	L104-P111 HydrophobicContact CD2-CB 4.15Å
105	C	94.1	Very high	82.8	Confident	2 Å²	2	95 Å²	95	1%	0.014	51%	0.509	C	S	.	.	P	Polyproline II helix	trans	-71.9	127.7	177.7	-179.5	0	0	0	0	111.5	D107 Q109 K110 F112 S124 C126	C105-D107 VanDerWaalsContact C-N 3.25Å; C105-D107 PolarHBondContact O-N 2.94Å; C105-Q109 WeakPolarHBondContact O-CA 3.29Å; C105-Q109 PolarHBondContact O-N 3.39Å; C105-K110 PolarHBondContact N-O 3.44Å; C105-F112 HydrophobicContact CB-CD1 3.86Å; C105-F112 HydrophobicContact CB-CE1 3.93Å; C105-S124 CarbonylContact C-O 3.6Å; C105-S124 VanDerWaalsContact CA-O 3.29Å; C105-S124 WeakPolarHBondContact CA-O 3.49Å; C105-C126 HydrophobicContact CB-CB 4.1Å; C105-C126 PolarHBondContact SG-N 3.29Å
106	D	90.9	Very high	84	Confident	105 Å²	105	94.6 Å²	94.6	56%	0.561	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-32.2	-179.6	-65.3	-7.8	0	0	0	112.8	S124 V125	D106-S124 PolarHBondContact N-O 3.26Å; D106-S124 PolarHBondContact OD1-OG 3.42Å; D106-S124 PolarHBondContact OD2-OG 3.04Å; D106-S124 VanDerWaalsContact OD2-OG 3.04Å; D106-V125 HydrophobicContact CB-CG2 4.25Å
107	D	90.9	Very high	85	Confident	73 Å²	73	89 Å²	89	39%	0.39	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-40.9	-177.1	-75.6	-42.9	0	0	0	113.4	C105 C129 K135	C105-D107 VanDerWaalsContact C-N 3.25Å; C105-D107 PolarHBondContact O-N 2.94Å; D107-C129 HydrophobicContact CB-CB 3.82Å; D107-K135 IonicContact OD1-NZ 3.44Å; D107-K135 PolarHBondContact OD1-NZ 3.03Å
108	C	92.8	Very high	86.4	Confident	43 Å²	43	83.2 Å²	83.2	29%	0.291	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-0.9	-174.3	68.5	0	0	0	0	115.3	K110	C108-K110 PolarHBondContact O-N 3.12Å
109	Q	92.1	Very high	87.5	Confident	158 Å²	158	80.8 Å²	80.8	74%	0.738	41%	0.41	S	S	*	.			trans	56.3	14.3	178.8	-60	178.6	-13.3	0	0	115.1	C105	C105-Q109 WeakPolarHBondContact O-CA 3.29Å; C105-Q109 PolarHBondContact O-N 3.39Å
110	K	91.9	Very high	88.8	Confident	138 Å²	138	74.3 Å²	74.3	60%	0.6	38%	0.382	S	S	*	.			trans	-81.4	139.6	175.9	-68.2	175.9	-175.3	176.4	0	109.7	C105 C108 F112	C105-K110 PolarHBondContact N-O 3.44Å; C108-K110 PolarHBondContact O-N 3.12Å; K110-F112 PolarHBondContact O-N 3.42Å
111	P	91.9	Very high	90.2	Very high	85 Å²	85	71.9 Å²	71.9	55%	0.552	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	134.5	171.2	27.8	-33	0	0	0	109.6	Y102 L103 L104	Y102-P111 HydrophobicContact CD1-CB 4.47Å; L103-P111 CarbonylContact O-C 3.51Å; L103-P111 VanDerWaalsContact O-CA 3.29Å; L103-P111 WeakPolarHBondContact O-CA 3.37Å; L104-P111 HydrophobicContact CD2-CB 4.15Å
112	F	91.7	Very high	90.8	Very high	22 Å²	22	69.8 Å²	69.8	10%	0.096	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.4	170.7	72.5	-81.8	0	0	0	108.2	L103 C105 K110 S115 C126	L103-F112 HydrophobicContact CB-CD1 4.39Å; L103-F112 HydrophobicContact CB-CE1 3.86Å; L103-F112 HydrophobicContact CB-CE2 4.2Å; L103-F112 HydrophobicContact CB-CZ 3.76Å; L103-F112 HydrophobicContact CD1-CE2 4.3Å; L103-F112 HydrophobicContact CD1-CZ 4.22Å; L103-F112 PolarHBondContact N-O 3.39Å; L103-F112 VanDerWaalsContact O-CD1 3.28Å; L103-F112 WeakPolarHBondContact O-CD1 3.35Å; L103-F112 PolarHBondContact O-N 3.25Å; L103-F112 VanDerWaalsContact O-O 3.07Å; C105-F112 HydrophobicContact CB-CD1 3.86Å; C105-F112 HydrophobicContact CB-CE1 3.93Å; K110-F112 PolarHBondContact O-N 3.42Å; F112-S115 WeakPolarHBondContact CE2-OG 3.36Å; F112-C126 HydrophobicContact CB-CB 4.12Å; F112-C126 HydrophobicContact CD1-CB 3.97Å; F112-C126 HydrophobicContact CD2-CB 4.5Å; F112-C126 HydrophobicContact CG-CB 3.93Å
113	M	86.8	Confident	91.4	Very high	85 Å²	85	64.1 Å²	64.1	42%	0.419	34%	0.335	S	S	.	.	S	Bend	trans	-92.6	-73.8	176.4	-68.1	-171.4	61.7	0	0	109.1	P100 Y102	P100-M113 HydrophobicContact CB-CE 3.45Å; P100-M113 VanDerWaalsContact CB-CE 3.45Å; P100-M113 HydrophobicContact CB-SD 3.81Å; Y102-M113 HydrophobicContact CD1-CG 3.48Å; Y102-M113 VanDerWaalsContact CD1-CG 3.48Å; Y102-M113 HydrophobicContact CD1-SD 4.39Å; Y102-M113 HydrophobicContact CE1-CG 3.36Å; Y102-M113 HydrophobicContact CE1-SD 3.71Å; Y102-M113 HydrophobicContact CG-CG 4.45Å
114	D	87.4	Confident	91.7	Very high	114 Å²	114	62.2 Å²	62.2	61%	0.61	33%	0.328	S	S	*	.			trans	-109.8	143.3	-179.6	-61.9	-21.3	0	0	0	110.1
115	S	92	Very high	91.8	Very high	4 Å²	4	57 Å²	57	3%	0.028	30%	0.301	C	S	.	.			trans	-138.2	162.8	166.2	73.7	0	0	0	0	109.7	F112 L117 S118 N119 V125	F112-S115 WeakPolarHBondContact CE2-OG 3.36Å; S115-L117 VanDerWaalsContact C-N 3.27Å; S115-L117 PolarHBondContact O-N 3.48Å; S115-S118 WeakPolarHBondContact CA-OG 3.49Å; S115-S118 PolarHBondContact N-OG 3.19Å; S115-S118 PolarHBondContact O-N 3.45Å; S115-S118 PolarHBondContact O-OG 3.04Å; S115-S118 WeakPolarHBondContact OG-CB 3.48Å; S115-S118 PolarHBondContact OG-N 3.45Å; S115-S118 VanDerWaalsContact OG-N 3.08Å; S115-S118 PolarHBondContact OG-OG 2.79Å; S115-N119 WeakPolarHBondContact O-CB 3.5Å; S115-N119 PolarHBondContact O-N 3.06Å; S115-N119 VanDerWaalsContact O-N 3.08Å; S115-V125 WeakPolarHBondContact CB-O 3.45Å; S115-V125 PolarHBondContact OG-O 2.9Å
116	F	92.7	Very high	91.8	Very high	73 Å²	73	57.6 Å²	57.6	32%	0.32	30%	0.304	S	S	.	.	H	α-helix	trans	-57.3	-44.5	175.4	175.5	-93.1	0	0	0	111.5	S120 F121 D127 R130 I165	F116-S120 WeakPolarHBondContact O-CB 3.44Å; F116-S120 PolarHBondContact O-N 3.44Å; F116-S120 PolarHBondContact O-OG 3.32Å; F116-F121 HydrophobicContact CE1-CE2 4.16Å; F116-D127 WeakPolarHBondContact CB-OD1 3.44Å; F116-D127 PolarHBondContact N-OD1 3.37Å; F116-R130 VanDerWaalsContact CE1-CZ 3.41Å; F116-I165 HydrophobicContact CE1-CD1 3.75Å; F116-I165 HydrophobicContact CE2-CD1 3.89Å; F116-I165 HydrophobicContact CZ-CD1 3.17Å
117	L	93.4	Very high	91.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.9	-36.9	-175.3	-67.5	174.4	0	0	0	112.8	S115 F121 D122 L123 V125 R130 H136 L182	S115-L117 VanDerWaalsContact C-N 3.27Å; S115-L117 PolarHBondContact O-N 3.48Å; L117-F121 HydrophobicContact CD2-CD2 4.03Å; L117-F121 CarbonylContact O-C 3.41Å; L117-F121 WeakPolarHBondContact O-CA 3.49Å; L117-F121 WeakPolarHBondContact O-CB 3.41Å; L117-F121 PolarHBondContact O-N 3.46Å; L117-D122 PolarHBondContact O-N 3.28Å; L117-L123 CarbonylContact C-O 3.55Å; L117-L123 HydrophobicContact CB-CB 4.35Å; L117-L123 HydrophobicContact CD1-CD2 4.42Å; L117-L123 PolarHBondContact O-N 3.23Å; L117-V125 HydrophobicContact CD1-CB 3.97Å; L117-V125 HydrophobicContact CD1-CG1 3.97Å; L117-R130 HydrophobicContact CD1-CB 4.26Å; L117-R130 HydrophobicContact CD1-CG 4.01Å; L117-R130 HydrophobicContact CG-CG 4.36Å; L117-H136 HydrophobicContact CD1-CB 4.02Å; L117-H136 VanDerWaalsContact CD1-CD2 3.43Å; L117-H136 WeakPolarHBondContact CD1-CD2 3.35Å; L117-H136 HydrophobicContact CD2-CB 4.11Å; L117-L182 HydrophobicContact CD2-CD1 4.24Å
118	S	92.5	Very high	91.8	Very high	11 Å²	11	62.8 Å²	62.8	8%	0.077	32%	0.323	C	S	.	.	H	α-helix	trans	-66	-47.9	175.2	52.8	0	0	0	0	110.8	S115 S120 D122 L123	S115-S118 WeakPolarHBondContact CA-OG 3.49Å; S115-S118 PolarHBondContact N-OG 3.19Å; S115-S118 PolarHBondContact O-N 3.45Å; S115-S118 PolarHBondContact O-OG 3.04Å; S115-S118 WeakPolarHBondContact OG-CB 3.48Å; S115-S118 PolarHBondContact OG-N 3.45Å; S115-S118 VanDerWaalsContact OG-N 3.08Å; S115-S118 PolarHBondContact OG-OG 2.79Å; S118-S120 PolarHBondContact O-N 3.35Å; S118-D122 VanDerWaalsContact O-CA 3.28Å; S118-D122 WeakPolarHBondContact O-CA 3.34Å; S118-D122 PolarHBondContact O-N 3.42Å; S118-L123 VanDerWaalsContact CA-O 3.23Å; S118-L123 WeakPolarHBondContact CA-O 3.39Å; S118-L123 PolarHBondContact N-O 2.91Å; S118-L123 VanDerWaalsContact N-O 3.07Å
119	N	91.8	Very high	91.8	Very high	97 Å²	97	62.5 Å²	62.5	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-66.9	-37.8	-178.5	-73.6	-8.5	0	0	0	113.4	S115	S115-N119 WeakPolarHBondContact O-CB 3.5Å; S115-N119 PolarHBondContact O-N 3.06Å; S115-N119 VanDerWaalsContact O-N 3.08Å
120	S	92.9	Very high	91.8	Very high	22 Å²	22	58.1 Å²	58.1	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-93.4	-32.4	-174.4	59.5	0	0	0	0	114.4	F116 S118 R163	F116-S120 WeakPolarHBondContact O-CB 3.44Å; F116-S120 PolarHBondContact O-N 3.44Å; F116-S120 PolarHBondContact O-OG 3.32Å; S118-S120 PolarHBondContact O-N 3.35Å; S120-R163 WeakPolarHBondContact O-CB 3.22Å; S120-R163 WeakPolarHBondContact O-CD 3.28Å
121	F	93.4	Very high	91.8	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-128.7	4.7	-172	-60	-73	0	0	0	114.5	F116 L117 L123 L138 R163 I165 L182 Q185	F116-F121 HydrophobicContact CE1-CE2 4.16Å; L117-F121 HydrophobicContact CD2-CD2 4.03Å; L117-F121 CarbonylContact O-C 3.41Å; L117-F121 WeakPolarHBondContact O-CA 3.49Å; L117-F121 WeakPolarHBondContact O-CB 3.41Å; L117-F121 PolarHBondContact O-N 3.46Å; F121-L123 PolarHBondContact O-N 2.93Å; F121-L138 HydrophobicContact CE1-CD2 4.41Å; F121-L138 HydrophobicContact CE2-CD2 3.55Å; F121-L138 HydrophobicContact CZ-CD2 3.44Å; F121-L138 VanDerWaalsContact CZ-CD2 3.44Å; F121-R163 HydrophobicContact CD1-CB 4.32Å; F121-I165 HydrophobicContact CE1-CG1 4.37Å; F121-I165 HydrophobicContact CE2-CD1 3.49Å; F121-I165 VanDerWaalsContact CE2-CD1 3.49Å; F121-I165 HydrophobicContact CE2-CG1 4.03Å; F121-I165 HydrophobicContact CZ-CD1 3.55Å; F121-I165 HydrophobicContact CZ-CG1 3.64Å; F121-L182 HydrophobicContact CB-CD2 4.48Å; F121-L182 HydrophobicContact CD1-CB 3.96Å; F121-L182 HydrophobicContact CD2-CB 4.47Å; F121-L182 HydrophobicContact CE1-CB 4.17Å; F121-L182 HydrophobicContact CG-CB 4.13Å; F121-Q185 PolarHBondContact O-NE2 3.06Å
122	D	90.8	Very high	91.6	Very high	100 Å²	100	53.9 Å²	53.9	54%	0.535	28%	0.277	S	S	.	.			trans	56.4	35.2	-174.5	-58.1	-23.8	0	0	0	113.1	L117 S118 R163	L117-D122 PolarHBondContact O-N 3.28Å; S118-D122 VanDerWaalsContact O-CA 3.28Å; S118-D122 WeakPolarHBondContact O-CA 3.34Å; S118-D122 PolarHBondContact O-N 3.42Å; D122-R163 VanDerWaalsContact CG-NH2 3.27Å; D122-R163 IonicContact OD1-CZ 3.32Å; D122-R163 IonicContact OD1-NE 2.75Å; D122-R163 PolarHBondContact OD1-NE 2.78Å; D122-R163 IonicContact OD1-NH1 3.66Å; D122-R163 PolarHBondContact OD1-NH1 3.31Å; D122-R163 VanDerWaalsContact OD1-NH1 3.15Å; D122-R163 IonicContact OD1-NH2 3.14Å; D122-R163 PolarHBondContact OD1-NH2 3.2Å; D122-R163 IonicContact OD2-CZ 3.95Å; D122-R163 IonicContact OD2-NE 3.62Å; D122-R163 PolarHBondContact OD2-NE 3.43Å; D122-R163 IonicContact OD2-NH1 2.8Å; D122-R163 IonicContact OD2-NH2 2.74Å; D122-R163 PolarHBondContact OD2-NH2 2.88Å
123	L	92	Very high	91.4	Very high	23 Å²	23	60.6 Å²	60.6	12%	0.12	31%	0.308	C	S	.	.			trans	-108.7	122.5	179.8	-163.3	152.1	0	0	0	110.7	L117 S118 F121 V125 L182	L117-L123 CarbonylContact C-O 3.55Å; L117-L123 HydrophobicContact CB-CB 4.35Å; L117-L123 HydrophobicContact CD1-CD2 4.42Å; L117-L123 PolarHBondContact O-N 3.23Å; S118-L123 VanDerWaalsContact CA-O 3.23Å; S118-L123 WeakPolarHBondContact CA-O 3.39Å; S118-L123 PolarHBondContact N-O 2.91Å; S118-L123 VanDerWaalsContact N-O 3.07Å; F121-L123 PolarHBondContact O-N 2.93Å; L123-V125 HydrophobicContact CD2-CB 3.58Å; L123-V125 HydrophobicContact CD2-CG2 3.23Å; L123-V125 PolarHBondContact O-N 3.24Å; L123-L182 HydrophobicContact CD1-CD2 3.49Å; L123-L182 VanDerWaalsContact CD1-CD2 3.49Å
124	S	92.3	Very high	91.4	Very high	37 Å²	37	63.8 Å²	63.8	26%	0.259	32%	0.322	S	S	.	.			trans	-76.1	58	-173.6	39.9	0	0	0	0	113.5	C105 D106	C105-S124 CarbonylContact C-O 3.6Å; C105-S124 VanDerWaalsContact CA-O 3.29Å; C105-S124 WeakPolarHBondContact CA-O 3.49Å; D106-S124 PolarHBondContact N-O 3.26Å; D106-S124 PolarHBondContact OD1-OG 3.42Å; D106-S124 PolarHBondContact OD2-OG 3.04Å; D106-S124 VanDerWaalsContact OD2-OG 3.04Å
125	V	93.1	Very high	91.4	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.024	32%	0.316	C	S	.	.			trans	-124	130.4	177.1	169.8	0	0	0	0	110.2	D106 S115 L117 L123 C129	D106-V125 HydrophobicContact CB-CG2 4.25Å; S115-V125 WeakPolarHBondContact CB-O 3.45Å; S115-V125 PolarHBondContact OG-O 2.9Å; L117-V125 HydrophobicContact CD1-CB 3.97Å; L117-V125 HydrophobicContact CD1-CG1 3.97Å; L123-V125 HydrophobicContact CD2-CB 3.58Å; L123-V125 HydrophobicContact CD2-CG2 3.23Å; L123-V125 PolarHBondContact O-N 3.24Å; V125-C129 HydrophobicContact CG1-CB 3.81Å
126	C	93.7	Very high	91.3	Very high	13 Å²	13	63.7 Å²	63.7	9%	0.088	32%	0.316	C	S	.	.			trans	-73.3	154.9	178.3	74.8	0	0	0	0	111.6	C105 F112 K128 C129 R130	C105-C126 HydrophobicContact CB-CB 4.1Å; C105-C126 PolarHBondContact SG-N 3.29Å; F112-C126 HydrophobicContact CB-CB 4.12Å; F112-C126 HydrophobicContact CD1-CB 3.97Å; F112-C126 HydrophobicContact CD2-CB 4.5Å; F112-C126 HydrophobicContact CG-CB 3.93Å; C126-K128 PolarHBondContact O-N 3.01Å; C126-C129 PolarHBondContact O-N 2.86Å; C126-C129 VanDerWaalsContact SG-SG 3.68Å; C126-R130 PolarHBondContact O-N 3.06Å
127	D	92.1	Very high	91.4	Very high	90 Å²	90	64.4 Å²	64.4	48%	0.481	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.3	-176	-68.7	-37.7	0	0	0	114.1	F116 R130	F116-D127 WeakPolarHBondContact CB-OD1 3.44Å; F116-D127 PolarHBondContact N-OD1 3.37Å; D127-R130 WeakPolarHBondContact O-CB 3.48Å
128	K	91.4	Very high	91.5	Very high	198 Å²	198	66.7 Å²	66.7	86%	0.861	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-31	175.5	-64.1	179.9	-178.2	177.1	0	112.8	C126	C126-K128 PolarHBondContact O-N 3.01Å
129	C	92.1	Very high	91.7	Very high	36 Å²	36	66.2 Å²	66.2	24%	0.243	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.3	177.7	-68.4	0	0	0	0	112.1	D107 V125 C126 D131	D107-C129 HydrophobicContact CB-CB 3.82Å; V125-C129 HydrophobicContact CG1-CB 3.81Å; C126-C129 PolarHBondContact O-N 2.86Å; C126-C129 VanDerWaalsContact SG-SG 3.68Å; C129-D131 PolarHBondContact O-N 3.34Å
130	R	91.9	Very high	91.9	Very high	66 Å²	66	62.3 Å²	62.3	25%	0.249	31%	0.308	C	S	.	.			trans	-67.8	104.3	178.8	179.6	-177	169.6	-175.6	2	110.9	F116 L117 C126 D127 N132	F116-R130 VanDerWaalsContact CE1-CZ 3.41Å; L117-R130 HydrophobicContact CD1-CB 4.26Å; L117-R130 HydrophobicContact CD1-CG 4.01Å; L117-R130 HydrophobicContact CG-CG 4.36Å; C126-R130 PolarHBondContact O-N 3.06Å; D127-R130 WeakPolarHBondContact O-CB 3.48Å; R130-N132 PolarHBondContact NE-OD1 2.89Å; R130-N132 PolarHBondContact NH2-OD1 3.43Å
131	D	92.1	Very high	92.1	Very high	50 Å²	50	64 Å²	64	27%	0.267	31%	0.311	S	S	.	.			trans	-93.4	118	166.5	175.2	20.8	0	0	0	112.1	C129 E133 E134 K135 H136	C129-D131 PolarHBondContact O-N 3.34Å; D131-E133 PolarHBondContact OD1-N 2.91Å; D131-E134 VanDerWaalsContact OD2-CB 3.31Å; D131-E134 WeakPolarHBondContact OD2-CB 3.45Å; D131-E134 PolarHBondContact OD2-N 3.48Å; D131-K135 PolarHBondContact OD2-N 3.36Å; D131-H136 PolarHBondContact N-ND1 2.99Å; D131-H136 VanDerWaalsContact N-ND1 3.1Å; D131-H136 VanDerWaalsContact O-CA 3.26Å; D131-H136 WeakPolarHBondContact O-CA 3.34Å; D131-H136 WeakPolarHBondContact O-CB 3.09Å; D131-H136 PolarHBondContact O-N 3.14Å; D131-H136 PolarHBondContact O-ND1 3.45Å; D131-H136 VanDerWaalsContact O-ND1 3.11Å
132	N	88	Confident	92.2	Very high	85 Å²	85	68 Å²	68	46%	0.455	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-13.5	-179	-68	-63.1	0	0	0	114	R130 K137	R130-N132 PolarHBondContact NE-OD1 2.89Å; R130-N132 PolarHBondContact NH2-OD1 3.43Å; N132-K137 WeakPolarHBondContact O-CA 3.4Å
133	E	86.9	Confident	92.4	Very high	162 Å²	162	65.3 Å²	65.3	76%	0.757	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-43.9	-170.8	-64.8	-170.1	174.2	0	0	112.1	D131	D131-E133 PolarHBondContact OD1-N 2.91Å
134	E	86.3	Confident	92.6	Very high	152 Å²	152	64.2 Å²	64.2	71%	0.71	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-77.9	-178.5	-52.7	-178.4	163.5	0	0	111	D131	D131-E134 VanDerWaalsContact OD2-CB 3.31Å; D131-E134 WeakPolarHBondContact OD2-CB 3.45Å; D131-E134 PolarHBondContact OD2-N 3.48Å
135	K	87	Confident	92.8	Very high	111 Å²	111	65.6 Å²	65.6	48%	0.483	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-45.1	-166.4	-67.6	-176.4	179.2	-179	0	114.1	D107 D131	D107-K135 IonicContact OD1-NZ 3.44Å; D107-K135 PolarHBondContact OD1-NZ 3.03Å; D131-K135 PolarHBondContact OD2-N 3.36Å
136	H	91.1	Very high	92.8	Very high	6 Å²	6	72.4 Å²	72.4	3%	0.028	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	31.4	-173.9	-40.3	99.9	0	0	0	112.6	L117 D131 L138 L182	L117-H136 HydrophobicContact CD1-CB 4.02Å; L117-H136 VanDerWaalsContact CD1-CD2 3.43Å; L117-H136 WeakPolarHBondContact CD1-CD2 3.35Å; L117-H136 HydrophobicContact CD2-CB 4.11Å; D131-H136 PolarHBondContact N-ND1 2.99Å; D131-H136 VanDerWaalsContact N-ND1 3.1Å; D131-H136 VanDerWaalsContact O-CA 3.26Å; D131-H136 WeakPolarHBondContact O-CA 3.34Å; D131-H136 WeakPolarHBondContact O-CB 3.09Å; D131-H136 PolarHBondContact O-N 3.14Å; D131-H136 PolarHBondContact O-ND1 3.45Å; D131-H136 VanDerWaalsContact O-ND1 3.11Å; H136-L138 PolarHBondContact O-N 3.44Å; H136-L182 HydrophobicContact CB-CD1 3.97Å
137	K	95.3	Very high	92.9	Very high	88 Å²	88	77.5 Å²	77.5	38%	0.383	36%	0.364	S	S	.	.			trans	-61.1	136.4	175.1	-172.9	172.5	-176.9	171.2	0	110.8	N132 L183	N132-K137 WeakPolarHBondContact O-CA 3.4Å; K137-L183 HydrophobicContact CB-CB 4.35Å; K137-L183 HydrophobicContact CD-CD1 4.33Å; K137-L183 WeakPolarHBondContact O-CB 3.44Å; K137-L183 PolarHBondContact O-N 3.02Å
138	L	95.6	Very high	93	Very high	47 Å²	47	74.7 Å²	74.7	25%	0.246	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.9	175.5	-59.4	-179.8	0	0	0	110.2	F121 H136 L180 Y181 L182	F121-L138 HydrophobicContact CE1-CD2 4.41Å; F121-L138 HydrophobicContact CE2-CD2 3.55Å; F121-L138 HydrophobicContact CZ-CD2 3.44Å; F121-L138 VanDerWaalsContact CZ-CD2 3.44Å; H136-L138 PolarHBondContact O-N 3.44Å; L138-L180 HydrophobicContact CB-CB 4.4Å; L138-L180 HydrophobicContact CD1-CD1 4.41Å; L138-Y181 CarbonylContact C-O 3.52Å; L138-Y181 WeakPolarHBondContact CA-O 3.3Å; L138-L182 HydrophobicContact CD2-CD1 3.89Å
139	I	96.3	Very high	93.2	Very high	1 Å²	1	65.9 Å²	65.9	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.2	177	57.4	173.3	0	0	0	111.4	E143 A144 Y148 L180 Y181 L183 V186	I139-E143 HydrophobicContact CB-CG 4.49Å; I139-A144 HydrophobicContact CD1-CB 3.86Å; I139-A144 HydrophobicContact CG1-CB 4.42Å; I139-Y148 HydrophobicContact CD1-CD2 4.43Å; I139-Y148 HydrophobicContact CD1-CE2 3.89Å; I139-L180 CarbonylContact O-C 3.58Å; I139-L180 WeakPolarHBondContact O-CA 3.43Å; I139-Y181 PolarHBondContact N-O 2.93Å; I139-Y181 PolarHBondContact O-N 2.75Å; I139-L183 HydrophobicContact CD1-CB 4.46Å; I139-L183 HydrophobicContact CG1-CB 4.48Å; I139-L183 HydrophobicContact CG2-CB 4.25Å; I139-L183 HydrophobicContact CG2-CD1 3.82Å; I139-V186 HydrophobicContact CD1-CB 3.95Å; I139-V186 HydrophobicContact CD1-CG1 3.93Å; I139-V186 HydrophobicContact CD1-CG2 3.98Å; I139-V186 HydrophobicContact CG1-CG2 4.4Å
140	S	96.6	Very high	93.4	Very high	15 Å²	15	64.4 Å²	64.4	11%	0.105	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	152.1	178.6	67.7	0	0	0	0	111.8	T142 E143 A144	S140-T142 PolarHBondContact O-N 3.07Å; S140-T142 VanDerWaalsContact O-N 3.17Å; S140-T142 PolarHBondContact OG-OG1 3.18Å; S140-T142 VanDerWaalsContact OG-OG1 3.11Å; S140-E143 PolarHBondContact N-OE2 3.07Å; S140-E143 WeakPolarHBondContact O-CB 3.38Å; S140-E143 PolarHBondContact O-N 3.44Å; S140-E143 WeakPolarHBondContact OG-CB 3.48Å; S140-E143 PolarHBondContact OG-N 2.97Å; S140-A144 PolarHBondContact O-N 2.93Å
141	R	95.6	Very high	93.5	Very high	57 Å²	57	67.9 Å²	67.9	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-50.6	-41.4	174	-172.1	175.2	176.3	154.3	15.2	112.7	K145 D152 L155 D156 K179 Y181	R141-K145 HydrophobicContact CG-CD 4.22Å; R141-K145 VanDerWaalsContact O-CG 3.24Å; R141-K145 WeakPolarHBondContact O-CG 3.42Å; R141-K145 PolarHBondContact O-N 3.27Å; R141-K145 VanDerWaalsContact O-N 3.14Å; R141-D152 IonicContact CZ-OD1 3.15Å; R141-D152 IonicContact NE-OD1 3.23Å; R141-D152 PolarHBondContact NE-OD1 3.5Å; R141-D152 VanDerWaalsContact NE-OD1 3.14Å; R141-D152 IonicContact NH2-OD1 2.69Å; R141-D152 PolarHBondContact NH2-OD1 2.87Å; R141-L155 HydrophobicContact CG-CD1 4.06Å; R141-D156 IonicContact CZ-OD2 3.21Å; R141-D156 IonicContact NH1-OD2 2.95Å; R141-D156 IonicContact NH2-OD1 3.97Å; R141-D156 IonicContact NH2-OD2 2.7Å; R141-D156 PolarHBondContact NH2-OD2 2.88Å; R141-K179 HydrophobicContact CB-CB 4.21Å; R141-K179 PolarHBondContact N-O 2.74Å; R141-Y181 HydrophobicContact CB-CD2 4.32Å; R141-Y181 HydrophobicContact CB-CE2 3.78Å; R141-Y181 HydrophobicContact CG-CE2 3.95Å
142	T	95.2	Very high	93.7	Very high	86 Å²	86	68.5 Å²	68.5	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-67.3	-41.9	179.7	41.3	0	0	0	0	112	S140 K145 Q146	S140-T142 PolarHBondContact O-N 3.07Å; S140-T142 VanDerWaalsContact O-N 3.17Å; S140-T142 PolarHBondContact OG-OG1 3.18Å; S140-T142 VanDerWaalsContact OG-OG1 3.11Å; T142-K145 PolarHBondContact O-N 3.38Å; T142-Q146 WeakPolarHBondContact O-CB 2.93Å; T142-Q146 VanDerWaalsContact O-CG 3.23Å; T142-Q146 WeakPolarHBondContact O-CG 3.46Å; T142-Q146 PolarHBondContact O-N 2.74Å
143	E	95.9	Very high	94	Very high	45 Å²	45	68 Å²	68	21%	0.21	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-43.5	177.7	-178	179.6	-174	0	0	111.4	I139 S140 K145 Q146 R147	I139-E143 HydrophobicContact CB-CG 4.49Å; S140-E143 PolarHBondContact N-OE2 3.07Å; S140-E143 WeakPolarHBondContact O-CB 3.38Å; S140-E143 PolarHBondContact O-N 3.44Å; S140-E143 WeakPolarHBondContact OG-CB 3.48Å; S140-E143 PolarHBondContact OG-N 2.97Å; E143-K145 PolarHBondContact O-N 2.88Å; E143-Q146 PolarHBondContact O-N 3.02Å; E143-R147 HydrophobicContact CG-CG 4.34Å; E143-R147 WeakPolarHBondContact O-CB 3.39Å; E143-R147 PolarHBondContact O-N 3.14Å; E143-R147 IonicContact OE1-CZ 2.91Å; E143-R147 IonicContact OE1-NE 2.75Å; E143-R147 IonicContact OE1-NH1 2.66Å; E143-R147 PolarHBondContact OE1-NH1 3.44Å; E143-R147 IonicContact OE1-NH2 2.94Å; E143-R147 PolarHBondContact OE1-NH2 3.45Å
144	A	95.9	Very high	94.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-56.5	-48.7	174.7	0	0	0	0	0	111.8	I139 S140 Q146 Y148 V186	I139-A144 HydrophobicContact CD1-CB 3.86Å; I139-A144 HydrophobicContact CG1-CB 4.42Å; S140-A144 PolarHBondContact O-N 2.93Å; A144-Q146 VanDerWaalsContact C-N 3.35Å; A144-Q146 PolarHBondContact O-N 3.42Å; A144-Y148 WeakPolarHBondContact O-CB 3.36Å; A144-Y148 PolarHBondContact O-N 3.14Å; A144-V186 HydrophobicContact CB-CG1 3.92Å; A144-V186 HydrophobicContact CB-CG2 4.36Å
145	K	95.9	Very high	94.7	Very high	66 Å²	66	53.5 Å²	53.5	29%	0.287	25%	0.252	S	S	.	.	H	α-helix	trans	-66	-34.2	178.4	-68.5	175	67.3	171.3	0	113.4	R141 T142 E143 L149 L150 D152 L155	R141-K145 HydrophobicContact CG-CD 4.22Å; R141-K145 VanDerWaalsContact O-CG 3.24Å; R141-K145 WeakPolarHBondContact O-CG 3.42Å; R141-K145 PolarHBondContact O-N 3.27Å; R141-K145 VanDerWaalsContact O-N 3.14Å; T142-K145 PolarHBondContact O-N 3.38Å; E143-K145 PolarHBondContact O-N 2.88Å; K145-L149 CarbonylContact O-C 3.57Å; K145-L149 WeakPolarHBondContact O-CA 3.42Å; K145-L149 PolarHBondContact O-N 2.72Å; K145-L150 WeakPolarHBondContact CG-O 3.43Å; K145-D152 WeakPolarHBondContact CD-OD1 3.46Å; K145-D152 WeakPolarHBondContact CE-OD1 3.43Å; K145-D152 IonicContact NZ-OD1 3.79Å; K145-D152 PolarHBondContact NZ-OD1 2.89Å; K145-D152 IonicContact NZ-OD2 2.86Å; K145-D152 PolarHBondContact NZ-OD2 3.27Å; K145-L155 HydrophobicContact CD-CD1 4.48Å; K145-L155 HydrophobicContact CG-CD1 4.01Å
146	Q	94.9	Very high	95	Very high	147 Å²	147	51.2 Å²	51.2	69%	0.687	25%	0.245	S	C	*	.	H	α-helix	trans	-78.4	-47	-179	-75.3	174.7	2.3	0	0	111.9	T142 E143 A144 L149	T142-Q146 WeakPolarHBondContact O-CB 2.93Å; T142-Q146 VanDerWaalsContact O-CG 3.23Å; T142-Q146 WeakPolarHBondContact O-CG 3.46Å; T142-Q146 PolarHBondContact O-N 2.74Å; E143-Q146 PolarHBondContact O-N 3.02Å; A144-Q146 VanDerWaalsContact C-N 3.35Å; A144-Q146 PolarHBondContact O-N 3.42Å; Q146-L149 WeakPolarHBondContact O-CD2 3.49Å
147	R	94.4	Very high	95.1	Very high	119 Å²	119	58.3 Å²	58.3	45%	0.449	28%	0.275	S	S	.	.	H	α-helix	trans	-74.1	-48.5	-177.3	-69.2	-168.5	178.3	155.1	11.4	112.3	E143 R204	E143-R147 HydrophobicContact CG-CG 4.34Å; E143-R147 WeakPolarHBondContact O-CB 3.39Å; E143-R147 PolarHBondContact O-N 3.14Å; E143-R147 IonicContact OE1-CZ 2.91Å; E143-R147 IonicContact OE1-NE 2.75Å; E143-R147 IonicContact OE1-NH1 2.66Å; E143-R147 PolarHBondContact OE1-NH1 3.44Å; E143-R147 IonicContact OE1-NH2 2.94Å; E143-R147 PolarHBondContact OE1-NH2 3.45Å; R147-R204 PolarHBondContact O-NH2 2.93Å
148	Y	94.9	Very high	94.9	Very high	32 Å²	32	59.2 Å²	59.2	13%	0.125	28%	0.276	C	S	.	.	S	Bend	trans	-95.7	7.8	-176.2	-57.9	-80.6	0	0	0	113	I139 A144 L150 V186 E187 C190 W194 L200	I139-Y148 HydrophobicContact CD1-CD2 4.43Å; I139-Y148 HydrophobicContact CD1-CE2 3.89Å; A144-Y148 WeakPolarHBondContact O-CB 3.36Å; A144-Y148 PolarHBondContact O-N 3.14Å; Y148-L150 PolarHBondContact O-N 3.28Å; Y148-V186 HydrophobicContact CD2-CG1 3.53Å; Y148-V186 HydrophobicContact CE2-CG1 3.92Å; Y148-V186 HydrophobicContact CG-CG1 4.05Å; Y148-E187 HydrophobicContact CE1-CG 3.6Å; Y148-E187 VanDerWaalsContact OH-CG 3.32Å; Y148-E187 WeakPolarHBondContact OH-CG 3.31Å; Y148-E187 PolarHBondContact OH-OE1 3.47Å; Y148-C190 HydrophobicContact CD1-CB 3.84Å; Y148-C190 HydrophobicContact CG-CB 4.24Å; Y148-W194 PolarHBondContact O-NE1 3.34Å; Y148-W194 VanDerWaalsContact O-NE1 3.11Å; Y148-L200 HydrophobicContact CD1-CD2 4.42Å; Y148-L200 WeakPolarHBondContact O-CD1 3.31Å
149	L	95.3	Very high	94.7	Very high	12 Å²	12	65.4 Å²	65.4	6%	0.063	30%	0.304	C	S	.	.			trans	53.2	21.1	178.2	-53.5	179.2	0	0	0	114.8	K145 Q146 W194 L200 A203 R204	K145-L149 CarbonylContact O-C 3.57Å; K145-L149 WeakPolarHBondContact O-CA 3.42Å; K145-L149 PolarHBondContact O-N 2.72Å; Q146-L149 WeakPolarHBondContact O-CD2 3.49Å; L149-W194 HydrophobicContact CB-CZ2 3.69Å; L149-W194 HydrophobicContact CD1-CZ2 4.38Å; L149-L200 HydrophobicContact CB-CD1 4.03Å; L149-L200 HydrophobicContact CD1-CD1 3.95Å; L149-L200 HydrophobicContact CG-CD1 3.95Å; L149-A203 HydrophobicContact CD1-CB 3.92Å; L149-R204 HydrophobicContact CD1-CB 4.25Å
150	L	95.3	Very high	94.5	Very high	5 Å²	5	69.8 Å²	69.8	3%	0.026	33%	0.333	C	S	.	.			trans	-71.6	149.1	-177.4	-66.5	175.7	0	0	0	112.5	K145 Y148 D154 L155 V186 R189 V193	K145-L150 WeakPolarHBondContact CG-O 3.43Å; Y148-L150 PolarHBondContact O-N 3.28Å; L150-D154 HydrophobicContact CD2-CB 4.15Å; L150-L155 HydrophobicContact CD1-CD2 3.9Å; L150-V186 HydrophobicContact CD1-CG1 3.73Å; L150-R189 HydrophobicContact CD1-CG 4.43Å; L150-V193 HydrophobicContact CD2-CB 4.07Å; L150-V193 HydrophobicContact CD2-CG1 4.27Å; L150-V193 HydrophobicContact CD2-CG2 3.94Å
151	K	95.8	Very high	94.2	Very high	139 Å²	139	73 Å²	73	60%	0.604	35%	0.354	S	S	*	.			trans	-96.6	165.7	174	-56.8	172.8	-173.7	168.7	0	110.4	V153 D154 L155	K151-V153 PolarHBondContact O-N 3.24Å; K151-D154 VanDerWaalsContact CB-OD2 3.28Å; K151-D154 WeakPolarHBondContact CB-OD2 3.24Å; K151-D154 PolarHBondContact N-OD2 3.47Å; K151-D154 WeakPolarHBondContact O-CB 3.45Å; K151-D154 PolarHBondContact O-N 3.09Å; K151-L155 PolarHBondContact O-N 2.77Å
152	D	95.2	Very high	94.2	Very high	64 Å²	64	71.1 Å²	71.1	34%	0.342	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-30.8	178.7	-66.8	-47.8	0	0	0	112.8	R141 K145 D154 L155 D156	R141-D152 IonicContact CZ-OD1 3.15Å; R141-D152 IonicContact NE-OD1 3.23Å; R141-D152 PolarHBondContact NE-OD1 3.5Å; R141-D152 VanDerWaalsContact NE-OD1 3.14Å; R141-D152 IonicContact NH2-OD1 2.69Å; R141-D152 PolarHBondContact NH2-OD1 2.87Å; K145-D152 WeakPolarHBondContact CD-OD1 3.46Å; K145-D152 WeakPolarHBondContact CE-OD1 3.43Å; K145-D152 IonicContact NZ-OD1 3.79Å; K145-D152 PolarHBondContact NZ-OD1 2.89Å; K145-D152 IonicContact NZ-OD2 2.86Å; K145-D152 PolarHBondContact NZ-OD2 3.27Å; D152-D154 VanDerWaalsContact C-N 3.29Å; D152-D154 PolarHBondContact O-N 2.94Å; D152-L155 PolarHBondContact O-N 3.44Å; D152-D156 WeakPolarHBondContact O-CB 3.42Å; D152-D156 PolarHBondContact O-N 2.92Å
153	V	94.3	Very high	94.1	Very high	74 Å²	74	72.6 Å²	72.6	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-37.6	174.2	176.3	0	0	0	0	111.3	K151 L155 K157 R158	K151-V153 PolarHBondContact O-N 3.24Å; V153-L155 VanDerWaalsContact C-N 3.27Å; V153-L155 PolarHBondContact O-N 3.44Å; V153-K157 HydrophobicContact CG1-CB 4.13Å; V153-K157 HydrophobicContact CG1-CD 4.16Å; V153-K157 HydrophobicContact CG2-CD 4.36Å; V153-K157 WeakPolarHBondContact O-CB 3.47Å; V153-K157 PolarHBondContact O-N 3.39Å; V153-R158 PolarHBondContact O-N 3.49Å; V153-R158 VanDerWaalsContact O-N 3.14Å
154	D	94.3	Very high	94.1	Very high	10 Å²	10	73.8 Å²	73.8	5%	0.053	35%	0.348	C	S	.	.	H	α-helix	trans	-71.7	-25.5	-178.1	-53	-47.5	0	0	0	111.9	L150 K151 D152 R158 R189 V193	L150-D154 HydrophobicContact CD2-CB 4.15Å; K151-D154 VanDerWaalsContact CB-OD2 3.28Å; K151-D154 WeakPolarHBondContact CB-OD2 3.24Å; K151-D154 PolarHBondContact N-OD2 3.47Å; K151-D154 WeakPolarHBondContact O-CB 3.45Å; K151-D154 PolarHBondContact O-N 3.09Å; D152-D154 VanDerWaalsContact C-N 3.29Å; D152-D154 PolarHBondContact O-N 2.94Å; D154-R158 IonicContact OD1-CZ 2.78Å; D154-R158 IonicContact OD1-NE 3.47Å; D154-R158 PolarHBondContact OD1-NE 3.31Å; D154-R158 IonicContact OD1-NH2 2.97Å; D154-R158 PolarHBondContact OD1-NH2 2.94Å; D154-R189 WeakPolarHBondContact O-CD 3.41Å; D154-R189 PolarHBondContact O-NH1 2.87Å; D154-V193 HydrophobicContact CB-CG2 4.06Å
155	L	94.2	Very high	94.1	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-88.9	-47.5	177.2	-59.6	176.1	0	0	0	112.3	R141 K145 L150 K151 D152 V153 L162	R141-L155 HydrophobicContact CG-CD1 4.06Å; K145-L155 HydrophobicContact CD-CD1 4.48Å; K145-L155 HydrophobicContact CG-CD1 4.01Å; L150-L155 HydrophobicContact CD1-CD2 3.9Å; K151-L155 PolarHBondContact O-N 2.77Å; D152-L155 PolarHBondContact O-N 3.44Å; V153-L155 VanDerWaalsContact C-N 3.27Å; V153-L155 PolarHBondContact O-N 3.44Å; L155-L162 HydrophobicContact CD2-CD1 3.86Å; L155-L162 PolarHBondContact O-N 2.89Å
156	D	93.2	Very high	94.1	Very high	62 Å²	62	77.4 Å²	77.4	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-94.6	-27.4	-167.8	-65.5	-29.6	0	0	0	113.8	R141 D152 Y181	R141-D156 IonicContact CZ-OD2 3.21Å; R141-D156 IonicContact NH1-OD2 2.95Å; R141-D156 IonicContact NH2-OD1 3.97Å; R141-D156 IonicContact NH2-OD2 2.7Å; R141-D156 PolarHBondContact NH2-OD2 2.88Å; D152-D156 WeakPolarHBondContact O-CB 3.42Å; D152-D156 PolarHBondContact O-N 2.92Å; D156-Y181 PolarHBondContact OD1-OH 2.92Å
157	K	92.8	Very high	94.1	Very high	155 Å²	155	76.6 Å²	76.6	67%	0.674	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	-35.2	-170.1	-63.9	-174	178	-177	0	114.9	V153 E159	V153-K157 HydrophobicContact CG1-CB 4.13Å; V153-K157 HydrophobicContact CG1-CD 4.16Å; V153-K157 HydrophobicContact CG2-CD 4.36Å; V153-K157 WeakPolarHBondContact O-CB 3.47Å; V153-K157 PolarHBondContact O-N 3.39Å; K157-E159 PolarHBondContact O-N 3.45Å
158	R	92.3	Very high	94.2	Very high	107 Å²	107	76.8 Å²	76.8	40%	0.404	37%	0.368	S	S	.	.	S	Bend	trans	-62.7	135.3	-180	-80.4	-171.9	-173.6	-107.5	5.9	110.4	V153 D154 P160 P161 R189	V153-R158 PolarHBondContact O-N 3.49Å; V153-R158 VanDerWaalsContact O-N 3.14Å; D154-R158 IonicContact OD1-CZ 2.78Å; D154-R158 IonicContact OD1-NE 3.47Å; D154-R158 PolarHBondContact OD1-NE 3.31Å; D154-R158 IonicContact OD1-NH2 2.97Å; D154-R158 PolarHBondContact OD1-NH2 2.94Å; R158-P160 CarbonylContact O-C 3.33Å; R158-P161 WeakPolarHBondContact O-CA 3.28Å; R158-R189 VanDerWaalsContact CB-NH1 3.3Å; R158-R189 PolarHBondContact O-NH1 2.91Å
159	E	90.6	Very high	94.2	Very high	177 Å²	177	77.1 Å²	77.1	83%	0.827	37%	0.372	S	S	*	.	S	Bend	trans	-78.9	137	178.6	-64.9	178.9	-176.1	0	0	111.1	K157 R189	K157-E159 PolarHBondContact O-N 3.45Å; E159-R189 PolarHBondContact O-NH2 3.08Å
160	P	91.3	Very high	94.2	Very high	94 Å²	94	81.9 Å²	81.9	61%	0.61	40%	0.403	S	S	*	.	S	Bend	cis	-69.6	141	-14.8	28.8	-33.7	0	0	0	111.4	R158 L162 R189	R158-P160 CarbonylContact O-C 3.33Å; P160-L162 PolarHBondContact O-N 3.31Å; P160-R189 PolarHBondContact O-NH2 3.47Å
161	P	91.9	Very high	94	Very high	83 Å²	83	88.9 Å²	88.9	54%	0.539	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-60.5	134	176	-22.8	33.9	0	0	0	111.2	R158 R163	R158-P161 WeakPolarHBondContact O-CA 3.28Å; P161-R163 PolarHBondContact O-N 3.41Å
162	L	93.9	Very high	93.9	Very high	17 Å²	17	84.5 Å²	84.5	9%	0.089	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-73.9	124.6	-179.4	-64.1	-173.9	0	0	0	110.4	L155 P160 Y181 Q185 V186 R189	L155-L162 HydrophobicContact CD2-CD1 3.86Å; L155-L162 PolarHBondContact O-N 2.89Å; P160-L162 PolarHBondContact O-N 3.31Å; L162-Y181 HydrophobicContact CB-CD1 3.89Å; L162-Y181 HydrophobicContact CB-CE1 3.94Å; L162-Q185 HydrophobicContact CD2-CB 3.98Å; L162-V186 HydrophobicContact CD1-CG2 4.29Å; L162-R189 HydrophobicContact CD1-CB 4.09Å; L162-R189 HydrophobicContact CD1-CG 4.19Å
163	R	94.4	Very high	93.8	Very high	116 Å²	116	85.8 Å²	85.8	44%	0.438	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-72	153.7	173.1	-63.4	-162.6	177.9	-158.6	8.7	111.2	S120 F121 D122 P161 Y181	S120-R163 WeakPolarHBondContact O-CB 3.22Å; S120-R163 WeakPolarHBondContact O-CD 3.28Å; F121-R163 HydrophobicContact CD1-CB 4.32Å; D122-R163 VanDerWaalsContact CG-NH2 3.27Å; D122-R163 IonicContact OD1-CZ 3.32Å; D122-R163 IonicContact OD1-NE 2.75Å; D122-R163 PolarHBondContact OD1-NE 2.78Å; D122-R163 IonicContact OD1-NH1 3.66Å; D122-R163 PolarHBondContact OD1-NH1 3.31Å; D122-R163 VanDerWaalsContact OD1-NH1 3.15Å; D122-R163 IonicContact OD1-NH2 3.14Å; D122-R163 PolarHBondContact OD1-NH2 3.2Å; D122-R163 IonicContact OD2-CZ 3.95Å; D122-R163 IonicContact OD2-NE 3.62Å; D122-R163 PolarHBondContact OD2-NE 3.43Å; D122-R163 IonicContact OD2-NH1 2.8Å; D122-R163 IonicContact OD2-NH2 2.74Å; D122-R163 PolarHBondContact OD2-NH2 2.88Å; P161-R163 PolarHBondContact O-N 3.41Å; R163-Y181 WeakPolarHBondContact O-CD1 3.35Å
164	F	95.5	Very high	93.8	Very high	71 Å²	71	93.5 Å²	93.5	31%	0.311	45%	0.452	S	S	.	.			trans	-146.2	157.6	-179.4	58.6	-94.9	0	0	0	111.8	L166 K179 L180 Y181	F164-L166 HydrophobicContact CD2-CD2 4.11Å; F164-L166 HydrophobicContact CD2-CG 4.31Å; F164-L166 HydrophobicContact CE2-CD2 3.86Å; F164-L166 HydrophobicContact CE2-CG 4.07Å; F164-K179 HydrophobicContact CB-CB 4.35Å; F164-K179 HydrophobicContact CD1-CD 4.22Å; F164-K179 HydrophobicContact CD2-CB 4.05Å; F164-K179 HydrophobicContact CD2-CD 3.82Å; F164-K179 HydrophobicContact CD2-CG 3.68Å; F164-K179 HydrophobicContact CE1-CD 4.19Å; F164-K179 HydrophobicContact CE2-CD 3.8Å; F164-K179 HydrophobicContact CE2-CG 3.91Å; F164-K179 HydrophobicContact CG-CB 4.24Å; F164-K179 HydrophobicContact CG-CD 4.06Å; F164-K179 HydrophobicContact CG-CG 4.21Å; F164-K179 HydrophobicContact CZ-CD 4Å; F164-K179 VanDerWaalsContact CZ-NZ 3.29Å; F164-L180 CarbonylContact C-O 3.58Å; F164-L180 WeakPolarHBondContact CA-O 3.4Å; F164-L180 VanDerWaalsContact CB-O 3.31Å; F164-L180 WeakPolarHBondContact CB-O 3.4Å; F164-Y181 HydrophobicContact CB-CD1 3.87Å; F164-Y181 HydrophobicContact CB-CD2 4.36Å; F164-Y181 HydrophobicContact CB-CE1 3.68Å; F164-Y181 HydrophobicContact CB-CE2 4.14Å; F164-Y181 HydrophobicContact CB-CG 4.25Å; F164-Y181 AromaticContact CD1-CE1 3.85Å; F164-Y181 HydrophobicContact CD1-CE1 3.85Å; F164-Y181 AromaticContact CD1-CZ 3.87Å; F164-Y181 HydrophobicContact CG-CE1 4.19Å
165	I	95.9	Very high	93.8	Very high	41 Å²	41	99.1 Å²	99.1	21%	0.21	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.3	172.5	-59.7	174.3	0	0	0	109.2	F116 F121 K179 L180	F116-I165 HydrophobicContact CE1-CD1 3.75Å; F116-I165 HydrophobicContact CE2-CD1 3.89Å; F116-I165 HydrophobicContact CZ-CD1 3.17Å; F121-I165 HydrophobicContact CE1-CG1 4.37Å; F121-I165 HydrophobicContact CE2-CD1 3.49Å; F121-I165 VanDerWaalsContact CE2-CD1 3.49Å; F121-I165 HydrophobicContact CE2-CG1 4.03Å; F121-I165 HydrophobicContact CZ-CD1 3.55Å; F121-I165 HydrophobicContact CZ-CG1 3.64Å; I165-K179 WeakPolarHBondContact O-CA 3.3Å; I165-L180 PolarHBondContact N-O 3.44Å; I165-L180 PolarHBondContact O-N 2.74Å
166	L	96.2	Very high	93.8	Very high	100 Å²	100	102.1 Å²	102.1	52%	0.524	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.3	173	-65.6	173.4	0	0	0	110.3	F164 D177 M178 K179	F164-L166 HydrophobicContact CD2-CD2 4.11Å; F164-L166 HydrophobicContact CD2-CG 4.31Å; F164-L166 HydrophobicContact CE2-CD2 3.86Å; F164-L166 HydrophobicContact CE2-CG 4.07Å; L166-D177 HydrophobicContact CB-CB 4.32Å; L166-D177 HydrophobicContact CD2-CB 4.24Å; L166-M178 WeakPolarHBondContact CA-O 3.18Å; L166-K179 HydrophobicContact CD2-CG 3.69Å
167	K	95.4	Very high	93.9	Very high	131 Å²	131	102.6 Å²	102.6	57%	0.57	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.8	175.7	-166.4	172.4	-177.5	174.2	0	110.2	M178 L180	K167-M178 PolarHBondContact N-O 3.14Å; K167-M178 PolarHBondContact O-N 3.25Å; K167-L180 HydrophobicContact CB-CD1 4.02Å; K167-L180 HydrophobicContact CD-CD1 3.93Å
168	K	96.3	Very high	94	Very high	122 Å²	122	97.5 Å²	97.5	53%	0.53	48%	0.484	S	S	.	.			trans	-58.1	141.7	173.3	-65.5	-74	161.2	-150.7	0	109.9	D177	K168-D177 WeakPolarHBondContact CD-OD1 3.27Å; K168-D177 VanDerWaalsContact CE-OD1 3.24Å; K168-D177 WeakPolarHBondContact CE-OD1 3.32Å; K168-D177 IonicContact NZ-OD1 3.39Å; K168-D177 PolarHBondContact NZ-OD1 2.8Å; K168-D177 IonicContact NZ-OD2 3.53Å; K168-D177 PolarHBondContact NZ-OD2 3.43Å
169	N	94.4	Very high	94.2	Very high	39 Å²	39	94.8 Å²	94.8	21%	0.209	48%	0.476	C	S	.	.			trans	-67.3	124.5	179.6	-172.2	-45.9	0	0	0	110	H171 N172 W175	N169-H171 VanDerWaalsContact C-N 3.26Å; N169-H171 PolarHBondContact O-N 3.28Å; N169-H171 WeakPolarHBondContact OD1-CB 3.38Å; N169-H171 PolarHBondContact OD1-N 3.36Å; N169-N172 CarbonylContact O-C 3.49Å; N169-N172 PolarHBondContact O-N 3.41Å; N169-W175 HydrophobicContact CB-CB 4.31Å; N169-W175 HydrophobicContact CB-CE3 4.49Å
170	P	94.5	Very high	94.5	Very high	112 Å²	112	87.4 Å²	87.4	73%	0.727	44%	0.442	S	S	*	.	S	Bend	trans	-66.4	-26.7	-175.3	26.2	-35	0	0	0	113.3
171	H	91.5	Very high	94.8	Very high	153 Å²	153	82.9 Å²	82.9	71%	0.708	41%	0.413	S	S	*	.	S	Bend	trans	-79.9	-37.7	-179.9	-174	-70.6	0	0	0	111.9	N169 W175	N169-H171 VanDerWaalsContact C-N 3.26Å; N169-H171 PolarHBondContact O-N 3.28Å; N169-H171 WeakPolarHBondContact OD1-CB 3.38Å; N169-H171 PolarHBondContact OD1-N 3.36Å; H171-W175 HydrophobicContact CB-CH2 4.48Å; H171-W175 HydrophobicContact CB-CZ3 3.79Å; H171-W175 AromaticContact CE1-CH2 3.78Å; H171-W175 AromaticContact CG-CH2 3.98Å; H171-W175 AromaticContact CG-CZ3 3.77Å; H171-W175 AromaticContact ND1-CH2 3.21Å; H171-W175 WeakPolarHBondContact ND1-CH2 3.48Å; H171-W175 AromaticContact ND1-CZ3 3.42Å; H171-W175 WeakPolarHBondContact ND1-CZ3 3.4Å
172	N	93.8	Very high	95	Very high	47 Å²	47	79 Å²	79	25%	0.251	39%	0.387	S	S	.	.			trans	-152.1	113.6	174.9	-176.7	-7.1	0	0	0	110.9	N169 R174 W175	N169-N172 CarbonylContact O-C 3.49Å; N169-N172 PolarHBondContact O-N 3.41Å; N172-R174 PolarHBondContact O-N 3.06Å; N172-R174 WeakPolarHBondContact OD1-CB 3.43Å; N172-R174 PolarHBondContact OD1-N 3.27Å; N172-W175 HydrophobicContact CB-CD2 3.51Å; N172-W175 HydrophobicContact CB-CE3 3.69Å; N172-W175 HydrophobicContact CB-CG 3.95Å; N172-W175 HydrophobicContact CB-CH2 4.18Å; N172-W175 HydrophobicContact CB-CZ2 3.99Å; N172-W175 HydrophobicContact CB-CZ3 4.04Å; N172-W175 PolarHBondContact ND2-NE1 3.49Å; N172-W175 WeakPolarHBondContact O-CB 3.4Å; N172-W175 PolarHBondContact O-N 2.8Å; N172-W175 VanDerWaalsContact O-N 3.07Å
173	P	93.8	Very high	95	Very high	90 Å²	90	79.3 Å²	79.3	58%	0.584	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-12.9	-177.1	29.2	-35.9	0	0	0	113.8	W175	P173-W175 VanDerWaalsContact C-N 3.32Å
174	R	94.4	Very high	95	Very high	237 Å²	237	76.2 Å²	76.2	89%	0.894	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-18.4	173	-64.9	-176.9	176.6	175.8	-0.3	112.7	N172	N172-R174 PolarHBondContact O-N 3.06Å; N172-R174 WeakPolarHBondContact OD1-CB 3.43Å; N172-R174 PolarHBondContact OD1-N 3.27Å
175	W	93.4	Very high	94.9	Very high	128 Å²	128	74.5 Å²	74.5	49%	0.485	37%	0.374	S	S	.	.	S	Bend	trans	-69.7	161.7	172.6	-64.6	-19.9	0	0	0	110.5	N169 H171 N172 P173	N169-W175 HydrophobicContact CB-CB 4.31Å; N169-W175 HydrophobicContact CB-CE3 4.49Å; H171-W175 HydrophobicContact CB-CH2 4.48Å; H171-W175 HydrophobicContact CB-CZ3 3.79Å; H171-W175 AromaticContact CE1-CH2 3.78Å; H171-W175 AromaticContact CG-CH2 3.98Å; H171-W175 AromaticContact CG-CZ3 3.77Å; H171-W175 AromaticContact ND1-CH2 3.21Å; H171-W175 WeakPolarHBondContact ND1-CH2 3.48Å; H171-W175 AromaticContact ND1-CZ3 3.42Å; H171-W175 WeakPolarHBondContact ND1-CZ3 3.4Å; N172-W175 HydrophobicContact CB-CD2 3.51Å; N172-W175 HydrophobicContact CB-CE3 3.69Å; N172-W175 HydrophobicContact CB-CG 3.95Å; N172-W175 HydrophobicContact CB-CH2 4.18Å; N172-W175 HydrophobicContact CB-CZ2 3.99Å; N172-W175 HydrophobicContact CB-CZ3 4.04Å; N172-W175 PolarHBondContact ND2-NE1 3.49Å; N172-W175 WeakPolarHBondContact O-CB 3.4Å; N172-W175 PolarHBondContact O-N 2.8Å; N172-W175 VanDerWaalsContact O-N 3.07Å; P173-W175 VanDerWaalsContact C-N 3.32Å
176	G	94.4	Very high	94.9	Very high	62 Å²	62	72.6 Å²	72.6	64%	0.639	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-57.2	154	176.1	0	0	0	0	0	112.1
177	D	96.1	Very high	94.8	Very high	73 Å²	73	71.6 Å²	71.6	39%	0.39	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-63	136.9	179.5	-66.3	-30.9	0	0	0	111.1	L166 K168	L166-D177 HydrophobicContact CB-CB 4.32Å; L166-D177 HydrophobicContact CD2-CB 4.24Å; K168-D177 WeakPolarHBondContact CD-OD1 3.27Å; K168-D177 VanDerWaalsContact CE-OD1 3.24Å; K168-D177 WeakPolarHBondContact CE-OD1 3.32Å; K168-D177 IonicContact NZ-OD1 3.39Å; K168-D177 PolarHBondContact NZ-OD1 2.8Å; K168-D177 IonicContact NZ-OD2 3.53Å; K168-D177 PolarHBondContact NZ-OD2 3.43Å
178	M	94.9	Very high	94.8	Very high	47 Å²	47	71.6 Å²	71.6	23%	0.232	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	132.5	176.2	180	164.6	67.5	0	0	109.5	L166 K167 L180	L166-M178 WeakPolarHBondContact CA-O 3.18Å; K167-M178 PolarHBondContact N-O 3.14Å; K167-M178 PolarHBondContact O-N 3.25Å; M178-L180 HydrophobicContact CE-CD2 3.87Å; M178-L180 HydrophobicContact CG-CD2 4.33Å; M178-L180 HydrophobicContact SD-CD2 4.43Å
179	K	96.3	Very high	94.7	Very high	51 Å²	51	66 Å²	66	22%	0.222	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.8	170.3	-65.2	-175.2	177.1	-161.1	0	110.1	R141 F164 I165 L166 Y181	R141-K179 HydrophobicContact CB-CB 4.21Å; R141-K179 PolarHBondContact N-O 2.74Å; F164-K179 HydrophobicContact CB-CB 4.35Å; F164-K179 HydrophobicContact CD1-CD 4.22Å; F164-K179 HydrophobicContact CD2-CB 4.05Å; F164-K179 HydrophobicContact CD2-CD 3.82Å; F164-K179 HydrophobicContact CD2-CG 3.68Å; F164-K179 HydrophobicContact CE1-CD 4.19Å; F164-K179 HydrophobicContact CE2-CD 3.8Å; F164-K179 HydrophobicContact CE2-CG 3.91Å; F164-K179 HydrophobicContact CG-CB 4.24Å; F164-K179 HydrophobicContact CG-CD 4.06Å; F164-K179 HydrophobicContact CG-CG 4.21Å; F164-K179 HydrophobicContact CZ-CD 4Å; F164-K179 VanDerWaalsContact CZ-NZ 3.29Å; I165-K179 WeakPolarHBondContact O-CA 3.3Å; L166-K179 HydrophobicContact CD2-CG 3.69Å; K179-Y181 HydrophobicContact CB-CE2 3.9Å
180	L	96.8	Very high	94.7	Very high	21 Å²	21	64.4 Å²	64.4	11%	0.11	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.9	176.1	-66.3	178.2	0	0	0	109.9	L138 I139 F164 I165 K167 M178	L138-L180 HydrophobicContact CB-CB 4.4Å; L138-L180 HydrophobicContact CD1-CD1 4.41Å; I139-L180 CarbonylContact O-C 3.58Å; I139-L180 WeakPolarHBondContact O-CA 3.43Å; F164-L180 CarbonylContact C-O 3.58Å; F164-L180 WeakPolarHBondContact CA-O 3.4Å; F164-L180 VanDerWaalsContact CB-O 3.31Å; F164-L180 WeakPolarHBondContact CB-O 3.4Å; I165-L180 PolarHBondContact N-O 3.44Å; I165-L180 PolarHBondContact O-N 2.74Å; K167-L180 HydrophobicContact CB-CD1 4.02Å; K167-L180 HydrophobicContact CD-CD1 3.93Å; M178-L180 HydrophobicContact CE-CD2 3.87Å; M178-L180 HydrophobicContact CG-CD2 4.33Å; M178-L180 HydrophobicContact SD-CD2 4.43Å
181	Y	96.3	Very high	94.7	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	154.3	177.1	-65.4	-92.5	0	0	0	109.9	L138 I139 R141 D156 L162 R163 F164 K179 V186	L138-Y181 CarbonylContact C-O 3.52Å; L138-Y181 WeakPolarHBondContact CA-O 3.3Å; I139-Y181 PolarHBondContact N-O 2.93Å; I139-Y181 PolarHBondContact O-N 2.75Å; R141-Y181 HydrophobicContact CB-CD2 4.32Å; R141-Y181 HydrophobicContact CB-CE2 3.78Å; R141-Y181 HydrophobicContact CG-CE2 3.95Å; D156-Y181 PolarHBondContact OD1-OH 2.92Å; L162-Y181 HydrophobicContact CB-CD1 3.89Å; L162-Y181 HydrophobicContact CB-CE1 3.94Å; R163-Y181 WeakPolarHBondContact O-CD1 3.35Å; F164-Y181 HydrophobicContact CB-CD1 3.87Å; F164-Y181 HydrophobicContact CB-CD2 4.36Å; F164-Y181 HydrophobicContact CB-CE1 3.68Å; F164-Y181 HydrophobicContact CB-CE2 4.14Å; F164-Y181 HydrophobicContact CB-CG 4.25Å; F164-Y181 AromaticContact CD1-CE1 3.85Å; F164-Y181 HydrophobicContact CD1-CE1 3.85Å; F164-Y181 AromaticContact CD1-CZ 3.87Å; F164-Y181 HydrophobicContact CG-CE1 4.19Å; K179-Y181 HydrophobicContact CB-CE2 3.9Å; Y181-V186 HydrophobicContact CG-CG2 4.48Å
182	L	95.8	Very high	94.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	126	172.5	-168.5	69.5	0	0	0	110.1	L117 F121 L123 H136 L138 L184 Q185 V186	L117-L182 HydrophobicContact CD2-CD1 4.24Å; F121-L182 HydrophobicContact CB-CD2 4.48Å; F121-L182 HydrophobicContact CD1-CB 3.96Å; F121-L182 HydrophobicContact CD2-CB 4.47Å; F121-L182 HydrophobicContact CE1-CB 4.17Å; F121-L182 HydrophobicContact CG-CB 4.13Å; L123-L182 HydrophobicContact CD1-CD2 3.49Å; L123-L182 VanDerWaalsContact CD1-CD2 3.49Å; H136-L182 HydrophobicContact CB-CD1 3.97Å; L138-L182 HydrophobicContact CD2-CD1 3.89Å; L182-L184 VanDerWaalsContact C-N 3.31Å; L182-L184 HydrophobicContact CD2-CB 4.44Å; L182-L184 HydrophobicContact CG-CB 4.43Å; L182-L184 PolarHBondContact O-N 3.01Å; L182-Q185 HydrophobicContact CB-CB 4.34Å; L182-Q185 HydrophobicContact CB-CG 4.29Å; L182-Q185 HydrophobicContact CD2-CG 4.18Å; L182-Q185 PolarHBondContact O-N 2.93Å; L182-Q185 VanDerWaalsContact O-N 3.12Å; L182-V186 PolarHBondContact O-N 3.14Å; L182-V186 VanDerWaalsContact O-N 3.16Å
183	L	95.2	Very high	94.9	Very high	25 Å²	25	61.4 Å²	61.4	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-45.8	-176.8	177.1	139.8	0	0	0	112	K137 I139 Q185 V186 E187	K137-L183 HydrophobicContact CB-CB 4.35Å; K137-L183 HydrophobicContact CD-CD1 4.33Å; K137-L183 WeakPolarHBondContact O-CB 3.44Å; K137-L183 PolarHBondContact O-N 3.02Å; I139-L183 HydrophobicContact CD1-CB 4.46Å; I139-L183 HydrophobicContact CG1-CB 4.48Å; I139-L183 HydrophobicContact CG2-CB 4.25Å; I139-L183 HydrophobicContact CG2-CD1 3.82Å; L183-Q185 VanDerWaalsContact C-N 3.29Å; L183-Q185 PolarHBondContact O-N 3.36Å; L183-V186 WeakPolarHBondContact O-CB 3.44Å; L183-V186 PolarHBondContact O-N 2.86Å; L183-E187 VanDerWaalsContact CD2-CD 3.46Å; L183-E187 HydrophobicContact CD2-CG 4.34Å; L183-E187 VanDerWaalsContact CD2-OE1 3.28Å; L183-E187 WeakPolarHBondContact CD2-OE1 3.47Å; L183-E187 PolarHBondContact O-N 2.89Å
184	L	93.8	Very high	94.9	Very high	50 Å²	50	60.8 Å²	60.8	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-56.4	-39.7	178.1	-175.1	155.2	0	0	0	113.1	L182 K188	L182-L184 VanDerWaalsContact C-N 3.31Å; L182-L184 HydrophobicContact CD2-CB 4.44Å; L182-L184 HydrophobicContact CG-CB 4.43Å; L182-L184 PolarHBondContact O-N 3.01Å; L184-K188 HydrophobicContact CD2-CD 3.94Å; L184-K188 VanDerWaalsContact CD2-CE 3.46Å; L184-K188 WeakPolarHBondContact O-CG 3.42Å; L184-K188 PolarHBondContact O-N 3.3Å
185	Q	94.8	Very high	94.9	Very high	36 Å²	36	52.1 Å²	52.1	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-71.2	-37	177.2	-75.5	177	-19.4	0	0	112	F121 L162 L182 L183 R189	F121-Q185 PolarHBondContact O-NE2 3.06Å; L162-Q185 HydrophobicContact CD2-CB 3.98Å; L182-Q185 HydrophobicContact CB-CB 4.34Å; L182-Q185 HydrophobicContact CB-CG 4.29Å; L182-Q185 HydrophobicContact CD2-CG 4.18Å; L182-Q185 PolarHBondContact O-N 2.93Å; L182-Q185 VanDerWaalsContact O-N 3.12Å; L183-Q185 VanDerWaalsContact C-N 3.29Å; L183-Q185 PolarHBondContact O-N 3.36Å; Q185-R189 WeakPolarHBondContact O-CB 3.46Å; Q185-R189 PolarHBondContact O-N 2.86Å
186	V	95.6	Very high	94.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.1	-39	177.7	175.6	0	0	0	0	111.1	I139 A144 Y148 L150 L162 Y181 L182 L183 R189 C190	I139-V186 HydrophobicContact CD1-CB 3.95Å; I139-V186 HydrophobicContact CD1-CG1 3.93Å; I139-V186 HydrophobicContact CD1-CG2 3.98Å; I139-V186 HydrophobicContact CG1-CG2 4.4Å; A144-V186 HydrophobicContact CB-CG1 3.92Å; A144-V186 HydrophobicContact CB-CG2 4.36Å; Y148-V186 HydrophobicContact CD2-CG1 3.53Å; Y148-V186 HydrophobicContact CE2-CG1 3.92Å; Y148-V186 HydrophobicContact CG-CG1 4.05Å; L150-V186 HydrophobicContact CD1-CG1 3.73Å; L162-V186 HydrophobicContact CD1-CG2 4.29Å; Y181-V186 HydrophobicContact CG-CG2 4.48Å; L182-V186 PolarHBondContact O-N 3.14Å; L182-V186 VanDerWaalsContact O-N 3.16Å; L183-V186 WeakPolarHBondContact O-CB 3.44Å; L183-V186 PolarHBondContact O-N 2.86Å; V186-R189 CarbonylContact O-C 3.06Å; V186-R189 PolarHBondContact O-N 3.41Å; V186-C190 WeakPolarHBondContact O-CB 3.4Å; V186-C190 PolarHBondContact O-N 3.09Å
187	E	94.1	Very high	94.7	Very high	80 Å²	80	51.6 Å²	51.6	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-63.6	-46.6	175.4	-74.9	178.1	168	0	0	111.8	Y148 L183 R189 C190 M191	Y148-E187 HydrophobicContact CE1-CG 3.6Å; Y148-E187 VanDerWaalsContact OH-CG 3.32Å; Y148-E187 WeakPolarHBondContact OH-CG 3.31Å; Y148-E187 PolarHBondContact OH-OE1 3.47Å; L183-E187 VanDerWaalsContact CD2-CD 3.46Å; L183-E187 HydrophobicContact CD2-CG 4.34Å; L183-E187 VanDerWaalsContact CD2-OE1 3.28Å; L183-E187 WeakPolarHBondContact CD2-OE1 3.47Å; L183-E187 PolarHBondContact O-N 2.89Å; E187-R189 VanDerWaalsContact C-N 3.32Å; E187-R189 PolarHBondContact O-N 2.96Å; E187-C190 WeakPolarHBondContact O-CA 3.31Å; E187-C190 VanDerWaalsContact O-CB 3.29Å; E187-C190 WeakPolarHBondContact O-CB 3.35Å; E187-C190 PolarHBondContact O-N 3.13Å; E187-C190 VanDerWaalsContact O-N 3.08Å; E187-M191 WeakPolarHBondContact O-CG 3.44Å; E187-M191 PolarHBondContact O-N 3.45Å
188	K	94.3	Very high	94.6	Very high	131 Å²	131	54.9 Å²	54.9	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-56.5	-46.8	173	-72.4	178	179.1	-178.3	0	111.5	L184 C190 M191 E192	L184-K188 HydrophobicContact CD2-CD 3.94Å; L184-K188 VanDerWaalsContact CD2-CE 3.46Å; L184-K188 WeakPolarHBondContact O-CG 3.42Å; L184-K188 PolarHBondContact O-N 3.3Å; K188-C190 VanDerWaalsContact C-N 3.29Å; K188-C190 PolarHBondContact O-N 3.42Å; K188-M191 PolarHBondContact O-N 3.12Å; K188-E192 WeakPolarHBondContact O-CG 3.24Å; K188-E192 PolarHBondContact O-N 2.99Å
189	R	94.5	Very high	94.6	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-33.7	176.4	-178.3	53.5	53.1	85.8	-1.7	112.5	L150 D154 R158 E159 P160 L162 Q185 V186 E187 E192 V193	L150-R189 HydrophobicContact CD1-CG 4.43Å; D154-R189 WeakPolarHBondContact O-CD 3.41Å; D154-R189 PolarHBondContact O-NH1 2.87Å; R158-R189 VanDerWaalsContact CB-NH1 3.3Å; R158-R189 PolarHBondContact O-NH1 2.91Å; E159-R189 PolarHBondContact O-NH2 3.08Å; P160-R189 PolarHBondContact O-NH2 3.47Å; L162-R189 HydrophobicContact CD1-CB 4.09Å; L162-R189 HydrophobicContact CD1-CG 4.19Å; Q185-R189 WeakPolarHBondContact O-CB 3.46Å; Q185-R189 PolarHBondContact O-N 2.86Å; V186-R189 CarbonylContact O-C 3.06Å; V186-R189 PolarHBondContact O-N 3.41Å; E187-R189 VanDerWaalsContact C-N 3.32Å; E187-R189 PolarHBondContact O-N 2.96Å; R189-E192 WeakPolarHBondContact CD-OE2 3.27Å; R189-E192 IonicContact CZ-OE2 3.53Å; R189-E192 IonicContact NE-OE2 2.74Å; R189-E192 PolarHBondContact NE-OE2 3.1Å; R189-E192 IonicContact NH2-OE2 2.72Å; R189-E192 PolarHBondContact O-N 3.01Å; R189-V193 VanDerWaalsContact O-CG2 3.27Å; R189-V193 WeakPolarHBondContact O-CG2 3.49Å; R189-V193 PolarHBondContact O-N 3.18Å; R189-V193 VanDerWaalsContact O-N 3.09Å
190	C	95.1	Very high	94.5	Very high	6 Å²	6	52.1 Å²	52.1	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-46.9	174.3	-173.7	0	0	0	0	111.1	Y148 V186 E187 K188 E192 V193 W194	Y148-C190 HydrophobicContact CD1-CB 3.84Å; Y148-C190 HydrophobicContact CG-CB 4.24Å; V186-C190 WeakPolarHBondContact O-CB 3.4Å; V186-C190 PolarHBondContact O-N 3.09Å; E187-C190 WeakPolarHBondContact O-CA 3.31Å; E187-C190 VanDerWaalsContact O-CB 3.29Å; E187-C190 WeakPolarHBondContact O-CB 3.35Å; E187-C190 PolarHBondContact O-N 3.13Å; E187-C190 VanDerWaalsContact O-N 3.08Å; K188-C190 VanDerWaalsContact C-N 3.29Å; K188-C190 PolarHBondContact O-N 3.42Å; C190-E192 VanDerWaalsContact C-N 3.3Å; C190-E192 PolarHBondContact O-N 2.89Å; C190-V193 PolarHBondContact O-N 2.81Å; C190-V193 VanDerWaalsContact O-N 3.13Å; C190-W194 PolarHBondContact O-N 3.09Å; C190-W194 VanDerWaalsContact SG-CD1 3.56Å
191	M	94.4	Very high	94.4	Very high	93 Å²	93	56 Å²	56	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-37.2	175.8	-65.8	-58.2	-69.8	0	0	112	E187 K188 V193 G195	E187-M191 WeakPolarHBondContact O-CG 3.44Å; E187-M191 PolarHBondContact O-N 3.45Å; K188-M191 PolarHBondContact O-N 3.12Å; M191-V193 VanDerWaalsContact C-N 3.33Å; M191-V193 PolarHBondContact O-N 3.02Å; M191-G195 WeakPolarHBondContact O-CA 3.35Å; M191-G195 PolarHBondContact O-N 3.05Å
192	E	94	Very high	94.3	Very high	114 Å²	114	62 Å²	62	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-33.4	174.1	-70.4	167.3	-172.4	0	0	113.5	K188 R189 C190	K188-E192 WeakPolarHBondContact O-CG 3.24Å; K188-E192 PolarHBondContact O-N 2.99Å; R189-E192 WeakPolarHBondContact CD-OE2 3.27Å; R189-E192 IonicContact CZ-OE2 3.53Å; R189-E192 IonicContact NE-OE2 2.74Å; R189-E192 PolarHBondContact NE-OE2 3.1Å; R189-E192 IonicContact NH2-OE2 2.72Å; R189-E192 PolarHBondContact O-N 3.01Å; C190-E192 VanDerWaalsContact C-N 3.3Å; C190-E192 PolarHBondContact O-N 2.89Å
193	V	94.8	Very high	94.3	Very high	42 Å²	42	62.7 Å²	62.7	26%	0.255	32%	0.322	S	S	.	.	H	α-helix	trans	-84.1	-42.7	-176.6	170.7	0	0	0	0	111.8	L150 D154 R189 C190 M191	L150-V193 HydrophobicContact CD2-CB 4.07Å; L150-V193 HydrophobicContact CD2-CG1 4.27Å; L150-V193 HydrophobicContact CD2-CG2 3.94Å; D154-V193 HydrophobicContact CB-CG2 4.06Å; R189-V193 VanDerWaalsContact O-CG2 3.27Å; R189-V193 WeakPolarHBondContact O-CG2 3.49Å; R189-V193 PolarHBondContact O-N 3.18Å; R189-V193 VanDerWaalsContact O-N 3.09Å; C190-V193 PolarHBondContact O-N 2.81Å; C190-V193 VanDerWaalsContact O-N 3.13Å; M191-V193 VanDerWaalsContact C-N 3.33Å; M191-V193 PolarHBondContact O-N 3.02Å
194	W	94.8	Very high	94.2	Very high	76 Å²	76	66 Å²	66	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-99.2	-18.5	-174.5	-66.1	102.3	0	0	0	113.4	Y148 L149 C190 S196 L200 A203	Y148-W194 PolarHBondContact O-NE1 3.34Å; Y148-W194 VanDerWaalsContact O-NE1 3.11Å; L149-W194 HydrophobicContact CB-CZ2 3.69Å; L149-W194 HydrophobicContact CD1-CZ2 4.38Å; C190-W194 PolarHBondContact O-N 3.09Å; C190-W194 VanDerWaalsContact SG-CD1 3.56Å; W194-S196 PolarHBondContact O-N 3.31Å; W194-L200 HydrophobicContact CB-CB 4.47Å; W194-L200 HydrophobicContact CD2-CD1 4.24Å; W194-L200 HydrophobicContact CG-CB 4.33Å; W194-L200 HydrophobicContact CG-CD1 4.14Å; W194-A203 HydrophobicContact CE3-CB 4.23Å; W194-A203 HydrophobicContact CH2-CB 3.62Å; W194-A203 HydrophobicContact CZ2-CB 4.42Å; W194-A203 HydrophobicContact CZ3-CB 3.5Å
195	G	93	Very high	94.3	Very high	56 Å²	56	69.4 Å²	69.4	58%	0.577	35%	0.347	S	S	*	.	S	Bend	trans	80.6	-52.3	-179.3	0	0	0	0	0	113.1	M191	M191-G195 WeakPolarHBondContact O-CA 3.35Å; M191-G195 PolarHBondContact O-N 3.05Å
196	S	93.3	Very high	94.4	Very high	46 Å²	46	70.8 Å²	70.8	32%	0.322	36%	0.358	S	S	.	.	S	Bend	trans	-129.5	157.1	178.3	64.2	0	0	0	0	111.9	W194 E198 A199 L200	W194-S196 PolarHBondContact O-N 3.31Å; S196-E198 VanDerWaalsContact C-N 3.31Å; S196-A199 PolarHBondContact O-N 2.75Å; S196-A199 WeakPolarHBondContact OG-CB 3.44Å; S196-A199 PolarHBondContact OG-N 3.21Å; S196-L200 PolarHBondContact O-N 3.07Å
197	E	91.8	Very high	94.3	Very high	132 Å²	132	76.6 Å²	76.6	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-66.1	-36.4	172.5	-172.9	164.9	-157.2	0	0	111.2	A199 L200 E201	E197-A199 VanDerWaalsContact C-N 3.34Å; E197-A199 PolarHBondContact O-N 2.7Å; E197-L200 WeakPolarHBondContact O-CB 3.45Å; E197-L200 PolarHBondContact O-N 3Å; E197-E201 PolarHBondContact O-N 2.74Å
198	E	94.3	Very high	94.4	Very high	142 Å²	142	78.3 Å²	78.3	66%	0.664	39%	0.388	S	S	*	.	H	α-helix	trans	-56.2	-45.1	174.9	-62.2	176.2	167.7	0	0	111.9	S196 L200 E201 E202	S196-E198 VanDerWaalsContact C-N 3.31Å; E198-L200 VanDerWaalsContact C-N 3.27Å; E198-L200 PolarHBondContact O-N 3.18Å; E198-E201 PolarHBondContact O-N 2.75Å; E198-E201 VanDerWaalsContact O-N 3.15Å; E198-E202 WeakPolarHBondContact O-CG 3.12Å; E198-E202 PolarHBondContact O-N 2.78Å
199	A	94.8	Very high	94.5	Very high	27 Å²	27	77.7 Å²	77.7	22%	0.223	39%	0.387	C	S	.	.	H	α-helix	trans	-64.6	-31.9	178.4	0	0	0	0	0	112.7	S196 E197 A203	S196-A199 PolarHBondContact O-N 2.75Å; S196-A199 WeakPolarHBondContact OG-CB 3.44Å; S196-A199 PolarHBondContact OG-N 3.21Å; E197-A199 VanDerWaalsContact C-N 3.34Å; E197-A199 PolarHBondContact O-N 2.7Å; A199-A203 VanDerWaalsContact O-CB 3.24Å; A199-A203 WeakPolarHBondContact O-CB 3.25Å; A199-A203 PolarHBondContact O-N 2.97Å; A199-A203 VanDerWaalsContact O-N 3.09Å
200	L	94.1	Very high	94.6	Very high	13 Å²	13	82 Å²	82	7%	0.068	41%	0.41	C	S	.	.	H	α-helix	trans	-69.6	-40.9	174.5	178.3	73.2	0	0	0	111.2	Y148 L149 W194 S196 E197 E198 A203 R204	Y148-L200 HydrophobicContact CD1-CD2 4.42Å; Y148-L200 WeakPolarHBondContact O-CD1 3.31Å; L149-L200 HydrophobicContact CB-CD1 4.03Å; L149-L200 HydrophobicContact CD1-CD1 3.95Å; L149-L200 HydrophobicContact CG-CD1 3.95Å; W194-L200 HydrophobicContact CB-CB 4.47Å; W194-L200 HydrophobicContact CD2-CD1 4.24Å; W194-L200 HydrophobicContact CG-CB 4.33Å; W194-L200 HydrophobicContact CG-CD1 4.14Å; S196-L200 PolarHBondContact O-N 3.07Å; E197-L200 WeakPolarHBondContact O-CB 3.45Å; E197-L200 PolarHBondContact O-N 3Å; E198-L200 VanDerWaalsContact C-N 3.27Å; E198-L200 PolarHBondContact O-N 3.18Å; L200-A203 PolarHBondContact O-N 3.26Å; L200-R204 PolarHBondContact O-N 2.95Å
201	E	93.9	Very high	94.6	Very high	102 Å²	102	87.8 Å²	87.8	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-65.9	-48.3	177.8	-70.4	-171.8	160.8	0	0	111.5	E197 E198 A203 R204 E205	E197-E201 PolarHBondContact O-N 2.74Å; E198-E201 PolarHBondContact O-N 2.75Å; E198-E201 VanDerWaalsContact O-N 3.15Å; E201-A203 VanDerWaalsContact C-N 3.28Å; E201-A203 PolarHBondContact O-N 3.15Å; E201-R204 WeakPolarHBondContact O-CA 3.13Å; E201-R204 VanDerWaalsContact O-CB 3.31Å; E201-R204 WeakPolarHBondContact O-CB 3.39Å; E201-R204 PolarHBondContact O-N 3.14Å; E201-E205 PolarHBondContact O-N 3.06Å
202	E	95.1	Very high	94.7	Very high	126 Å²	126	89.6 Å²	89.6	59%	0.589	44%	0.442	S	S	*	.	H	α-helix	trans	-56.5	-42.9	173.4	-70.1	178.8	177.3	0	0	111.5	E198 R204 E205 T206	E198-E202 WeakPolarHBondContact O-CG 3.12Å; E198-E202 PolarHBondContact O-N 2.78Å; E202-R204 PolarHBondContact O-N 2.89Å; E202-E205 PolarHBondContact O-N 3.17Å; E202-T206 WeakPolarHBondContact O-CB 3.21Å; E202-T206 VanDerWaalsContact O-CG2 3.25Å; E202-T206 WeakPolarHBondContact O-CG2 3.47Å; E202-T206 PolarHBondContact O-N 3.11Å; E202-T206 PolarHBondContact O-OG1 3.23Å
203	A	94.4	Very high	94.9	Very high	15 Å²	15	87.4 Å²	87.4	12%	0.124	44%	0.436	C	S	.	.	H	α-helix	trans	-65.7	-25.5	175.8	0	0	0	0	0	113.1	L149 W194 A199 L200 E201 T206 R207	L149-A203 HydrophobicContact CD1-CB 3.92Å; W194-A203 HydrophobicContact CE3-CB 4.23Å; W194-A203 HydrophobicContact CH2-CB 3.62Å; W194-A203 HydrophobicContact CZ2-CB 4.42Å; W194-A203 HydrophobicContact CZ3-CB 3.5Å; A199-A203 VanDerWaalsContact O-CB 3.24Å; A199-A203 WeakPolarHBondContact O-CB 3.25Å; A199-A203 PolarHBondContact O-N 2.97Å; A199-A203 VanDerWaalsContact O-N 3.09Å; L200-A203 PolarHBondContact O-N 3.26Å; E201-A203 VanDerWaalsContact C-N 3.28Å; E201-A203 PolarHBondContact O-N 3.15Å; A203-T206 WeakPolarHBondContact CA-OG1 3.45Å; A203-T206 PolarHBondContact O-OG1 2.69Å; A203-T206 VanDerWaalsContact O-OG1 3.12Å; A203-R207 VanDerWaalsContact O-CG 3.31Å; A203-R207 WeakPolarHBondContact O-CG 3.18Å; A203-R207 PolarHBondContact O-N 3.23Å
204	R	94.1	Very high	95	Very high	95 Å²	95	90.3 Å²	90.3	36%	0.358	45%	0.447	S	S	.	.	H	α-helix	trans	-77.8	-48.8	175.5	-172	-177.7	-72.9	166.7	0.7	110.6	R147 L149 L200 E201 E202 T206 R207 E208	R147-R204 PolarHBondContact O-NH2 2.93Å; L149-R204 HydrophobicContact CD1-CB 4.25Å; L200-R204 PolarHBondContact O-N 2.95Å; E201-R204 WeakPolarHBondContact O-CA 3.13Å; E201-R204 VanDerWaalsContact O-CB 3.31Å; E201-R204 WeakPolarHBondContact O-CB 3.39Å; E201-R204 PolarHBondContact O-N 3.14Å; E202-R204 PolarHBondContact O-N 2.89Å; R204-T206 PolarHBondContact O-N 2.84Å; R204-R207 WeakPolarHBondContact O-CB 3.46Å; R204-R207 PolarHBondContact O-N 3.01Å; R204-R207 VanDerWaalsContact O-N 3.1Å; R204-E208 PolarHBondContact O-N 3.01Å
205	E	95.5	Very high	95.1	Very high	121 Å²	121	92.7 Å²	92.7	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-57.7	-49.8	177.6	-68.7	-174.1	163.3	0	0	111	E201 E202 R207 E208 E209	E201-E205 PolarHBondContact O-N 3.06Å; E202-E205 PolarHBondContact O-N 3.17Å; E205-R207 PolarHBondContact O-N 3.43Å; E205-E208 WeakPolarHBondContact O-CA 3.35Å; E205-E208 PolarHBondContact O-N 2.99Å; E205-E209 WeakPolarHBondContact O-CG 3.42Å; E205-E209 PolarHBondContact O-N 3.2Å
206	T	95.9	Very high	95.3	Very high	65 Å²	65	95 Å²	95	40%	0.399	46%	0.455	S	S	.	.	H	α-helix	trans	-58.5	-34.1	176.6	53.5	0	0	0	0	112.8	E202 A203 R204 N210	E202-T206 WeakPolarHBondContact O-CB 3.21Å; E202-T206 VanDerWaalsContact O-CG2 3.25Å; E202-T206 WeakPolarHBondContact O-CG2 3.47Å; E202-T206 PolarHBondContact O-N 3.11Å; E202-T206 PolarHBondContact O-OG1 3.23Å; A203-T206 WeakPolarHBondContact CA-OG1 3.45Å; A203-T206 PolarHBondContact O-OG1 2.69Å; A203-T206 VanDerWaalsContact O-OG1 3.12Å; R204-T206 PolarHBondContact O-N 2.84Å; T206-N210 VanDerWaalsContact O-CB 3.27Å; T206-N210 WeakPolarHBondContact O-CB 3.31Å; T206-N210 VanDerWaalsContact O-CG 3.24Å; T206-N210 PolarHBondContact O-N 3.44Å; T206-N210 VanDerWaalsContact O-N 3.08Å; T206-N210 PolarHBondContact O-ND2 3.11Å
207	R	94.6	Very high	95.5	Very high	123 Å²	123	99.4 Å²	99.4	46%	0.464	47%	0.469	S	S	.	.	H	α-helix	trans	-70.2	-37.2	174.1	-81.6	-178	-175.6	-166.2	10.6	112.2	A203 R204 E205 K211	A203-R207 VanDerWaalsContact O-CG 3.31Å; A203-R207 WeakPolarHBondContact O-CG 3.18Å; A203-R207 PolarHBondContact O-N 3.23Å; R204-R207 WeakPolarHBondContact O-CB 3.46Å; R204-R207 PolarHBondContact O-N 3.01Å; R204-R207 VanDerWaalsContact O-N 3.1Å; E205-R207 PolarHBondContact O-N 3.43Å; R207-K211 WeakPolarHBondContact O-CB 3.4Å; R207-K211 PolarHBondContact O-N 3.48Å
208	E	94.9	Very high	95.8	Very high	115 Å²	115	101.2 Å²	101.2	54%	0.537	47%	0.47	S	S	.	.	H	α-helix	trans	-68.3	-48.3	177.9	-71.5	-176	-178.6	0	0	111.2	R204 E205 N210 K211 E212	R204-E208 PolarHBondContact O-N 3.01Å; E205-E208 WeakPolarHBondContact O-CA 3.35Å; E205-E208 PolarHBondContact O-N 2.99Å; E208-N210 VanDerWaalsContact C-N 3.33Å; E208-N210 PolarHBondContact O-N 2.79Å; E208-K211 WeakPolarHBondContact O-CA 3.24Å; E208-K211 VanDerWaalsContact O-CB 3.31Å; E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 2.76Å; E208-E212 WeakPolarHBondContact O-CG 3.18Å; E208-E212 PolarHBondContact O-N 3.42Å
209	E	96.8	Very high	96	Very high	119 Å²	119	100.3 Å²	100.3	56%	0.556	46%	0.464	S	S	*	.	H	α-helix	trans	-55.3	-48.1	173.4	-68.7	-179.1	162.5	0	0	111.4	E205 K211 E212 V213	E205-E209 WeakPolarHBondContact O-CG 3.42Å; E205-E209 PolarHBondContact O-N 3.2Å; E209-K211 VanDerWaalsContact C-N 3.27Å; E209-K211 PolarHBondContact O-N 3Å; E209-E212 PolarHBondContact O-N 3.39Å; E209-E212 VanDerWaalsContact O-N 3.14Å; E209-V213 WeakPolarHBondContact O-CG2 3.41Å; E209-V213 PolarHBondContact O-N 3.23Å
210	N	96.5	Very high	96.1	Very high	94 Å²	94	102.7 Å²	102.7	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-37.2	177.5	-82.9	-50.5	0	0	0	112.2	T206 E208 Q214	T206-N210 VanDerWaalsContact O-CB 3.27Å; T206-N210 WeakPolarHBondContact O-CB 3.31Å; T206-N210 VanDerWaalsContact O-CG 3.24Å; T206-N210 PolarHBondContact O-N 3.44Å; T206-N210 VanDerWaalsContact O-N 3.08Å; T206-N210 PolarHBondContact O-ND2 3.11Å; E208-N210 VanDerWaalsContact C-N 3.33Å; E208-N210 PolarHBondContact O-N 2.79Å; N210-Q214 WeakPolarHBondContact O-CB 3.4Å; N210-Q214 WeakPolarHBondContact O-CG 3.23Å; N210-Q214 PolarHBondContact O-N 3.34Å
211	K	96.3	Very high	96.3	Very high	128 Å²	128	108.1 Å²	108.1	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-66.7	-39.9	176.6	-172	-179.3	-177.5	-177.8	0	111	R207 E208 E209 Q214 K215	R207-K211 WeakPolarHBondContact O-CB 3.4Å; R207-K211 PolarHBondContact O-N 3.48Å; E208-K211 WeakPolarHBondContact O-CA 3.24Å; E208-K211 VanDerWaalsContact O-CB 3.31Å; E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 2.76Å; E209-K211 VanDerWaalsContact C-N 3.27Å; E209-K211 PolarHBondContact O-N 3Å; K211-Q214 PolarHBondContact O-N 3.08Å; K211-K215 VanDerWaalsContact O-CG 3.3Å; K211-K215 WeakPolarHBondContact O-CG 3.41Å; K211-K215 PolarHBondContact O-N 3.44Å
212	E	96.8	Very high	96.4	Very high	130 Å²	130	110.3 Å²	110.3	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-65.9	-47.7	175.2	-68.1	-172.4	165.1	0	0	112	E208 E209 Q214 K215 Q216	E208-E212 WeakPolarHBondContact O-CG 3.18Å; E208-E212 PolarHBondContact O-N 3.42Å; E209-E212 PolarHBondContact O-N 3.39Å; E209-E212 VanDerWaalsContact O-N 3.14Å; E212-Q214 VanDerWaalsContact C-N 3.27Å; E212-Q214 PolarHBondContact O-N 3Å; E212-K215 WeakPolarHBondContact O-CB 3.38Å; E212-K215 PolarHBondContact O-N 3.44Å; E212-K215 VanDerWaalsContact O-N 3.09Å; E212-Q216 PolarHBondContact O-N 3.06Å
213	V	97.3	Very high	96.5	Very high	68 Å²	68	106.3 Å²	106.3	41%	0.412	49%	0.488	S	S	.	.	H	α-helix	trans	-57.3	-42.5	174.6	171.7	0	0	0	0	110.7	E209 Q216 K217	E209-V213 WeakPolarHBondContact O-CG2 3.41Å; E209-V213 PolarHBondContact O-N 3.23Å; V213-Q216 PolarHBondContact O-N 3.39Å; V213-K217 HydrophobicContact CG1-CD 4Å; V213-K217 HydrophobicContact CG1-CG 4.47Å; V213-K217 WeakPolarHBondContact O-CB 3.35Å; V213-K217 VanDerWaalsContact O-CG 3.28Å; V213-K217 WeakPolarHBondContact O-CG 3.5Å; V213-K217 PolarHBondContact O-N 2.95Å
214	Q	96.8	Very high	96.6	Very high	103 Å²	103	114 Å²	114	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-40.3	176.1	-76.1	-178.3	15.4	0	0	112.7	N210 K211 E212 K217 R218	N210-Q214 WeakPolarHBondContact O-CB 3.4Å; N210-Q214 WeakPolarHBondContact O-CG 3.23Å; N210-Q214 PolarHBondContact O-N 3.34Å; K211-Q214 PolarHBondContact O-N 3.08Å; E212-Q214 VanDerWaalsContact C-N 3.27Å; E212-Q214 PolarHBondContact O-N 3Å; Q214-K217 PolarHBondContact O-N 2.91Å; Q214-R218 WeakPolarHBondContact O-CB 3.41Å; Q214-R218 VanDerWaalsContact O-CG 3.24Å; Q214-R218 WeakPolarHBondContact O-CG 3.46Å; Q214-R218 PolarHBondContact O-N 3.32Å
215	K	97.3	Very high	96.6	Very high	126 Å²	126	114.1 Å²	114.1	55%	0.548	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-46.3	173.8	-75.1	171.7	-178.2	176.1	0	110.7	K211 E212 K217 R218 F219	K211-K215 VanDerWaalsContact O-CG 3.3Å; K211-K215 WeakPolarHBondContact O-CG 3.41Å; K211-K215 PolarHBondContact O-N 3.44Å; E212-K215 WeakPolarHBondContact O-CB 3.38Å; E212-K215 PolarHBondContact O-N 3.44Å; E212-K215 VanDerWaalsContact O-N 3.09Å; K215-K217 PolarHBondContact O-N 2.92Å; K215-R218 PolarHBondContact O-N 3.5Å; K215-F219 PolarHBondContact O-N 3.36Å
216	Q	96.9	Very high	96.6	Very high	105 Å²	105	113.7 Å²	113.7	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-44.6	178.2	-170.1	61.3	25.6	0	0	111.6	E212 V213 R218 F219 N220	E212-Q216 PolarHBondContact O-N 3.06Å; V213-Q216 PolarHBondContact O-N 3.39Å; Q216-R218 VanDerWaalsContact C-N 3.35Å; Q216-R218 PolarHBondContact O-N 3.32Å; Q216-F219 PolarHBondContact O-N 3.47Å; Q216-N220 PolarHBondContact NE2-OD1 3.15Å; Q216-N220 WeakPolarHBondContact O-CB 3.29Å; Q216-N220 VanDerWaalsContact O-CG 3.29Å; Q216-N220 PolarHBondContact O-N 3.23Å
217	K	97.7	Very high	96.4	Very high	139 Å²	139	118.7 Å²	118.7	60%	0.604	53%	0.531	S	S	*	.	H	α-helix	trans	-60.2	-42.9	175.1	-75.5	174.7	-179.8	175.2	0	111.9	V213 Q214 K215 N220 K221	V213-K217 HydrophobicContact CG1-CD 4Å; V213-K217 HydrophobicContact CG1-CG 4.47Å; V213-K217 WeakPolarHBondContact O-CB 3.35Å; V213-K217 VanDerWaalsContact O-CG 3.28Å; V213-K217 WeakPolarHBondContact O-CG 3.5Å; V213-K217 PolarHBondContact O-N 2.95Å; Q214-K217 PolarHBondContact O-N 2.91Å; K215-K217 PolarHBondContact O-N 2.92Å; K217-N220 PolarHBondContact O-N 3.02Å; K217-K221 WeakPolarHBondContact O-CB 3.49Å; K217-K221 PolarHBondContact O-N 3.34Å
218	R	97.8	Very high	96.2	Very high	169 Å²	169	121.1 Å²	121.1	64%	0.638	54%	0.54	S	S	*	.	H	α-helix	trans	-63.4	-42.5	176.1	-74.1	174.1	-171.6	-163	4.8	111.7	Q214 K215 Q216 K221 K222	Q214-R218 WeakPolarHBondContact O-CB 3.41Å; Q214-R218 VanDerWaalsContact O-CG 3.24Å; Q214-R218 WeakPolarHBondContact O-CG 3.46Å; Q214-R218 PolarHBondContact O-N 3.32Å; K215-R218 PolarHBondContact O-N 3.5Å; Q216-R218 VanDerWaalsContact C-N 3.35Å; Q216-R218 PolarHBondContact O-N 3.32Å; R218-K221 PolarHBondContact O-N 2.86Å; R218-K222 WeakPolarHBondContact O-CG 3.4Å; R218-K222 PolarHBondContact O-N 2.75Å
219	F	97.9	Very high	96	Very high	123 Å²	123	118.2 Å²	118.2	54%	0.539	54%	0.536	S	S	.	.	H	α-helix	trans	-63	-50.8	176	179.5	-99.4	0	0	0	111.5	K215 Q216 K221 K222 V223	K215-F219 PolarHBondContact O-N 3.36Å; Q216-F219 PolarHBondContact O-N 3.47Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 3.22Å; F219-K222 WeakPolarHBondContact O-CB 3.35Å; F219-K222 PolarHBondContact O-N 2.78Å; F219-K222 VanDerWaalsContact O-N 3.07Å; F219-V223 HydrophobicContact CD1-CG2 4.19Å; F219-V223 HydrophobicContact CE1-CG2 3.77Å; F219-V223 HydrophobicContact CE2-CG2 4.33Å; F219-V223 HydrophobicContact CZ-CG2 3.85Å; F219-V223 WeakPolarHBondContact O-CG2 3.43Å; F219-V223 PolarHBondContact O-N 2.9Å
220	N	97.2	Very high	95.7	Very high	77 Å²	77	116.5 Å²	116.5	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-58.5	-38	177.4	-72.8	-14.4	0	0	0	112.3	Q216 K217 V223 R224	Q216-N220 PolarHBondContact NE2-OD1 3.15Å; Q216-N220 WeakPolarHBondContact O-CB 3.29Å; Q216-N220 VanDerWaalsContact O-CG 3.29Å; Q216-N220 PolarHBondContact O-N 3.23Å; K217-N220 PolarHBondContact O-N 3.02Å; N220-V223 PolarHBondContact O-N 2.92Å; N220-R224 WeakPolarHBondContact O-CB 3.24Å; N220-R224 PolarHBondContact O-N 2.87Å
221	K	97.8	Very high	95.1	Very high	128 Å²	128	120.2 Å²	120.2	56%	0.557	54%	0.54	S	S	*	.	H	α-helix	trans	-61.5	-48.5	173.9	-178.5	177.1	172.2	179.7	0	111.4	K217 R218 F219 V223 R224 E225	K217-K221 WeakPolarHBondContact O-CB 3.49Å; K217-K221 PolarHBondContact O-N 3.34Å; R218-K221 PolarHBondContact O-N 2.86Å; F219-K221 VanDerWaalsContact C-N 3.26Å; F219-K221 PolarHBondContact O-N 3.22Å; K221-V223 VanDerWaalsContact C-N 3.34Å; K221-V223 PolarHBondContact O-N 3.09Å; K221-R224 PolarHBondContact O-N 3.4Å; K221-E225 WeakPolarHBondContact CE-OE1 3.41Å; K221-E225 IonicContact NZ-OE1 3.96Å; K221-E225 WeakPolarHBondContact O-CG 3.19Å; K221-E225 PolarHBondContact O-N 3.21Å
222	K	97.4	Very high	94.1	Very high	147 Å²	147	117.6 Å²	117.6	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-59.6	-42.8	176.7	-73.6	178.1	174	-174	0	112.2	R218 F219 R224 E225 L226	R218-K222 WeakPolarHBondContact O-CG 3.4Å; R218-K222 PolarHBondContact O-N 2.75Å; F219-K222 WeakPolarHBondContact O-CB 3.35Å; F219-K222 PolarHBondContact O-N 2.78Å; F219-K222 VanDerWaalsContact O-N 3.07Å; K222-R224 VanDerWaalsContact C-N 3.34Å; K222-R224 PolarHBondContact O-N 2.77Å; K222-E225 PolarHBondContact O-N 2.89Å; K222-L226 WeakPolarHBondContact O-CB 3.31Å; K222-L226 PolarHBondContact O-N 2.96Å
223	V	97.3	Very high	92.8	Very high	43 Å²	43	115.5 Å²	115.5	26%	0.261	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-41.9	176.3	173.8	0	0	0	0	111.2	F219 N220 K221 L226 R227	F219-V223 HydrophobicContact CD1-CG2 4.19Å; F219-V223 HydrophobicContact CE1-CG2 3.77Å; F219-V223 HydrophobicContact CE2-CG2 4.33Å; F219-V223 HydrophobicContact CZ-CG2 3.85Å; F219-V223 WeakPolarHBondContact O-CG2 3.43Å; F219-V223 PolarHBondContact O-N 2.9Å; N220-V223 PolarHBondContact O-N 2.92Å; K221-V223 VanDerWaalsContact C-N 3.34Å; K221-V223 PolarHBondContact O-N 3.09Å; V223-L226 PolarHBondContact O-N 3.31Å; V223-R227 WeakPolarHBondContact O-CB 3.48Å; V223-R227 VanDerWaalsContact O-CG 3.31Å; V223-R227 WeakPolarHBondContact O-CG 3.4Å; V223-R227 PolarHBondContact O-N 3.02Å
224	R	95.8	Very high	91.3	Very high	176 Å²	176	117.7 Å²	117.7	66%	0.664	55%	0.552	S	S	*	*	H	α-helix	trans	-64.5	-41.9	177	-173.5	-176.6	-67.2	160.5	-2.6	112	N220 K221 K222 R227 R228	N220-R224 WeakPolarHBondContact O-CB 3.24Å; N220-R224 PolarHBondContact O-N 2.87Å; K221-R224 PolarHBondContact O-N 3.4Å; K222-R224 VanDerWaalsContact C-N 3.34Å; K222-R224 PolarHBondContact O-N 2.77Å; R224-R227 PolarHBondContact O-N 2.86Å; R224-R228 PolarHBondContact O-N 3.09Å
225	E	95.1	Very high	89.6	Confident	97 Å²	97	120.4 Å²	120.4	45%	0.453	56%	0.558	S	S	.	*	H	α-helix	trans	-63.2	-45.3	175.5	-75.5	170.8	-179.7	0	0	111.4	K221 K222 R227 R228 A229	K221-E225 WeakPolarHBondContact CE-OE1 3.41Å; K221-E225 IonicContact NZ-OE1 3.96Å; K221-E225 WeakPolarHBondContact O-CG 3.19Å; K221-E225 PolarHBondContact O-N 3.21Å; K222-E225 PolarHBondContact O-N 2.89Å; E225-R227 PolarHBondContact O-N 2.84Å; E225-R228 WeakPolarHBondContact O-CB 3.28Å; E225-R228 PolarHBondContact O-N 2.88Å; E225-R228 VanDerWaalsContact O-N 3.14Å; E225-A229 PolarHBondContact O-N 3.02Å
226	L	94.6	Very high	88	Confident	113 Å²	113	119.6 Å²	119.6	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-58.5	-47.2	174.9	-179	64.1	0	0	0	111.6	K222 V223 R228 A229 V230	K222-L226 WeakPolarHBondContact O-CB 3.31Å; K222-L226 PolarHBondContact O-N 2.96Å; V223-L226 PolarHBondContact O-N 3.31Å; L226-R228 VanDerWaalsContact C-N 3.28Å; L226-R228 PolarHBondContact O-N 3.43Å; L226-A229 PolarHBondContact O-N 2.91Å; L226-V230 HydrophobicContact CD1-CG2 4.49Å; L226-V230 WeakPolarHBondContact O-CG2 3.34Å; L226-V230 PolarHBondContact O-N 2.85Å
227	R	92.3	Very high	86.3	Confident	169 Å²	169	120.9 Å²	120.9	64%	0.638	57%	0.567	S	S	*	*	H	α-helix	trans	-59.8	-38.6	175.9	-74.4	176.2	-178.2	-170.7	1.3	112.1	V223 R224 E225 R231	V223-R227 WeakPolarHBondContact O-CB 3.48Å; V223-R227 VanDerWaalsContact O-CG 3.31Å; V223-R227 WeakPolarHBondContact O-CG 3.4Å; V223-R227 PolarHBondContact O-N 3.02Å; R224-R227 PolarHBondContact O-N 2.86Å; E225-R227 PolarHBondContact O-N 2.84Å; R227-R231 VanDerWaalsContact O-CB 3.3Å; R227-R231 WeakPolarHBondContact O-CB 3.38Å; R227-R231 PolarHBondContact O-N 3.26Å
228	R	90.3	Very high	84.5	Confident	175 Å²	175	121.6 Å²	121.6	66%	0.66	58%	0.578	S	S	*	*	H	α-helix	trans	-65.1	-46.5	176.6	-177.3	-178.4	-72.6	171.1	-5.8	110.8	R224 E225 L226 R231 S232	R224-R228 PolarHBondContact O-N 3.09Å; E225-R228 WeakPolarHBondContact O-CB 3.28Å; E225-R228 PolarHBondContact O-N 2.88Å; E225-R228 VanDerWaalsContact O-N 3.14Å; L226-R228 VanDerWaalsContact C-N 3.28Å; L226-R228 PolarHBondContact O-N 3.43Å; R228-R231 PolarHBondContact O-N 3.05Å; R228-S232 PolarHBondContact O-N 3.08Å; R228-S232 PolarHBondContact O-OG 2.83Å
229	A	90.8	Very high	82.9	Confident	54 Å²	54	119.7 Å²	119.7	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-60	-47.2	179.3	0	0	0	0	0	112.1	E225 L226 R231 S232 S233	E225-A229 PolarHBondContact O-N 3.02Å; L226-A229 PolarHBondContact O-N 2.91Å; A229-R231 VanDerWaalsContact C-N 3.34Å; A229-R231 PolarHBondContact O-N 2.57Å; A229-S232 WeakPolarHBondContact CA-OG 3.15Å; A229-S232 PolarHBondContact O-N 2.84Å; A229-S232 PolarHBondContact O-OG 2.89Å; A229-S233 PolarHBondContact O-N 3.16Å; A229-S233 PolarHBondContact O-OG 3.4Å
230	V	90.4	Very high	81.5	Confident	82 Å²	82	118.8 Å²	118.8	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-63.8	-38.9	176.9	174.9	0	0	0	0	111.6	L226 S233 T234	L226-V230 HydrophobicContact CD1-CG2 4.49Å; L226-V230 WeakPolarHBondContact O-CG2 3.34Å; L226-V230 PolarHBondContact O-N 2.85Å; V230-S233 WeakPolarHBondContact CA-OG 3.38Å; V230-S233 PolarHBondContact O-N 3.12Å; V230-S233 PolarHBondContact O-OG 3.33Å; V230-T234 PolarHBondContact O-N 2.94Å; V230-T234 PolarHBondContact O-OG1 3.37Å; V230-T234 VanDerWaalsContact O-OG1 3.06Å
231	R	84.3	Confident	80.2	Confident	172 Å²	172	119 Å²	119	65%	0.649	61%	0.606	S	S	*	*	H	α-helix	trans	-68.2	-37.9	177.5	-168.6	-178.5	-64.6	150.8	-3.1	112	R227 R228 A229 T234 W235	R227-R231 VanDerWaalsContact O-CB 3.3Å; R227-R231 WeakPolarHBondContact O-CB 3.38Å; R227-R231 PolarHBondContact O-N 3.26Å; R228-R231 PolarHBondContact O-N 3.05Å; A229-R231 VanDerWaalsContact C-N 3.34Å; A229-R231 PolarHBondContact O-N 2.57Å; R231-T234 PolarHBondContact O-OG1 3.27Å; R231-W235 WeakPolarHBondContact O-CB 3.5Å; R231-W235 PolarHBondContact O-N 2.66Å
232	S	74.4	Confident	79.2	Confident	74 Å²	74	116.8 Å²	116.8	52%	0.517	60%	0.598	S	S	.	*	H	α-helix	trans	-70	-31	176.2	47.3	0	0	0	0	113.2	R228 A229	R228-S232 PolarHBondContact O-N 3.08Å; R228-S232 PolarHBondContact O-OG 2.83Å; A229-S232 WeakPolarHBondContact CA-OG 3.15Å; A229-S232 PolarHBondContact O-N 2.84Å; A229-S232 PolarHBondContact O-OG 2.89Å
233	S	69.6	Low	78.2	Confident	85 Å²	85	117.9 Å²	117.9	59%	0.594	61%	0.605	S	S	*	*	H	α-helix	trans	-74.2	-30.4	177.7	56.3	0	0	0	0	113.3	A229 V230	A229-S233 PolarHBondContact O-N 3.16Å; A229-S233 PolarHBondContact O-OG 3.4Å; V230-S233 WeakPolarHBondContact CA-OG 3.38Å; V230-S233 PolarHBondContact O-N 3.12Å; V230-S233 PolarHBondContact O-OG 3.33Å
234	T	65.6	Low	77.3	Confident	115 Å²	115	119.4 Å²	119.4	71%	0.706	61%	0.609	S	S	*	*	H	α-helix	trans	-91.1	-17.4	177.6	51.6	0	0	0	0	113.5	V230 R231	V230-T234 PolarHBondContact O-N 2.94Å; V230-T234 PolarHBondContact O-OG1 3.37Å; V230-T234 VanDerWaalsContact O-OG1 3.06Å; R231-T234 PolarHBondContact O-OG1 3.27Å
235	W	62.2	Low	76.6	Confident	160 Å²	160	117.6 Å²	117.6	61%	0.606	61%	0.608	S	S	*	*			trans	-115.1	56.6	-175.9	-159.7	83.9	0	0	0	111.6	R231 K237	R231-W235 WeakPolarHBondContact O-CB 3.5Å; R231-W235 PolarHBondContact O-N 2.66Å; W235-K237 HydrophobicContact CD2-CG 4.18Å; W235-K237 HydrophobicContact CE3-CG 4.42Å; W235-K237 HydrophobicContact CH2-CD 3.57Å; W235-K237 HydrophobicContact CH2-CG 4.21Å; W235-K237 HydrophobicContact CZ2-CD 3.46Å; W235-K237 VanDerWaalsContact CZ2-CD 3.46Å; W235-K237 HydrophobicContact CZ2-CG 3.97Å; W235-K237 VanDerWaalsContact CZ2-NZ 3.28Å; W235-K237 HydrophobicContact CZ3-CD 4.16Å; W235-K237 HydrophobicContact CZ3-CG 4.4Å; W235-K237 PolarHBondContact O-N 2.9Å
236	T	63.3	Low	76	Confident	108 Å²	108	116.6 Å²	116.6	66%	0.663	60%	0.601	S	S	*	*			trans	-81.7	91.5	157.8	52	0	0	0	0	107.1	N238	T236-N238 PolarHBondContact O-N 3.04Å; T236-N238 VanDerWaalsContact O-N 3.09Å
237	K	61.1	Low	75.1	Confident	132 Å²	132	112.5 Å²	112.5	57%	0.574	59%	0.586	S	S	*	*			trans	-58	117.8	161.5	-79.6	-177	168	173.3	0	106.2	W235 T239	W235-K237 HydrophobicContact CD2-CG 4.18Å; W235-K237 HydrophobicContact CE3-CG 4.42Å; W235-K237 HydrophobicContact CH2-CD 3.57Å; W235-K237 HydrophobicContact CH2-CG 4.21Å; W235-K237 HydrophobicContact CZ2-CD 3.46Å; W235-K237 VanDerWaalsContact CZ2-CD 3.46Å; W235-K237 HydrophobicContact CZ2-CG 3.97Å; W235-K237 VanDerWaalsContact CZ2-NZ 3.28Å; W235-K237 HydrophobicContact CZ3-CD 4.16Å; W235-K237 HydrophobicContact CZ3-CG 4.4Å; W235-K237 PolarHBondContact O-N 2.9Å; K237-T239 HydrophobicContact CB-CG2 4.4Å; K237-T239 PolarHBondContact O-N 3.26Å
238	N	60.1	Low	74.2	Confident	154 Å²	154	112.1 Å²	112.1	82%	0.824	60%	0.596	S	S	*	*			trans	-61.7	90.9	167.8	-85.9	-30.7	0	0	0	107.4	T236 S240	T236-N238 PolarHBondContact O-N 3.04Å; T236-N238 VanDerWaalsContact O-N 3.09Å; N238-S240 PolarHBondContact O-N 3.18Å
239	T	63.2	Low	73.5	Confident	129 Å²	129	107.8 Å²	107.8	79%	0.791	58%	0.583	S	S	*	*			trans	-81.7	30.4	168.8	57.9	0	0	0	0	110.3	K237 A241	K237-T239 HydrophobicContact CB-CG2 4.4Å; K237-T239 PolarHBondContact O-N 3.26Å; T239-A241 PolarHBondContact O-N 2.8Å
240	S	68.9	Low	72.8	Confident	104 Å²	104	110.7 Å²	110.7	73%	0.727	59%	0.587	S	S	*	*			trans	-67.2	93.9	163.8	-175.5	0	0	0	0	105.6	N238 H242	N238-S240 PolarHBondContact O-N 3.18Å; S240-H242 PolarHBondContact O-N 3.09Å
241	A	68.9	Low	72	Confident	81 Å²	81	110.8 Å²	110.8	67%	0.669	59%	0.588	S	S	*	*			trans	-58.1	125.2	166.1	0	0	0	0	0	106.2	T239 Q243	T239-A241 PolarHBondContact O-N 2.8Å; A241-Q243 PolarHBondContact O-N 2.91Å
242	H	76.9	Confident	71.5	Confident	82 Å²	82	106.3 Å²	106.3	38%	0.38	58%	0.58	S	S	.	*			trans	-54.4	116.1	176.6	177.6	56.8	0	0	0	108.9	S240 H244 T265 C266	S240-H242 PolarHBondContact O-N 3.09Å; H242-H244 AromaticContact CD2-CE1 3.71Å; H242-H244 AromaticContact CD2-ND1 3.56Å; H242-H244 PolarHBondContact O-N 2.74Å; H242-T265 WeakPolarHBondContact CE1-CB 3.29Å; H242-T265 PolarHBondContact CE1-OG1 3Å; H242-T265 PolarHBondContact NE2-OG1 3.23Å; H242-C266 PolarHBondContact CD2-SG 3.1Å; H242-C266 WeakPolarHBondContact NE2-CB 3.37Å
243	Q	77.6	Confident	71.4	Confident	171 Å²	171	106.5 Å²	106.5	80%	0.799	58%	0.575	S	S	*	*			trans	-75.1	114.7	172	-75	-177	-14.4	0	0	107.5	A241 E245	A241-Q243 PolarHBondContact O-N 2.91Å; Q243-E245 PolarHBondContact O-N 2.87Å
244	H	78.8	Confident	71.3	Confident	75 Å²	75	107.2 Å²	107.2	35%	0.347	58%	0.578	S	S	.	*			trans	-75.7	112.4	-179.1	-65.6	-82.7	0	0	0	110.3	H242 Y246 C263 C266 H268	H242-H244 AromaticContact CD2-CE1 3.71Å; H242-H244 AromaticContact CD2-ND1 3.56Å; H242-H244 PolarHBondContact O-N 2.74Å; H244-Y246 HydrophobicContact CB-CD2 4.12Å; H244-Y246 HydrophobicContact CB-CE1 4.4Å; H244-Y246 HydrophobicContact CB-CE2 3.43Å; H244-Y246 VanDerWaalsContact CB-CE2 3.43Å; H244-C263 WeakPolarHBondContact CA-SG 3.26Å; H244-C263 HydrophobicContact CB-CB 4.15Å; H244-C266 PolarHBondContact CE1-SG 3.35Å; H244-C266 PolarHBondContact ND1-SG 2.97Å; H244-H268 WeakPolarHBondContact CE1-CB 3.28Å; H244-H268 AromaticContact CE1-CG 3.7Å; H244-H268 WeakPolarHBondContact ND1-CB 3.32Å
245	E	79.4	Confident	71.4	Confident	138 Å²	138	110.8 Å²	110.8	65%	0.645	59%	0.586	S	S	*	*			trans	-88.4	108.2	163.9	-71.2	-178.6	-176.3	0	0	108.4	Q243 C263 T264	Q243-E245 PolarHBondContact O-N 2.87Å; E245-C263 VanDerWaalsContact O-CA 3.27Å; E245-C263 WeakPolarHBondContact O-CA 3.45Å; E245-C263 PolarHBondContact O-SG 2.63Å; E245-C263 VanDerWaalsContact O-SG 3.35Å; E245-T264 PolarHBondContact O-N 3.08Å; E245-T264 PolarHBondContact O-OG1 3.49Å
246	Y	83.1	Confident	71.5	Confident	75 Å²	75	109.5 Å²	109.5	29%	0.294	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.3	128.8	179.1	-70.2	-77.1	0	0	0	110.6	H244 K261 C263 H268 L270	H244-Y246 HydrophobicContact CB-CD2 4.12Å; H244-Y246 HydrophobicContact CB-CE1 4.4Å; H244-Y246 HydrophobicContact CB-CE2 3.43Å; H244-Y246 VanDerWaalsContact CB-CE2 3.43Å; Y246-K261 HydrophobicContact CD1-CB 3.85Å; Y246-K261 HydrophobicContact CG-CB 4.19Å; Y246-C263 HydrophobicContact CD1-CB 4.1Å; Y246-C263 HydrophobicContact CE1-CB 3.97Å; Y246-H268 AromaticContact CE1-ND1 3.91Å; Y246-H268 AromaticContact CZ-ND1 3.87Å; Y246-H268 PolarHBondContact OH-ND1 2.78Å; Y246-L270 HydrophobicContact CD1-CB 4.43Å; Y246-L270 HydrophobicContact CD1-CD1 4.38Å; Y246-L270 HydrophobicContact CD2-CD1 4.2Å; Y246-L270 HydrophobicContact CE1-CB 3.9Å; Y246-L270 HydrophobicContact CE1-CD1 3.68Å; Y246-L270 HydrophobicContact CE1-CG 3.86Å; Y246-L270 HydrophobicContact CE2-CD1 3.45Å; Y246-L270 VanDerWaalsContact CE2-CD1 3.45Å; Y246-L270 HydrophobicContact CE2-CG 4.47Å; Y246-L270 WeakPolarHBondContact OH-CD1 3.06Å
247	G	75.9	Confident	72.2	Confident	27 Å²	27	108.2 Å²	108.2	28%	0.278	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.7	-158	178.5	0	0	0	0	0	113.4	T262	G247-T262 PolarHBondContact N-O 3.37Å
248	L	73	Confident	73.1	Confident	161 Å²	161	104 Å²	104	84%	0.843	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.2	143.6	-178	-66.8	169.3	0	0	0	112
249	E	76.6	Confident	74.1	Confident	84 Å²	84	98.8 Å²	98.8	39%	0.393	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.8	179.2	-71.7	172.7	-167.4	0	0	110.6	K261 Y272 K274	E249-K261 HydrophobicContact CG-CD 4.08Å; E249-K261 HydrophobicContact CG-CG 3.74Å; E249-K261 WeakPolarHBondContact OE1-CE 3.5Å; E249-K261 IonicContact OE1-NZ 2.67Å; E249-K261 PolarHBondContact OE1-NZ 2.8Å; E249-Y272 PolarHBondContact OE1-OH 3.26Å; E249-Y272 VanDerWaalsContact OE1-OH 3.13Å; E249-Y272 PolarHBondContact OE2-OH 3.44Å; E249-K274 WeakPolarHBondContact OE2-CE 3.31Å; E249-K274 IonicContact OE2-NZ 2.65Å; E249-K274 PolarHBondContact OE2-NZ 2.96Å
250	E	74.7	Confident	75.3	Confident	115 Å²	115	94.7 Å²	94.7	54%	0.537	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.3	172.6	-66.9	-180	173.2	0	0	109.1	K260	E250-K260 PolarHBondContact N-O 2.82Å; E250-K260 PolarHBondContact O-N 2.86Å
251	V	74.9	Confident	76	Confident	84 Å²	84	92.3 Å²	92.3	51%	0.509	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.6	172.5	-177.3	0	0	0	0	107.3	P254 Y259	V251-P254 HydrophobicContact CG1-CB 4.22Å; V251-Y259 HydrophobicContact CG2-CD1 3.98Å; V251-Y259 HydrophobicContact CG2-CE1 3.71Å
252	V	74.2	Confident	76.8	Confident	78 Å²	78	90.6 Å²	90.6	47%	0.473	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-47.2	179.6	-178.9	0	0	0	0	109.6	L258 K260	V252-L258 PolarHBondContact N-O 3.04Å; V252-L258 VanDerWaalsContact N-O 3.1Å; V252-K260 HydrophobicContact CG2-CB 3.64Å; V252-K260 HydrophobicContact CG2-CD 4.29Å
253	D	71.1	Confident	77.2	Confident	79 Å²	79	86.9 Å²	86.9	42%	0.422	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	116.7	177.4	-76.5	-55.7	0	0	0	110.8	D257 L258	D253-D257 PolarHBondContact O-N 3.07Å; D253-L258 PolarHBondContact O-N 3.49Å
254	P	66.9	Low	77.2	Confident	100 Å²	100	83.5 Å²	83.5	65%	0.649	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.6	-177.1	30.7	-34.6	0	0	0	114.3	V251	V251-P254 HydrophobicContact CG1-CB 4.22Å
255	E	68.3	Low	77.2	Confident	189 Å²	189	84 Å²	84	88%	0.883	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-21.3	177.4	-62.7	-160.8	159	0	0	113.2
256	E	65.3	Low	77.3	Confident	133 Å²	133	80.6 Å²	80.6	62%	0.621	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	9	-179.3	-63.6	-167.8	166.7	0	0	113	L258	E256-L258 HydrophobicContact CB-CD1 3.82Å; E256-L258 HydrophobicContact CB-CG 4.2Å; E256-L258 PolarHBondContact O-N 2.8Å; E256-L258 WeakPolarHBondContact OE2-CD1 3.43Å
257	D	77.2	Confident	77.1	Confident	82 Å²	82	79.6 Å²	79.6	44%	0.439	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	35.5	-178.6	-77	-49	0	0	0	114.6	D253 Y259 E273 K274	D253-D257 PolarHBondContact O-N 3.07Å; D257-Y259 HydrophobicContact CB-CE2 4.35Å; D257-Y259 WeakPolarHBondContact O-CD2 3.38Å; D257-Y259 VanDerWaalsContact O-CE2 3.27Å; D257-Y259 WeakPolarHBondContact O-CE2 2.99Å; D257-E273 WeakPolarHBondContact O-CA 3.37Å; D257-K274 PolarHBondContact O-N 3.06Å
258	L	80.4	Confident	77.4	Confident	42 Å²	42	82.3 Å²	82.3	22%	0.22	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.8	-178.6	-77.5	161.5	0	0	0	112.2	V252 D253 E256 E273	V252-L258 PolarHBondContact N-O 3.04Å; V252-L258 VanDerWaalsContact N-O 3.1Å; D253-L258 PolarHBondContact O-N 3.49Å; E256-L258 HydrophobicContact CB-CD1 3.82Å; E256-L258 HydrophobicContact CB-CG 4.2Å; E256-L258 PolarHBondContact O-N 2.8Å; E256-L258 WeakPolarHBondContact OE2-CD1 3.43Å; L258-E273 HydrophobicContact CD2-CG 3.62Å; L258-E273 HydrophobicContact CG-CG 4.23Å
259	Y	81.6	Confident	78	Confident	46 Å²	46	79.8 Å²	79.8	18%	0.18	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142	179.4	-61.6	-98	0	0	0	111.3	V251 D257 T271 Y272 K274	V251-Y259 HydrophobicContact CG2-CD1 3.98Å; V251-Y259 HydrophobicContact CG2-CE1 3.71Å; D257-Y259 HydrophobicContact CB-CE2 4.35Å; D257-Y259 WeakPolarHBondContact O-CD2 3.38Å; D257-Y259 VanDerWaalsContact O-CE2 3.27Å; D257-Y259 WeakPolarHBondContact O-CE2 2.99Å; Y259-T271 CarbonylContact O-C 3.57Å; Y259-T271 WeakPolarHBondContact O-CA 3.35Å; Y259-Y272 PolarHBondContact N-O 2.75Å; Y259-Y272 PolarHBondContact O-N 3.03Å; Y259-K274 HydrophobicContact CD1-CD 4.5Å; Y259-K274 HydrophobicContact CD2-CB 4.01Å; Y259-K274 HydrophobicContact CD2-CD 3.93Å; Y259-K274 HydrophobicContact CD2-CG 3.73Å; Y259-K274 HydrophobicContact CE1-CD 4.31Å; Y259-K274 HydrophobicContact CE2-CB 3.72Å; Y259-K274 HydrophobicContact CE2-CD 3.77Å; Y259-K274 HydrophobicContact CE2-CG 3.82Å; Y259-K274 HydrophobicContact CG-CD 4.33Å; Y259-K274 HydrophobicContact CG-CG 4.42Å
260	K	86.5	Confident	78.3	Confident	42 Å²	42	79.5 Å²	79.5	18%	0.183	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.5	176.4	-173.8	-180	177.3	-174.1	0	110.8	E250 V252 E269 L270 T271	E250-K260 PolarHBondContact N-O 2.82Å; E250-K260 PolarHBondContact O-N 2.86Å; V252-K260 HydrophobicContact CG2-CB 3.64Å; V252-K260 HydrophobicContact CG2-CD 4.29Å; K260-E269 WeakPolarHBondContact CE-OE1 3.23Å; K260-E269 WeakPolarHBondContact CE-OE2 3.43Å; K260-E269 IonicContact NZ-OE1 2.76Å; K260-E269 PolarHBondContact NZ-OE1 2.86Å; K260-E269 IonicContact NZ-OE2 2.77Å; K260-E269 PolarHBondContact NZ-OE2 2.87Å; K260-L270 CarbonylContact C-O 3.56Å; K260-L270 WeakPolarHBondContact CA-O 3.28Å; K260-T271 HydrophobicContact CB-CG2 4.22Å; K260-T271 HydrophobicContact CD-CG2 4.41Å; K260-T271 HydrophobicContact CG-CG2 4.01Å
261	K	85.4	Confident	78.8	Confident	55 Å²	55	78.7 Å²	78.7	24%	0.239	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.1	173	-80.5	175.3	-179.5	174.5	0	109.7	Y246 E249 E269 L270 Y272	Y246-K261 HydrophobicContact CD1-CB 3.85Å; Y246-K261 HydrophobicContact CG-CB 4.19Å; E249-K261 HydrophobicContact CG-CD 4.08Å; E249-K261 HydrophobicContact CG-CG 3.74Å; E249-K261 WeakPolarHBondContact OE1-CE 3.5Å; E249-K261 IonicContact OE1-NZ 2.67Å; E249-K261 PolarHBondContact OE1-NZ 2.8Å; K261-E269 CarbonylContact O-C 3.58Å; K261-E269 WeakPolarHBondContact O-CA 3.19Å; K261-L270 HydrophobicContact CB-CB 4.5Å; K261-L270 PolarHBondContact N-O 2.97Å; K261-L270 PolarHBondContact O-N 2.84Å; K261-Y272 HydrophobicContact CD-CE1 3.75Å; K261-Y272 WeakPolarHBondContact CE-OH 3.1Å; K261-Y272 HydrophobicContact CG-CE1 3.93Å; K261-Y272 PolarHBondContact NZ-OH 3.36Å
262	T	84.3	Confident	79.2	Confident	44 Å²	44	77.7 Å²	77.7	27%	0.27	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.1	175.2	59.4	0	0	0	0	110.5	G247 H268 E269	G247-T262 PolarHBondContact N-O 3.37Å; T262-H268 CarbonylContact C-O 3.54Å; T262-H268 WeakPolarHBondContact CA-O 3.12Å; T262-E269 HydrophobicContact CG2-CB 4.39Å; T262-E269 HydrophobicContact CG2-CG 3.93Å
263	C	85.1	Confident	79.5	Confident	4 Å²	4	81 Å²	81	3%	0.027	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.7	177.8	178.2	0	0	0	0	110	H244 E245 Y246 T265 C266 G267 H268	H244-C263 WeakPolarHBondContact CA-SG 3.26Å; H244-C263 HydrophobicContact CB-CB 4.15Å; E245-C263 VanDerWaalsContact O-CA 3.27Å; E245-C263 WeakPolarHBondContact O-CA 3.45Å; E245-C263 PolarHBondContact O-SG 2.63Å; E245-C263 VanDerWaalsContact O-SG 3.35Å; Y246-C263 HydrophobicContact CD1-CB 4.1Å; Y246-C263 HydrophobicContact CE1-CB 3.97Å; C263-T265 PolarHBondContact O-N 3.48Å; C263-T265 PolarHBondContact SG-OG1 3.29Å; C263-C266 VanDerWaalsContact SG-SG 3.65Å; C263-G267 WeakPolarHBondContact O-CA 3.28Å; C263-G267 PolarHBondContact O-N 3Å; C263-H268 HydrophobicContact CB-CB 4.09Å; C263-H268 WeakPolarHBondContact CB-O 3.29Å; C263-H268 PolarHBondContact N-O 3.27Å
264	T	79.4	Confident	79.8	Confident	100 Å²	100	81.1 Å²	81.1	61%	0.613	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-24.8	-173.1	52.7	0	0	0	0	113.5	E245	E245-T264 PolarHBondContact O-N 3.08Å; E245-T264 PolarHBondContact O-OG1 3.49Å
265	T	77.3	Confident	79.7	Confident	86 Å²	86	88.7 Å²	88.7	53%	0.528	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-22.4	-172.1	39.9	0	0	0	0	114.1	H242 C263	H242-T265 WeakPolarHBondContact CE1-CB 3.29Å; H242-T265 PolarHBondContact CE1-OG1 3Å; H242-T265 PolarHBondContact NE2-OG1 3.23Å; C263-T265 PolarHBondContact O-N 3.48Å; C263-T265 PolarHBondContact SG-OG1 3.29Å
266	C	81.4	Confident	80.3	Confident	67 Å²	67	83.7 Å²	83.7	45%	0.453	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.2	-1.4	-178.2	78.3	0	0	0	0	115.3	H242 H244 C263 H268	H242-C266 PolarHBondContact CD2-SG 3.1Å; H242-C266 WeakPolarHBondContact NE2-CB 3.37Å; H244-C266 PolarHBondContact CE1-SG 3.35Å; H244-C266 PolarHBondContact ND1-SG 2.97Å; C263-C266 VanDerWaalsContact SG-SG 3.65Å; C266-H268 VanDerWaalsContact C-N 3.27Å; C266-H268 PolarHBondContact O-N 2.92Å; C266-H268 VanDerWaalsContact SG-CB 3.53Å; C266-H268 PolarHBondContact SG-N 3.11Å
267	G	78.9	Confident	81.1	Confident	53 Å²	53	81.1 Å²	81.1	55%	0.546	43%	0.43	S	S	.	.			trans	70.2	16.9	179.5	0	0	0	0	0	115.1	C263	C263-G267 WeakPolarHBondContact O-CA 3.28Å; C263-G267 PolarHBondContact O-N 3Å
268	H	83.1	Confident	81.3	Confident	84 Å²	84	81.1 Å²	81.1	39%	0.389	43%	0.43	S	S	.	.			trans	-70.9	132.4	175.2	-178.2	-86.1	0	0	0	110.5	H244 Y246 T262 C263 C266	H244-H268 WeakPolarHBondContact CE1-CB 3.28Å; H244-H268 AromaticContact CE1-CG 3.7Å; H244-H268 WeakPolarHBondContact ND1-CB 3.32Å; Y246-H268 AromaticContact CE1-ND1 3.91Å; Y246-H268 AromaticContact CZ-ND1 3.87Å; Y246-H268 PolarHBondContact OH-ND1 2.78Å; T262-H268 CarbonylContact C-O 3.54Å; T262-H268 WeakPolarHBondContact CA-O 3.12Å; C263-H268 HydrophobicContact CB-CB 4.09Å; C263-H268 WeakPolarHBondContact CB-O 3.29Å; C263-H268 PolarHBondContact N-O 3.27Å; C266-H268 VanDerWaalsContact C-N 3.27Å; C266-H268 PolarHBondContact O-N 2.92Å; C266-H268 VanDerWaalsContact SG-CB 3.53Å; C266-H268 PolarHBondContact SG-N 3.11Å
269	E	84.8	Confident	81.3	Confident	109 Å²	109	83.4 Å²	83.4	51%	0.509	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.8	-176.6	-46.2	-168.8	138.6	0	0	110.5	K260 K261 T262	K260-E269 WeakPolarHBondContact CE-OE1 3.23Å; K260-E269 WeakPolarHBondContact CE-OE2 3.43Å; K260-E269 IonicContact NZ-OE1 2.76Å; K260-E269 PolarHBondContact NZ-OE1 2.86Å; K260-E269 IonicContact NZ-OE2 2.77Å; K260-E269 PolarHBondContact NZ-OE2 2.87Å; K261-E269 CarbonylContact O-C 3.58Å; K261-E269 WeakPolarHBondContact O-CA 3.19Å; T262-E269 HydrophobicContact CG2-CB 4.39Å; T262-E269 HydrophobicContact CG2-CG 3.93Å
270	L	83.3	Confident	81.3	Confident	77 Å²	77	85.7 Å²	85.7	40%	0.403	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.6	172.1	-97	176.5	0	0	0	109.1	Y246 K260 K261	Y246-L270 HydrophobicContact CD1-CB 4.43Å; Y246-L270 HydrophobicContact CD1-CD1 4.38Å; Y246-L270 HydrophobicContact CD2-CD1 4.2Å; Y246-L270 HydrophobicContact CE1-CB 3.9Å; Y246-L270 HydrophobicContact CE1-CD1 3.68Å; Y246-L270 HydrophobicContact CE1-CG 3.86Å; Y246-L270 HydrophobicContact CE2-CD1 3.45Å; Y246-L270 VanDerWaalsContact CE2-CD1 3.45Å; Y246-L270 HydrophobicContact CE2-CG 4.47Å; Y246-L270 WeakPolarHBondContact OH-CD1 3.06Å; K260-L270 CarbonylContact C-O 3.56Å; K260-L270 WeakPolarHBondContact CA-O 3.28Å; K261-L270 HydrophobicContact CB-CB 4.5Å; K261-L270 PolarHBondContact N-O 2.97Å; K261-L270 PolarHBondContact O-N 2.84Å
271	T	84.8	Confident	81	Confident	99 Å²	99	88.6 Å²	88.6	61%	0.607	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.3	170.5	51.2	0	0	0	0	109.7	Y259 K260	Y259-T271 CarbonylContact O-C 3.57Å; Y259-T271 WeakPolarHBondContact O-CA 3.35Å; K260-T271 HydrophobicContact CB-CG2 4.22Å; K260-T271 HydrophobicContact CD-CG2 4.41Å; K260-T271 HydrophobicContact CG-CG2 4.01Å
272	Y	82.9	Confident	80.7	Confident	62 Å²	62	91 Å²	91	24%	0.243	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	152.3	-179.5	69	-76.6	0	0	0	111.2	E249 Y259 K261 K274	E249-Y272 PolarHBondContact OE1-OH 3.26Å; E249-Y272 VanDerWaalsContact OE1-OH 3.13Å; E249-Y272 PolarHBondContact OE2-OH 3.44Å; Y259-Y272 PolarHBondContact N-O 2.75Å; Y259-Y272 PolarHBondContact O-N 3.03Å; K261-Y272 HydrophobicContact CD-CE1 3.75Å; K261-Y272 WeakPolarHBondContact CE-OH 3.1Å; K261-Y272 HydrophobicContact CG-CE1 3.93Å; K261-Y272 PolarHBondContact NZ-OH 3.36Å; Y272-K274 HydrophobicContact CD2-CG 4.29Å; Y272-K274 HydrophobicContact CE2-CD 4.36Å; Y272-K274 HydrophobicContact CE2-CG 3.68Å; Y272-K274 VanDerWaalsContact OH-CE 3.25Å; Y272-K274 WeakPolarHBondContact OH-CE 3.45Å
273	E	82.3	Confident	80.4	Confident	147 Å²	147	94.6 Å²	94.6	69%	0.687	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.5	175.3	-68	167.6	-166.1	0	0	109.7	D257 L258	D257-E273 WeakPolarHBondContact O-CA 3.37Å; L258-E273 HydrophobicContact CD2-CG 3.62Å; L258-E273 HydrophobicContact CG-CG 4.23Å
274	K	77.2	Confident	80	Confident	82 Å²	82	102.2 Å²	102.2	36%	0.357	55%	0.551	S	S	.	*			trans	-97.6	122.7	170.3	-75.3	-175.9	-176.3	169.2	0	109.2	E249 D257 Y259 Y272	E249-K274 WeakPolarHBondContact OE2-CE 3.31Å; E249-K274 IonicContact OE2-NZ 2.65Å; E249-K274 PolarHBondContact OE2-NZ 2.96Å; D257-K274 PolarHBondContact O-N 3.06Å; Y259-K274 HydrophobicContact CD1-CD 4.5Å; Y259-K274 HydrophobicContact CD2-CB 4.01Å; Y259-K274 HydrophobicContact CD2-CD 3.93Å; Y259-K274 HydrophobicContact CD2-CG 3.73Å; Y259-K274 HydrophobicContact CE1-CD 4.31Å; Y259-K274 HydrophobicContact CE2-CB 3.72Å; Y259-K274 HydrophobicContact CE2-CD 3.77Å; Y259-K274 HydrophobicContact CE2-CG 3.82Å; Y259-K274 HydrophobicContact CG-CD 4.33Å; Y259-K274 HydrophobicContact CG-CG 4.42Å; Y272-K274 HydrophobicContact CD2-CG 4.29Å; Y272-K274 HydrophobicContact CE2-CD 4.36Å; Y272-K274 HydrophobicContact CE2-CG 3.68Å; Y272-K274 VanDerWaalsContact OH-CE 3.25Å; Y272-K274 WeakPolarHBondContact OH-CE 3.45Å
275	M	64.4	Low	80	Confident	260 Å²	260	102.4 Å²	102.4	100%	1.281	55%	0.546	S	S	*	.			trans	-90.7	0	176.7	-161.6	-179.1	-67.9	0	0	111.7

Retrieved 275 of 275 residues in 103.8 ms (Link to these results)

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