A0A087YSI7_POEFO Loading...

Trophoblast glycoprotein

AlphaFold DB , UniProt , Accession A0A087YSI7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 369 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	V	41.3	Very low	39.5	Very low	201 Å²	201	175.4 Å²	175.4	100%	1.218	89%	0.888	S	S	*	*				0	110.2	0	179.6	0	0	0	0	108
2	R	35.3	Very low	40.2	Very low	248 Å²	248	175.6 Å²	175.6	94%	0.936	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-84.3	128.3	-179.9	-87.1	-179.5	-171.7	173.7	3.8	109.8
3	L	36	Very low	41	Very low	169 Å²	169	175 Å²	175	89%	0.885	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-73.6	140	165.5	-74.8	152.6	0	0	0	110.3
4	P	41.7	Very low	42	Very low	125 Å²	125	167.6 Å²	167.6	81%	0.812	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-84.8	133.4	176.9	31.9	-29.5	0	0	0	111.7
5	K	40.5	Very low	42.6	Very low	210 Å²	210	159.5 Å²	159.5	91%	0.913	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-78.7	119	168.5	-86	178.2	171.6	177	0	109.9
6	M	35.1	Very low	43.5	Very low	193 Å²	193	156.9 Å²	156.9	95%	0.951	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.2	129	165.3	-101.5	171.5	150.5	0	0	110.3
7	R	38.4	Very low	44.2	Very low	239 Å²	239	152.4 Å²	152.4	90%	0.902	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-86.2	140.5	170.2	-70.2	-179.1	-178.3	-174	0.1	109.6
8	P	39.5	Very low	44.9	Very low	128 Å²	128	153.9 Å²	153.9	83%	0.831	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.3	130.6	171	29.2	-29.6	0	0	0	110.5
9	G	39.9	Very low	45.6	Very low	73 Å²	73	150.7 Å²	150.7	75%	0.753	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-66.5	140	175.1	0	0	0	0	0	112
10	R	43.8	Very low	46.2	Very low	242 Å²	242	148.2 Å²	148.2	91%	0.913	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-62.4	134.7	173.6	-75.3	176.2	174.2	177.7	-2.7	110
11	P	43.5	Very low	46.8	Very low	101 Å²	101	146.5 Å²	146.5	66%	0.656	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.8	174	28.6	-30.1	0	0	0	110.3	K13	P11-K13 VanDerWaalsContact C-N 3.26Å; P11-K13 PolarHBondContact O-N 3.18Å
12	H	47.3	Very low	47.4	Very low	178 Å²	178	142.5 Å²	142.5	82%	0.824	72%	0.716	S	S	*	*			trans	-62.6	77.6	172.3	-107.4	-75.6	0	0	0	111	S14	H12-S14 PolarHBondContact O-N 3.1Å
13	K	51.3	Low	48.5	Very low	168 Å²	168	134.7 Å²	134.7	73%	0.73	69%	0.692	S	S	*	*	H	α-helix	trans	-69.5	-11.5	177.8	-76.4	-173.7	175.4	-175.7	0	114.4	P11 T17	P11-K13 VanDerWaalsContact C-N 3.26Å; P11-K13 PolarHBondContact O-N 3.18Å; K13-T17 PolarHBondContact O-OG1 2.86Å
14	S	54.5	Low	49.3	Very low	72 Å²	72	129.3 Å²	129.3	50%	0.503	67%	0.672	S	S	.	*	H	α-helix	trans	-83.1	-20.7	-176.9	-172.2	0	0	0	0	114.4	H12 T17 R18	H12-S14 PolarHBondContact O-N 3.1Å; S14-T17 PolarHBondContact O-OG1 2.98Å; S14-R18 WeakPolarHBondContact O-CG 3.29Å
15	G	51.1	Low	49.7	Very low	45 Å²	45	128.7 Å²	128.7	46%	0.464	66%	0.662	S	S	.	*	H	α-helix	trans	-80.7	-43.1	179.1	0	0	0	0	0	112.1	R18 L19	G15-R18 PolarHBondContact O-N 3.14Å; G15-L19 WeakPolarHBondContact O-CB 3.42Å; G15-L19 PolarHBondContact O-N 3.09Å
16	M	56.5	Low	50.2	Low	119 Å²	119	121.9 Å²	121.9	59%	0.586	64%	0.644	S	S	*	*	H	α-helix	trans	-68.1	-35.9	179.2	-77.6	-130.9	82.5	0	0	113.1	L19 L20	M16-L19 PolarHBondContact O-N 3.24Å; M16-L20 WeakPolarHBondContact O-CB 3.38Å; M16-L20 WeakPolarHBondContact O-CD1 3.34Å; M16-L20 VanDerWaalsContact O-CG 3.24Å; M16-L20 WeakPolarHBondContact O-CG 3.41Å; M16-L20 PolarHBondContact O-N 2.96Å
17	T	56	Low	50.8	Low	79 Å²	79	119.6 Å²	119.6	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-71.9	-33.9	176.3	41.9	0	0	0	0	112.7	K13 S14 L21	K13-T17 PolarHBondContact O-OG1 2.86Å; S14-T17 PolarHBondContact O-OG1 2.98Å; T17-L21 WeakPolarHBondContact O-CB 3.46Å; T17-L21 WeakPolarHBondContact O-CD1 3.48Å; T17-L21 PolarHBondContact O-N 3.18Å
18	R	55.8	Low	51.2	Low	181 Å²	181	111.8 Å²	111.8	68%	0.683	62%	0.618	S	S	*	*	H	α-helix	trans	-70.7	-38.9	170.9	-76.4	-175.5	177.3	-168.8	-0.9	112.2	S14 G15 L21 L22	S14-R18 WeakPolarHBondContact O-CG 3.29Å; G15-R18 PolarHBondContact O-N 3.14Å; R18-L21 PolarHBondContact O-N 2.98Å; R18-L22 VanDerWaalsContact O-CB 3.28Å; R18-L22 WeakPolarHBondContact O-CB 3.26Å; R18-L22 WeakPolarHBondContact O-CD1 3.11Å; R18-L22 WeakPolarHBondContact O-CG 3.28Å; R18-L22 PolarHBondContact O-N 3.5Å
19	L	58.6	Low	51.7	Low	93 Å²	93	109.8 Å²	109.8	49%	0.487	61%	0.605	S	S	.	*	H	α-helix	trans	-67.5	-40.6	174.9	-164.5	75.6	0	0	0	111.3	G15 M16 L22 L23	G15-L19 WeakPolarHBondContact O-CB 3.42Å; G15-L19 PolarHBondContact O-N 3.09Å; M16-L19 PolarHBondContact O-N 3.24Å; L19-L22 PolarHBondContact O-N 3.16Å; L19-L23 HydrophobicContact CD2-CD1 4.42Å; L19-L23 HydrophobicContact CG-CD1 4Å; L19-L23 WeakPolarHBondContact O-CB 3.49Å; L19-L23 WeakPolarHBondContact O-CD1 3.41Å; L19-L23 WeakPolarHBondContact O-CG 3.18Å; L19-L23 PolarHBondContact O-N 3.23Å
20	L	58.4	Low	52.6	Low	100 Å²	100	117.4 Å²	117.4	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-69.5	-33	173.3	-78.5	159.9	0	0	0	112.2	M16 A24	M16-L20 WeakPolarHBondContact O-CB 3.38Å; M16-L20 WeakPolarHBondContact O-CD1 3.34Å; M16-L20 VanDerWaalsContact O-CG 3.24Å; M16-L20 WeakPolarHBondContact O-CG 3.41Å; M16-L20 PolarHBondContact O-N 2.96Å; L20-A24 WeakPolarHBondContact O-CA 3.46Å; L20-A24 WeakPolarHBondContact O-CB 3.28Å; L20-A24 PolarHBondContact O-N 3.27Å
21	L	57.6	Low	53.9	Low	113 Å²	113	109.7 Å²	109.7	59%	0.592	59%	0.594	S	S	*	*	H	α-helix	trans	-69.7	-41.6	170.5	-113.9	89.1	0	0	0	111.6	T17 R18 A24 L25	T17-L21 WeakPolarHBondContact O-CB 3.46Å; T17-L21 WeakPolarHBondContact O-CD1 3.48Å; T17-L21 PolarHBondContact O-N 3.18Å; R18-L21 PolarHBondContact O-N 2.98Å; L21-A24 PolarHBondContact O-N 3.12Å; L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 VanDerWaalsContact O-CD1 3.31Å; L21-L25 WeakPolarHBondContact O-CD1 2.98Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.42Å; L21-L25 PolarHBondContact O-N 2.87Å
22	L	55.8	Low	56.1	Low	116 Å²	116	106.7 Å²	106.7	61%	0.607	58%	0.575	S	S	*	*	H	α-helix	trans	-67.6	-38.7	176.2	-75.9	163	0	0	0	111.3	R18 L19 A26	R18-L22 VanDerWaalsContact O-CB 3.28Å; R18-L22 WeakPolarHBondContact O-CB 3.26Å; R18-L22 WeakPolarHBondContact O-CD1 3.11Å; R18-L22 WeakPolarHBondContact O-CG 3.28Å; R18-L22 PolarHBondContact O-N 3.5Å; L19-L22 PolarHBondContact O-N 3.16Å; L22-A26 WeakPolarHBondContact O-CB 3.22Å; L22-A26 PolarHBondContact O-N 3.38Å
23	L	56.6	Low	58.2	Low	84 Å²	84	99 Å²	99	44%	0.44	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-42.2	169.6	-84.1	153.1	0	0	0	110.7	L19 A26 L27	L19-L23 HydrophobicContact CD2-CD1 4.42Å; L19-L23 HydrophobicContact CG-CD1 4Å; L19-L23 WeakPolarHBondContact O-CB 3.49Å; L19-L23 WeakPolarHBondContact O-CD1 3.41Å; L19-L23 WeakPolarHBondContact O-CG 3.18Å; L19-L23 PolarHBondContact O-N 3.23Å; L23-A26 CarbonylContact O-C 3.53Å; L23-A26 PolarHBondContact O-N 3.12Å; L23-L27 HydrophobicContact CB-CD1 4.22Å; L23-L27 HydrophobicContact CD2-CD1 4.28Å; L23-L27 VanDerWaalsContact O-CB 3.29Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 WeakPolarHBondContact O-CD1 3.48Å; L23-L27 PolarHBondContact O-N 3.35Å
24	A	53.7	Low	60	Low	56 Å²	56	98.2 Å²	98.2	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-67.6	-36.3	176.8	0	0	0	0	0	112.4	L20 L21 A26 L27 S28	L20-A24 WeakPolarHBondContact O-CA 3.46Å; L20-A24 WeakPolarHBondContact O-CB 3.28Å; L20-A24 PolarHBondContact O-N 3.27Å; L21-A24 PolarHBondContact O-N 3.12Å; A24-A26 VanDerWaalsContact C-N 3.35Å; A24-L27 PolarHBondContact O-N 3.09Å; A24-S28 WeakPolarHBondContact O-CB 3.47Å; A24-S28 PolarHBondContact O-N 2.92Å; A24-S28 PolarHBondContact O-OG 2.82Å; A24-S28 VanDerWaalsContact O-OG 3.08Å
25	L	50.8	Low	61.7	Low	112 Å²	112	101 Å²	101	59%	0.586	55%	0.547	S	S	*	.	H	α-helix	trans	-68.3	-33.1	171.7	-79.4	156	0	0	0	111.6	L21 S28	L21-L25 WeakPolarHBondContact O-CB 3.4Å; L21-L25 VanDerWaalsContact O-CD1 3.31Å; L21-L25 WeakPolarHBondContact O-CD1 2.98Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.42Å; L21-L25 PolarHBondContact O-N 2.87Å; L25-S28 WeakPolarHBondContact CA-OG 3.23Å; L25-S28 CarbonylContact O-C 3.59Å; L25-S28 PolarHBondContact O-OG 3.5Å; L25-S28 VanDerWaalsContact O-OG 3.12Å
26	A	50.3	Low	63.8	Low	67 Å²	67	99.8 Å²	99.8	55%	0.554	53%	0.532	S	S	*	.	H	α-helix	trans	-77.3	-31.4	172.6	0	0	0	0	0	113.1	L22 L23 A24 S28 C29	L22-A26 WeakPolarHBondContact O-CB 3.22Å; L22-A26 PolarHBondContact O-N 3.38Å; L23-A26 CarbonylContact O-C 3.53Å; L23-A26 PolarHBondContact O-N 3.12Å; A24-A26 VanDerWaalsContact C-N 3.35Å; A26-S28 VanDerWaalsContact C-N 3.3Å; A26-C29 WeakPolarHBondContact O-CB 2.97Å; A26-C29 PolarHBondContact O-N 3.3Å
27	L	47.3	Very low	65.6	Low	145 Å²	145	99.4 Å²	99.4	76%	0.759	53%	0.532	S	S	*	.	H	α-helix	trans	-78.3	-15.6	173	-89.8	103.9	0	0	0	112.2	L23 A24	L23-L27 HydrophobicContact CB-CD1 4.22Å; L23-L27 HydrophobicContact CD2-CD1 4.28Å; L23-L27 VanDerWaalsContact O-CB 3.29Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 WeakPolarHBondContact O-CD1 3.48Å; L23-L27 PolarHBondContact O-N 3.35Å; A24-L27 PolarHBondContact O-N 3.09Å
28	S	46.9	Very low	67.4	Low	76 Å²	76	97.7 Å²	97.7	53%	0.531	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	35.2	166.4	67.1	0	0	0	0	111.8	A24 L25 A26 R30	A24-S28 WeakPolarHBondContact O-CB 3.47Å; A24-S28 PolarHBondContact O-N 2.92Å; A24-S28 PolarHBondContact O-OG 2.82Å; A24-S28 VanDerWaalsContact O-OG 3.08Å; L25-S28 WeakPolarHBondContact CA-OG 3.23Å; L25-S28 CarbonylContact O-C 3.59Å; L25-S28 PolarHBondContact O-OG 3.5Å; L25-S28 VanDerWaalsContact O-OG 3.12Å; A26-S28 VanDerWaalsContact C-N 3.3Å; S28-R30 PolarHBondContact O-N 2.86Å
29	C	49.3	Very low	69.1	Low	85 Å²	85	92.4 Å²	92.4	57%	0.574	51%	0.51	S	S	*	.			trans	-63.5	124.3	175.4	-160	0	0	0	0	108.9	A26 C31	A26-C29 WeakPolarHBondContact O-CB 2.97Å; A26-C29 PolarHBondContact O-N 3.3Å; C29-C31 PolarHBondContact O-N 2.95Å; C29-C31 PolarHBondContact O-SG 2.92Å; C29-C31 VanDerWaalsContact O-SG 3.35Å
30	R	58.7	Low	70.5	Confident	234 Å²	234	93.8 Å²	93.8	88%	0.883	53%	0.528	S	S	*	.			trans	-65.8	80.3	166.7	-64.5	175.8	177	-164.9	-2.1	106.6	S28 C32	S28-R30 PolarHBondContact O-N 2.86Å; R30-C32 PolarHBondContact O-N 3.5Å
31	C	72.3	Confident	72.2	Confident	80 Å²	80	93.4 Å²	93.4	54%	0.541	52%	0.523	S	S	.	.			trans	-70.5	35.7	-177	-65.5	0	0	0	0	113.3	C29 P58	C29-C31 PolarHBondContact O-N 2.95Å; C29-C31 PolarHBondContact O-SG 2.92Å; C29-C31 VanDerWaalsContact O-SG 3.35Å; C31-P58 WeakPolarHBondContact O-CG 3.46Å
32	C	88.9	Confident	74.1	Confident	38 Å²	38	89.7 Å²	89.7	26%	0.257	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-80.3	131.6	170.4	-165.4	0	0	0	0	108.2	R30 C36 C38	R30-C32 PolarHBondContact O-N 3.5Å; C32-C36 PolarHBondContact SG-O 3.31Å; C32-C36 VanDerWaalsContact SG-O 3.34Å; C32-C38 WeakPolarHBondContact CA-SG 3.17Å; C32-C38 HydrophobicContact CB-CB 3.66Å; C32-C38 WeakPolarHBondContact CB-SG 3.47Å; C32-C38 WeakPolarHBondContact SG-CB 3.48Å; C32-C38 PolarHBondContact SG-N 3.08Å; C32-C38 CovalentContact SG-SG 2.03Å; C32-C38 PolarHBondContact SG-SG 3.12Å
33	P	91.7	Very high	76	Confident	17 Å²	17	84.2 Å²	84.2	11%	0.11	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-60.5	149.1	177.2	-7.2	13	0	0	0	111.9	K35 C36 V43 P54 S56 L57	P33-K35 PolarHBondContact O-N 2.88Å; P33-C36 HydrophobicContact CB-CB 4.26Å; P33-C36 HydrophobicContact CG-CB 4.2Å; P33-C36 VanDerWaalsContact O-CB 3.31Å; P33-C36 WeakPolarHBondContact O-CB 3.37Å; P33-C36 PolarHBondContact O-N 3.42Å; P33-V43 HydrophobicContact CG-CG1 4.49Å; P33-P54 HydrophobicContact CB-CB 3.37Å; P33-P54 HydrophobicContact CB-CG 3.93Å; P33-P54 HydrophobicContact CG-CB 3.71Å; P33-P54 HydrophobicContact CG-CG 4.2Å; P33-S56 WeakPolarHBondContact CG-O 3.41Å; P33-L57 HydrophobicContact CG-CD2 3.86Å
34	D	88.2	Confident	78	Confident	150 Å²	150	84.4 Å²	84.4	80%	0.802	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	141.4	173.5	-71.6	-25.6	0	0	0	110.4	C36	D34-C36 PolarHBondContact O-N 2.88Å
35	K	90.9	Very high	80	Confident	130 Å²	130	81.7 Å²	81.7	57%	0.565	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	2.1	-172.6	-49.1	-178.6	177.4	-178.2	0	115.4	P33 Q48 L50	P33-K35 PolarHBondContact O-N 2.88Å; K35-Q48 HydrophobicContact CB-CB 3.99Å; K35-Q48 HydrophobicContact CB-CG 3.9Å; K35-Q48 HydrophobicContact CD-CB 4.16Å; K35-Q48 VanDerWaalsContact O-CG 3.25Å; K35-Q48 WeakPolarHBondContact O-CG 3.31Å; K35-L50 HydrophobicContact CD-CD2 4.23Å
36	C	95.1	Very high	82.2	Confident	21 Å²	21	79.8 Å²	79.8	14%	0.142	44%	0.44	C	S	.	.			trans	-104.9	155.3	175.7	-54.8	0	0	0	0	112.3	C32 P33 D34 V43 K44 C45	C32-C36 PolarHBondContact SG-O 3.31Å; C32-C36 VanDerWaalsContact SG-O 3.34Å; P33-C36 HydrophobicContact CB-CB 4.26Å; P33-C36 HydrophobicContact CG-CB 4.2Å; P33-C36 VanDerWaalsContact O-CB 3.31Å; P33-C36 WeakPolarHBondContact O-CB 3.37Å; P33-C36 PolarHBondContact O-N 3.42Å; D34-C36 PolarHBondContact O-N 2.88Å; C36-V43 HydrophobicContact CB-CG1 4.17Å; C36-K44 CarbonylContact C-O 3.5Å; C36-K44 VanDerWaalsContact CA-O 3.27Å; C36-K44 WeakPolarHBondContact CA-O 3.49Å; C36-C45 HydrophobicContact CB-CB 4.11Å; C36-C45 WeakPolarHBondContact CB-SG 3.39Å; C36-C45 WeakPolarHBondContact SG-CB 3.36Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 3.45Å
37	L	95	Very high	84.4	Confident	111 Å²	111	82.5 Å²	82.5	58%	0.581	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.1	169.3	179.4	67.6	0	0	0	109.1	T39 K44	L37-T39 HydrophobicContact CG-CG2 4.39Å; L37-K44 PolarHBondContact N-O 2.96Å; L37-K44 PolarHBondContact O-N 3.04Å
38	C	94.1	Very high	86.8	Confident	43 Å²	43	79.3 Å²	79.3	29%	0.291	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.9	179.9	-56.6	0	0	0	0	110.8	C32 T42 V43	C32-C38 WeakPolarHBondContact CA-SG 3.17Å; C32-C38 HydrophobicContact CB-CB 3.66Å; C32-C38 WeakPolarHBondContact CB-SG 3.47Å; C32-C38 WeakPolarHBondContact SG-CB 3.48Å; C32-C38 PolarHBondContact SG-N 3.08Å; C32-C38 CovalentContact SG-SG 2.03Å; C32-C38 PolarHBondContact SG-SG 3.12Å; C38-T42 CarbonylContact C-O 3.6Å; C38-T42 WeakPolarHBondContact CA-O 3.22Å; C38-V43 HydrophobicContact CB-CG2 4.46Å
39	T	90.6	Very high	89.1	Confident	69 Å²	69	76.6 Å²	76.6	42%	0.423	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	110.8	-178.4	52.6	0	0	0	0	110.1	L37 E41 T42	L37-T39 HydrophobicContact CG-CG2 4.39Å; T39-E41 PolarHBondContact O-N 3.24Å; T39-T42 PolarHBondContact N-O 2.78Å; T39-T42 PolarHBondContact O-N 3.12Å
40	S	88.1	Confident	91.4	Very high	122 Å²	122	73.6 Å²	73.6	85%	0.853	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	-89.1	-177.4	-165	0	0	0	0	113.3
41	E	94.7	Very high	93.2	Very high	93 Å²	93	66.9 Å²	66.9	44%	0.435	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	6.1	-177.5	-56.6	-178.3	169.6	0	0	112.2	T39 K60 T61 K62 S63	T39-E41 PolarHBondContact O-N 3.24Å; E41-K60 WeakPolarHBondContact CA-O 3.39Å; E41-K60 WeakPolarHBondContact CB-O 3.22Å; E41-T61 CarbonylContact O-C 3.38Å; E41-T61 WeakPolarHBondContact O-CA 3.45Å; E41-K62 HydrophobicContact CB-CB 3.82Å; E41-K62 PolarHBondContact O-N 3.21Å; E41-S63 PolarHBondContact O-N 3Å; E41-S63 VanDerWaalsContact O-N 3.15Å
42	T	96.9	Very high	94.4	Very high	35 Å²	35	70.7 Å²	70.7	22%	0.215	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.3	-178.3	-52.2	0	0	0	0	110.8	C38 T39 K44 S63 F65	C38-T42 CarbonylContact C-O 3.6Å; C38-T42 WeakPolarHBondContact CA-O 3.22Å; T39-T42 PolarHBondContact N-O 2.78Å; T39-T42 PolarHBondContact O-N 3.12Å; T42-K44 HydrophobicContact CG2-CG 3.92Å; T42-S63 WeakPolarHBondContact CA-O 3.11Å; T42-F65 HydrophobicContact CG2-CD2 3.76Å; T42-F65 HydrophobicContact CG2-CE2 3.61Å
43	V	96.8	Very high	94.7	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.006	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.6	172.5	179.1	0	0	0	0	108.5	P33 C36 C38 L57 P58 T61 S63 L64 F65	P33-V43 HydrophobicContact CG-CG1 4.49Å; C36-V43 HydrophobicContact CB-CG1 4.17Å; C38-V43 HydrophobicContact CB-CG2 4.46Å; V43-L57 HydrophobicContact CG1-CD2 4.03Å; V43-P58 HydrophobicContact CG2-CG 4.09Å; V43-T61 HydrophobicContact CB-CG2 4.04Å; V43-T61 HydrophobicContact CG2-CG2 3.57Å; V43-T61 VanDerWaalsContact CG2-OG1 3.27Å; V43-T61 WeakPolarHBondContact CG2-OG1 3.21Å; V43-S63 PolarHBondContact N-O 1.98Å; V43-L64 HydrophobicContact CB-CD1 3.79Å; V43-L64 HydrophobicContact CG1-CD1 3.78Å; V43-F65 PolarHBondContact O-N 3.1Å
44	K	97.4	Very high	94.7	Very high	87 Å²	87	69.2 Å²	69.2	38%	0.378	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.5	-179.2	-59.5	-172.6	178.1	-177.2	0	110.9	C36 L37 T42 F65	C36-K44 CarbonylContact C-O 3.5Å; C36-K44 VanDerWaalsContact CA-O 3.27Å; C36-K44 WeakPolarHBondContact CA-O 3.49Å; L37-K44 PolarHBondContact N-O 2.96Å; L37-K44 PolarHBondContact O-N 3.04Å; T42-K44 HydrophobicContact CG2-CG 3.92Å; K44-F65 HydrophobicContact CG-CB 4.27Å; K44-F65 HydrophobicContact CG-CD2 3.95Å; K44-F65 HydrophobicContact CG-CG 4.37Å
45	C	96.6	Very high	94.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.359	C	S	.	.			trans	-123	56.4	-178.3	-55.6	0	0	0	0	109.6	C36 L50 F65 V66 N69	C36-C45 HydrophobicContact CB-CB 4.11Å; C36-C45 WeakPolarHBondContact CB-SG 3.39Å; C36-C45 WeakPolarHBondContact SG-CB 3.36Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 3.45Å; C45-L50 HydrophobicContact CB-CD1 3.74Å; C45-F65 WeakPolarHBondContact CA-O 3.45Å; C45-F65 PolarHBondContact N-O 3.27Å; C45-V66 HydrophobicContact CB-CG1 4.19Å; C45-N69 PolarHBondContact O-ND2 3.41Å
46	Q	96.8	Very high	94.3	Very high	71 Å²	71	64 Å²	64	33%	0.332	36%	0.36	S	S	.	.			trans	-100.3	138.6	-167.8	-55	178.6	-73.2	0	0	112.2	Q48 F65 T67	Q46-Q48 VanDerWaalsContact C-N 3.28Å; Q46-Q48 WeakPolarHBondContact O-CG 2.91Å; Q46-Q48 PolarHBondContact O-N 3.44Å; Q46-Q48 PolarHBondContact O-NE2 2.02Å; Q46-F65 HydrophobicContact CG-CB 4.04Å; Q46-T67 VanDerWaalsContact CA-O 3.28Å; Q46-T67 WeakPolarHBondContact CA-O 3.47Å; Q46-T67 WeakPolarHBondContact CG-OG1 3.44Å; Q46-T67 PolarHBondContact NE2-OG1 3.25Å
47	N	97.3	Very high	94.2	Very high	124 Å²	124	63.9 Å²	63.9	66%	0.663	36%	0.357	S	S	*	.	S	Bend	trans	55.7	38.3	176.3	-55.6	-45.8	0	0	0	114	T67 G68	N47-T67 PolarHBondContact N-O 2.96Å; N47-T67 VanDerWaalsContact N-O 3.11Å; N47-G68 VanDerWaalsContact CA-O 3.28Å; N47-G68 WeakPolarHBondContact CA-O 3.49Å; N47-G68 WeakPolarHBondContact OD1-CA 2.93Å; N47-G68 PolarHBondContact OD1-O 2.85Å
48	Q	96.4	Very high	94	Very high	78 Å²	78	60.1 Å²	60.1	36%	0.364	34%	0.34	S	S	.	.	S	Bend	trans	-104.8	1.5	-175.4	-62.1	-55.6	-43.8	0	0	113.3	K35 Q46 L50 N69	K35-Q48 HydrophobicContact CB-CB 3.99Å; K35-Q48 HydrophobicContact CB-CG 3.9Å; K35-Q48 HydrophobicContact CD-CB 4.16Å; K35-Q48 VanDerWaalsContact O-CG 3.25Å; K35-Q48 WeakPolarHBondContact O-CG 3.31Å; Q46-Q48 VanDerWaalsContact C-N 3.28Å; Q46-Q48 WeakPolarHBondContact O-CG 2.91Å; Q46-Q48 PolarHBondContact O-N 3.44Å; Q46-Q48 PolarHBondContact O-NE2 2.02Å; Q48-L50 HydrophobicContact CB-CD1 4.46Å; Q48-L50 HydrophobicContact CB-CD2 4.36Å; Q48-L50 HydrophobicContact CB-CG 3.96Å; Q48-L50 PolarHBondContact O-N 3.26Å; Q48-N69 WeakPolarHBondContact CA-OD1 3.5Å; Q48-N69 PolarHBondContact N-OD1 2.83Å
49	G	96.5	Very high	93.8	Very high	20 Å²	20	61.7 Å²	61.7	21%	0.206	36%	0.356	C	S	.	.			trans	63.2	29.6	-176.1	0	0	0	0	0	112.9	N69 R70	G49-N69 PolarHBondContact N-OD1 3.15Å; G49-N69 VanDerWaalsContact N-OD1 3.13Å; G49-R70 PolarHBondContact O-NH2 3.2Å
50	L	96.9	Very high	93.9	Very high	22 Å²	22	65.7 Å²	65.7	12%	0.115	37%	0.367	C	S	.	.			trans	-63.9	138.7	176.7	-61.4	175.5	0	0	0	110.2	K35 C45 Q48 P54 V66 N69 R70 I71	K35-L50 HydrophobicContact CD-CD2 4.23Å; C45-L50 HydrophobicContact CB-CD1 3.74Å; Q48-L50 HydrophobicContact CB-CD1 4.46Å; Q48-L50 HydrophobicContact CB-CD2 4.36Å; Q48-L50 HydrophobicContact CB-CG 3.96Å; Q48-L50 PolarHBondContact O-N 3.26Å; L50-P54 HydrophobicContact CD1-CG 4.13Å; L50-V66 HydrophobicContact CD1-CG1 4.01Å; L50-N69 HydrophobicContact CB-CB 3.94Å; L50-N69 PolarHBondContact N-OD1 2.97Å; L50-N69 VanDerWaalsContact N-OD1 3.13Å; L50-N69 WeakPolarHBondContact O-CB 3.35Å; L50-R70 CarbonylContact O-C 3.38Å; L50-R70 VanDerWaalsContact O-C 3.27Å; L50-R70 WeakPolarHBondContact O-CA 3.42Å; L50-R70 PolarHBondContact O-N 3.1Å; L50-I71 PolarHBondContact O-N 3.2Å
51	V	96.9	Very high	94.2	Very high	93 Å²	93	59.9 Å²	59.9	56%	0.564	33%	0.327	S	S	*	.	S	Bend	trans	-103.4	-11.2	175.6	-66	0	0	0	0	112.5	R70	V51-R70 WeakPolarHBondContact CA-O 3.13Å; V51-R70 HydrophobicContact CG1-CB 4.41Å
52	K	95.9	Very high	94.4	Very high	160 Å²	160	60 Å²	60	70%	0.696	33%	0.326	S	S	*	.	S	Bend	trans	-146.7	158.5	178.7	-64.3	-174	179.4	-170.9	0	109.7
53	I	95.4	Very high	94.4	Very high	10 Å²	10	59 Å²	59	5%	0.051	32%	0.32	C	S	.	.			trans	-62.7	134.7	168.5	-54.4	-64.8	0	0	0	108.9	L57 V66 I71 F79 M89 L91	I53-L57 HydrophobicContact CG2-CD1 4.24Å; I53-V66 HydrophobicContact CD1-CB 4.39Å; I53-V66 HydrophobicContact CD1-CG1 4.19Å; I53-V66 HydrophobicContact CD1-CG2 4.13Å; I53-I71 HydrophobicContact CD1-CD1 3.53Å; I53-I71 HydrophobicContact CG1-CD1 4.29Å; I53-F79 HydrophobicContact CG1-CZ 4.33Å; I53-F79 HydrophobicContact CG2-CD1 4.38Å; I53-F79 HydrophobicContact CG2-CE1 3.91Å; I53-M89 HydrophobicContact CD1-CE 3.74Å; I53-L91 HydrophobicContact CD1-CD2 3.65Å
54	P	92.6	Very high	94.5	Very high	14 Å²	14	58.9 Å²	58.9	9%	0.091	32%	0.32	C	S	.	.			trans	-61.2	129.4	175.6	-21	31.5	0	0	0	111.1	P33 L50 S56	P33-P54 HydrophobicContact CB-CB 3.37Å; P33-P54 HydrophobicContact CB-CG 3.93Å; P33-P54 HydrophobicContact CG-CB 3.71Å; P33-P54 HydrophobicContact CG-CG 4.2Å; L50-P54 HydrophobicContact CD1-CG 4.13Å; P54-S56 VanDerWaalsContact C-N 3.26Å; P54-S56 PolarHBondContact O-N 3.44Å
55	P	84.7	Confident	94.5	Very high	87 Å²	87	56.9 Å²	56.9	57%	0.565	31%	0.311	S	S	*	.	S	Bend	trans	-71.8	-17.8	-169	27.6	-36	0	0	0	114	P80	P55-P80 HydrophobicContact CB-CG 4.23Å; P55-P80 VanDerWaalsContact O-CG 3.23Å; P55-P80 WeakPolarHBondContact O-CG 3.49Å
56	S	85.8	Confident	94.6	Very high	84 Å²	84	56.9 Å²	56.9	59%	0.587	31%	0.311	S	S	*	.			trans	-119	88.9	-176.8	-59.4	0	0	0	0	110.5	P33 P54	P33-S56 WeakPolarHBondContact CG-O 3.41Å; P54-S56 VanDerWaalsContact C-N 3.26Å; P54-S56 PolarHBondContact O-N 3.44Å
57	L	92.1	Very high	94.6	Very high	17 Å²	17	54.6 Å²	54.6	9%	0.089	30%	0.302	C	S	.	.			trans	-95.1	141.6	174.1	-64.6	168.6	0	0	0	110	P33 V43 I53 A59 L64 L83	P33-L57 HydrophobicContact CG-CD2 3.86Å; V43-L57 HydrophobicContact CG1-CD2 4.03Å; I53-L57 HydrophobicContact CG2-CD1 4.24Å; L57-A59 PolarHBondContact O-N 2.77Å; L57-L64 HydrophobicContact CD1-CD1 4.48Å; L57-L64 HydrophobicContact CD1-CD2 3.66Å; L57-L64 HydrophobicContact CD2-CD1 3.9Å; L57-L83 HydrophobicContact CB-CD1 4.38Å; L57-L83 HydrophobicContact CB-CD2 4.32Å; L57-L83 HydrophobicContact CD1-CD1 3.77Å
58	P	91.9	Very high	94.7	Very high	33 Å²	33	49.8 Å²	49.8	21%	0.214	28%	0.282	C	S	.	.			trans	-55.6	133.1	173.6	-23.4	30.7	0	0	0	112.1	C31 V43 K60 T61	C31-P58 WeakPolarHBondContact O-CG 3.46Å; V43-P58 HydrophobicContact CG2-CG 4.09Å; P58-K60 PolarHBondContact O-N 2.97Å; P58-T61 VanDerWaalsContact O-CB 3.27Å; P58-T61 WeakPolarHBondContact O-CB 3.38Å; P58-T61 PolarHBondContact O-N 2.74Å; P58-T61 PolarHBondContact O-OG1 3.23Å
59	A	89.7	Confident	94.8	Very high	75 Å²	75	46.4 Å²	46.4	62%	0.62	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.7	-178.1	0	0	0	0	0	114.6	L57 T61 N85	L57-A59 PolarHBondContact O-N 2.77Å; A59-T61 VanDerWaalsContact C-N 3.31Å; A59-N85 PolarHBondContact O-ND2 3.37Å
60	K	91.8	Very high	94.8	Very high	153 Å²	153	51.5 Å²	51.5	67%	0.665	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	5	176	-62.4	-173.7	178.7	-175.1	0	113.4	E41 P58 K62	E41-K60 WeakPolarHBondContact CA-O 3.39Å; E41-K60 WeakPolarHBondContact CB-O 3.22Å; P58-K60 PolarHBondContact O-N 2.97Å; K60-K62 PolarHBondContact O-N 2.7Å
61	T	95.4	Very high	94.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.274	C	S	.	.			trans	-65.9	121.9	-179.6	-53.6	0	0	0	0	109.7	E41 V43 P58 A59 L64 N85 L86	E41-T61 CarbonylContact O-C 3.38Å; E41-T61 WeakPolarHBondContact O-CA 3.45Å; V43-T61 HydrophobicContact CB-CG2 4.04Å; V43-T61 HydrophobicContact CG2-CG2 3.57Å; V43-T61 VanDerWaalsContact CG2-OG1 3.27Å; V43-T61 WeakPolarHBondContact CG2-OG1 3.21Å; P58-T61 VanDerWaalsContact O-CB 3.27Å; P58-T61 WeakPolarHBondContact O-CB 3.38Å; P58-T61 PolarHBondContact O-N 2.74Å; P58-T61 PolarHBondContact O-OG1 3.23Å; A59-T61 VanDerWaalsContact C-N 3.31Å; T61-L64 HydrophobicContact CG2-CB 4.32Å; T61-N85 CarbonylContact O-C 3.47Å; T61-L86 HydrophobicContact CG2-CD1 3.73Å; T61-L86 VanDerWaalsContact O-CA 3.29Å; T61-L86 WeakPolarHBondContact O-CA 3.46Å; T61-L86 PolarHBondContact O-N 3.16Å
62	K	97.5	Very high	94.9	Very high	95 Å²	95	48 Å²	48	41%	0.413	26%	0.263	S	S	.	.			trans	-101	-39.6	173.5	-176	178.2	176.6	-178.7	0	112.3	E41 K60 N85 A87 E88	E41-K62 HydrophobicContact CB-CB 3.82Å; E41-K62 PolarHBondContact O-N 3.21Å; K60-K62 PolarHBondContact O-N 2.7Å; K62-N85 WeakPolarHBondContact CA-O 3.21Å; K62-A87 HydrophobicContact CG-CB 4.13Å; K62-A87 PolarHBondContact O-N 3.39Å; K62-E88 PolarHBondContact O-N 3.45Å
63	S	98.4	Very high	95	Very high	13 Å²	13	44 Å²	44	9%	0.091	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.6	178.7	-50.9	0	0	0	0	110.9	E41 T42 V43 E88	E41-S63 PolarHBondContact O-N 3Å; E41-S63 VanDerWaalsContact O-N 3.15Å; T42-S63 WeakPolarHBondContact CA-O 3.11Å; V43-S63 PolarHBondContact N-O 1.98Å; S63-E88 WeakPolarHBondContact CA-O 3.22Å; S63-E88 PolarHBondContact OG-OE2 3.49Å
64	L	97.9	Very high	95.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	119.4	-179.4	175.8	62.2	0	0	0	110.3	V43 L57 T61 V66 F79 L86 E88 M89 Y90	V43-L64 HydrophobicContact CB-CD1 3.79Å; V43-L64 HydrophobicContact CG1-CD1 3.78Å; L57-L64 HydrophobicContact CD1-CD1 4.48Å; L57-L64 HydrophobicContact CD1-CD2 3.66Å; L57-L64 HydrophobicContact CD2-CD1 3.9Å; T61-L64 HydrophobicContact CG2-CB 4.32Å; L64-V66 HydrophobicContact CD1-CG2 3.77Å; L64-V66 HydrophobicContact CD2-CG2 4.05Å; L64-V66 HydrophobicContact CG-CG2 3.64Å; L64-F79 HydrophobicContact CD2-CE1 4.44Å; L64-L86 HydrophobicContact CB-CD1 3.66Å; L64-E88 PolarHBondContact N-O 3.11Å; L64-M89 HydrophobicContact CB-CG 4.49Å; L64-M89 HydrophobicContact CD2-CE 3.68Å; L64-M89 HydrophobicContact CD2-CG 4.34Å; L64-M89 HydrophobicContact CD2-SD 4.31Å; L64-M89 HydrophobicContact CG-CE 4.48Å; L64-M89 WeakPolarHBondContact O-CA 3.41Å; L64-Y90 PolarHBondContact O-N 2.85Å
65	F	98.4	Very high	95.2	Very high	45 Å²	45	44.3 Å²	44.3	20%	0.197	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	111.4	177.6	-61.5	-95.8	0	0	0	109.5	T42 V43 K44 C45 Q46 Y90	T42-F65 HydrophobicContact CG2-CD2 3.76Å; T42-F65 HydrophobicContact CG2-CE2 3.61Å; V43-F65 PolarHBondContact O-N 3.1Å; K44-F65 HydrophobicContact CG-CB 4.27Å; K44-F65 HydrophobicContact CG-CD2 3.95Å; K44-F65 HydrophobicContact CG-CG 4.37Å; C45-F65 WeakPolarHBondContact CA-O 3.45Å; C45-F65 PolarHBondContact N-O 3.27Å; Q46-F65 HydrophobicContact CG-CB 4.04Å; F65-Y90 AromaticContact CD1-CD2 3.49Å; F65-Y90 HydrophobicContact CD1-CD2 3.49Å; F65-Y90 VanDerWaalsContact CD1-CD2 3.49Å; F65-Y90 HydrophobicContact CD1-CE2 4.14Å; F65-Y90 AromaticContact CD1-CG 3.79Å; F65-Y90 HydrophobicContact CD1-CG 3.79Å; F65-Y90 HydrophobicContact CE1-CD1 4.38Å; F65-Y90 AromaticContact CE1-CD2 3.29Å; F65-Y90 HydrophobicContact CE1-CD2 3.29Å; F65-Y90 HydrophobicContact CE1-CE1 4.49Å; F65-Y90 AromaticContact CE1-CE2 3.44Å; F65-Y90 HydrophobicContact CE1-CE2 3.44Å; F65-Y90 VanDerWaalsContact CE1-CE2 3.44Å; F65-Y90 AromaticContact CE1-CG 3.81Å; F65-Y90 HydrophobicContact CE1-CG 3.81Å; F65-Y90 HydrophobicContact CE2-CD2 4.36Å; F65-Y90 HydrophobicContact CE2-CE2 4.36Å; F65-Y90 HydrophobicContact CG-CD2 4.12Å; F65-Y90 AromaticContact CZ-CD2 3.77Å; F65-Y90 HydrophobicContact CZ-CD2 3.77Å; F65-Y90 AromaticContact CZ-CE2 3.57Å; F65-Y90 HydrophobicContact CZ-CE2 3.57Å
66	V	97.6	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.			trans	-122.6	32.3	177.4	-155.3	0	0	0	0	110.5	C45 L50 I53 L64 N69 I71 M89 Y90 L91 N94	C45-V66 HydrophobicContact CB-CG1 4.19Å; L50-V66 HydrophobicContact CD1-CG1 4.01Å; I53-V66 HydrophobicContact CD1-CB 4.39Å; I53-V66 HydrophobicContact CD1-CG1 4.19Å; I53-V66 HydrophobicContact CD1-CG2 4.13Å; L64-V66 HydrophobicContact CD1-CG2 3.77Å; L64-V66 HydrophobicContact CD2-CG2 4.05Å; L64-V66 HydrophobicContact CG-CG2 3.64Å; V66-N69 VanDerWaalsContact C-ND2 3.3Å; V66-N69 PolarHBondContact O-ND2 3.13Å; V66-I71 HydrophobicContact CG1-CD1 3.58Å; V66-M89 HydrophobicContact CG2-CE 4.42Å; V66-Y90 PolarHBondContact N-O 2.81Å; V66-L91 HydrophobicContact CB-CD2 4Å; V66-L91 HydrophobicContact CG2-CD2 4.43Å; V66-N94 PolarHBondContact O-ND2 3.49Å
67	T	98.1	Very high	96	Very high	22 Å²	22	44.8 Å²	44.8	14%	0.135	25%	0.245	C	C	.	.			trans	-72.7	148.3	-174	63	0	0	0	0	112.7	Q46 N47 N69 S92	Q46-T67 VanDerWaalsContact CA-O 3.28Å; Q46-T67 WeakPolarHBondContact CA-O 3.47Å; Q46-T67 WeakPolarHBondContact CG-OG1 3.44Å; Q46-T67 PolarHBondContact NE2-OG1 3.25Å; N47-T67 PolarHBondContact N-O 2.96Å; N47-T67 VanDerWaalsContact N-O 3.11Å; T67-N69 PolarHBondContact O-ND2 3.04Å; T67-S92 CarbonylContact C-O 3.27Å; T67-S92 WeakPolarHBondContact CA-O 3.46Å; T67-S92 WeakPolarHBondContact CB-O 3.45Å; T67-S92 WeakPolarHBondContact CG2-OG 3.34Å
68	G	98.1	Very high	96.1	Very high	24 Å²	24	45 Å²	45	25%	0.247	25%	0.248	C	C	.	.	S	Bend	trans	71.4	33.2	173.7	0	0	0	0	0	113.9	N47 S92 G93	N47-G68 VanDerWaalsContact CA-O 3.28Å; N47-G68 WeakPolarHBondContact CA-O 3.49Å; N47-G68 WeakPolarHBondContact OD1-CA 2.93Å; N47-G68 PolarHBondContact OD1-O 2.85Å; G68-S92 PolarHBondContact N-O 2.92Å; G68-G93 CarbonylContact C-O 3.6Å; G68-G93 WeakPolarHBondContact CA-O 3.42Å; G68-G93 PolarHBondContact N-O 3.42Å
69	N	98.3	Very high	96.2	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.032	24%	0.238	C	C	.	.	S	Bend	trans	-111.7	-161.7	175.8	-64	-77.2	0	0	0	110.7	C45 Q48 G49 L50 V66 T67 I71 G93 N94	C45-N69 PolarHBondContact O-ND2 3.41Å; Q48-N69 WeakPolarHBondContact CA-OD1 3.5Å; Q48-N69 PolarHBondContact N-OD1 2.83Å; G49-N69 PolarHBondContact N-OD1 3.15Å; G49-N69 VanDerWaalsContact N-OD1 3.13Å; L50-N69 HydrophobicContact CB-CB 3.94Å; L50-N69 PolarHBondContact N-OD1 2.97Å; L50-N69 VanDerWaalsContact N-OD1 3.13Å; L50-N69 WeakPolarHBondContact O-CB 3.35Å; V66-N69 VanDerWaalsContact C-ND2 3.3Å; V66-N69 PolarHBondContact O-ND2 3.13Å; T67-N69 PolarHBondContact O-ND2 3.04Å; N69-I71 HydrophobicContact CB-CG1 4.33Å; N69-G93 PolarHBondContact N-O 3.48Å; N69-N94 VanDerWaalsContact CA-OD1 3.25Å; N69-N94 WeakPolarHBondContact CA-OD1 3.39Å; N69-N94 WeakPolarHBondContact CB-OD1 3.41Å; N69-N94 PolarHBondContact N-OD1 3.39Å; N69-N94 WeakPolarHBondContact O-CA 3.46Å; N69-N94 PolarHBondContact O-OD1 2.94Å
70	R	98.1	Very high	96.3	Very high	128 Å²	128	43.8 Å²	43.8	48%	0.483	23%	0.233	S	C	.	.			trans	-124.7	40.2	-176.9	-61.3	-174.3	-66.4	-125.8	-6.3	110.8	G49 L50 V51 A72 N94 E95	G49-R70 PolarHBondContact O-NH2 3.2Å; L50-R70 CarbonylContact O-C 3.38Å; L50-R70 VanDerWaalsContact O-C 3.27Å; L50-R70 WeakPolarHBondContact O-CA 3.42Å; L50-R70 PolarHBondContact O-N 3.1Å; V51-R70 WeakPolarHBondContact CA-O 3.13Å; V51-R70 HydrophobicContact CG1-CB 4.41Å; R70-A72 PolarHBondContact O-N 3.38Å; R70-N94 PolarHBondContact N-OD1 2.9Å; R70-E95 WeakPolarHBondContact CG-OE1 3.18Å
71	I	98.1	Very high	96.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.			trans	-79.8	115.9	179.7	-58.5	179.9	0	0	0	107.5	L50 I53 V66 N69 I74 L91 N94 E95 M96	L50-I71 PolarHBondContact O-N 3.2Å; I53-I71 HydrophobicContact CD1-CD1 3.53Å; I53-I71 HydrophobicContact CG1-CD1 4.29Å; V66-I71 HydrophobicContact CG1-CD1 3.58Å; N69-I71 HydrophobicContact CB-CG1 4.33Å; I71-I74 HydrophobicContact CG2-CG1 4.37Å; I71-L91 HydrophobicContact CD1-CD2 4.44Å; I71-N94 HydrophobicContact CB-CB 4.44Å; I71-N94 PolarHBondContact N-OD1 2.79Å; I71-E95 CarbonylContact O-C 3.27Å; I71-E95 VanDerWaalsContact O-C 3.3Å; I71-E95 PolarHBondContact O-N 2.66Å; I71-M96 VanDerWaalsContact O-CA 3.27Å; I71-M96 WeakPolarHBondContact O-CA 3.39Å; I71-M96 PolarHBondContact O-N 2.95Å; I71-M96 VanDerWaalsContact O-N 3.09Å
72	A	97.6	Very high	96.1	Very high	40 Å²	40	46.6 Å²	46.6	33%	0.331	25%	0.247	S	C	.	.			trans	-91.2	-26.5	-177.4	0	0	0	0	0	113.6	R70 E95 M96 E97 D98	R70-A72 PolarHBondContact O-N 3.38Å; A72-E95 WeakPolarHBondContact CA-O 3.2Å; A72-M96 CarbonylContact O-C 3.49Å; A72-M96 WeakPolarHBondContact O-CA 3.39Å; A72-E97 PolarHBondContact O-N 2.9Å; A72-D98 PolarHBondContact O-N 3.2Å
73	E	97.4	Very high	96	Very high	77 Å²	77	42.1 Å²	42.1	36%	0.36	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.2	-172.3	-176	-167.5	133.2	0	0	110.9	N75 D98 L100	E73-N75 PolarHBondContact OE1-ND2 2.84Å; E73-D98 WeakPolarHBondContact CA-O 3.49Å; E73-D98 HydrophobicContact CB-CB 4.44Å; E73-D98 HydrophobicContact CG-CB 4.04Å; E73-L100 HydrophobicContact CG-CD1 3.99Å; E73-L100 HydrophobicContact CG-CG 4.02Å; E73-L100 WeakPolarHBondContact OE1-CD1 3.43Å
74	I	97.4	Very high	95.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.5	162.8	-60.5	-175	0	0	0	109.9	I71 F79 L91 M96 D98 L100 A103 F104	I71-I74 HydrophobicContact CG2-CG1 4.37Å; I74-F79 HydrophobicContact CG2-CE2 3.78Å; I74-L91 HydrophobicContact CD1-CD1 3.36Å; I74-L91 HydrophobicContact CD1-CD2 4.04Å; I74-L91 HydrophobicContact CD1-CG 4.31Å; I74-M96 HydrophobicContact CD1-CE 3.41Å; I74-M96 VanDerWaalsContact CD1-CE 3.41Å; I74-M96 HydrophobicContact CD1-SD 4.24Å; I74-M96 HydrophobicContact CG1-CE 3.71Å; I74-M96 HydrophobicContact CG1-SD 4.26Å; I74-D98 PolarHBondContact N-O 3.39Å; I74-L100 PolarHBondContact O-N 3.11Å; I74-A103 HydrophobicContact CB-CB 4.42Å; I74-A103 HydrophobicContact CG2-CB 3.77Å; I74-F104 HydrophobicContact CG2-CE1 4.37Å
75	N	95.9	Very high	95.7	Very high	31 Å²	31	49.6 Å²	49.6	17%	0.166	26%	0.264	C	S	.	.			trans	-142.5	-179.5	-178.9	63.2	30.4	0	0	0	111.1	E73 S77 S78 L100	E73-N75 PolarHBondContact OE1-ND2 2.84Å; N75-S77 PolarHBondContact O-N 2.95Å; N75-S77 WeakPolarHBondContact OD1-CA 3.31Å; N75-S77 WeakPolarHBondContact OD1-CB 3.31Å; N75-S77 PolarHBondContact OD1-N 2.89Å; N75-S77 PolarHBondContact OD1-OG 3.37Å; N75-S78 PolarHBondContact N-OG 2.94Å; N75-S78 WeakPolarHBondContact O-CB 3.28Å; N75-S78 PolarHBondContact O-N 3.48Å; N75-S78 PolarHBondContact O-OG 2.9Å; N75-S78 PolarHBondContact OD1-N 2.89Å; N75-S78 VanDerWaalsContact OD1-N 3.08Å; N75-S78 PolarHBondContact OD1-OG 3.49Å; N75-S78 VanDerWaalsContact OD1-OG 3.07Å; N75-L100 HydrophobicContact CB-CB 3.99Å; N75-L100 HydrophobicContact CB-CD1 4.1Å; N75-L100 HydrophobicContact CB-CG 4.41Å
76	D	92.4	Very high	95.7	Very high	102 Å²	102	47.4 Å²	47.4	55%	0.545	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-55.6	-33.3	179.5	68.6	-20.6	0	0	0	114.3	S78	D76-S78 VanDerWaalsContact C-N 3.31Å; D76-S78 PolarHBondContact O-N 2.86Å
77	S	92.9	Very high	95.7	Very high	79 Å²	79	48.3 Å²	48.3	55%	0.552	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-78	-12.8	178.3	78.8	0	0	0	0	114.1	N75 F79	N75-S77 PolarHBondContact O-N 2.95Å; N75-S77 WeakPolarHBondContact OD1-CA 3.31Å; N75-S77 WeakPolarHBondContact OD1-CB 3.31Å; N75-S77 PolarHBondContact OD1-N 2.89Å; N75-S77 PolarHBondContact OD1-OG 3.37Å; S77-F79 PolarHBondContact O-N 2.72Å
78	S	95.2	Very high	95.7	Very high	20 Å²	20	49.9 Å²	49.9	14%	0.14	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-66.9	-25.3	-179.2	-60.2	0	0	0	0	112.4	N75 D76	N75-S78 PolarHBondContact N-OG 2.94Å; N75-S78 WeakPolarHBondContact O-CB 3.28Å; N75-S78 PolarHBondContact O-N 3.48Å; N75-S78 PolarHBondContact O-OG 2.9Å; N75-S78 PolarHBondContact OD1-N 2.89Å; N75-S78 VanDerWaalsContact OD1-N 3.08Å; N75-S78 PolarHBondContact OD1-OG 3.49Å; N75-S78 VanDerWaalsContact OD1-OG 3.07Å; D76-S78 VanDerWaalsContact C-N 3.31Å; D76-S78 PolarHBondContact O-N 2.86Å
79	F	94.2	Very high	95.8	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.018	26%	0.256	C	S	.	.			trans	-124.6	82.6	174	-54.3	-80.8	0	0	0	109.5	I53 L64 I74 S77 T81 L83 M89 A103 F104 N106 L107	I53-F79 HydrophobicContact CG1-CZ 4.33Å; I53-F79 HydrophobicContact CG2-CD1 4.38Å; I53-F79 HydrophobicContact CG2-CE1 3.91Å; L64-F79 HydrophobicContact CD2-CE1 4.44Å; I74-F79 HydrophobicContact CG2-CE2 3.78Å; S77-F79 PolarHBondContact O-N 2.72Å; F79-T81 PolarHBondContact O-N 2.93Å; F79-L83 HydrophobicContact CD1-CD1 4.27Å; F79-M89 HydrophobicContact CE1-CE 3.73Å; F79-M89 HydrophobicContact CE1-SD 4.02Å; F79-M89 HydrophobicContact CZ-CE 3.41Å; F79-M89 VanDerWaalsContact CZ-CE 3.41Å; F79-M89 HydrophobicContact CZ-SD 3.59Å; F79-M89 VanDerWaalsContact CZ-SD 3.59Å; F79-A103 VanDerWaalsContact CD2-O 3.28Å; F79-A103 WeakPolarHBondContact CD2-O 3.29Å; F79-A103 WeakPolarHBondContact CE2-O 3.49Å; F79-F104 HydrophobicContact CE2-CD1 4.44Å; F79-N106 HydrophobicContact CB-CB 4.12Å; F79-N106 PolarHBondContact O-ND2 2.9Å; F79-L107 HydrophobicContact CB-CD2 4.46Å; F79-L107 HydrophobicContact CD1-CD2 4Å; F79-L107 HydrophobicContact CD2-CD1 4.3Å; F79-L107 HydrophobicContact CD2-CG 4.45Å; F79-L107 HydrophobicContact CE1-CD1 4.29Å; F79-L107 HydrophobicContact CE1-CD2 4.39Å; F79-L107 HydrophobicContact CE2-CD1 4.02Å; F79-L107 HydrophobicContact CG-CD2 4.08Å; F79-L107 HydrophobicContact CG-CG 4.45Å; F79-L107 HydrophobicContact CZ-CD1 4.01Å
80	P	91	Very high	95.8	Very high	79 Å²	79	50.4 Å²	50.4	51%	0.513	26%	0.262	S	S	.	.			trans	-67.9	-19.8	-174.8	27.6	-35.5	0	0	0	113.2	P55	P55-P80 HydrophobicContact CB-CG 4.23Å; P55-P80 VanDerWaalsContact O-CG 3.23Å; P55-P80 WeakPolarHBondContact O-CG 3.49Å
81	T	90.8	Very high	95.8	Very high	72 Å²	72	44.3 Å²	44.3	44%	0.442	24%	0.239	S	C	.	.	S	Bend	trans	-114.2	138.7	177.7	56.5	0	0	0	0	110.5	F79 L83	F79-T81 PolarHBondContact O-N 2.93Å; T81-L83 PolarHBondContact O-N 2.93Å
82	R	93.6	Very high	95.8	Very high	141 Å²	141	45.4 Å²	45.4	53%	0.532	25%	0.247	S	C	.	.			trans	-66.9	121.4	173.3	-165.4	172.7	-168.5	-143.9	8.6	110.8	E84 N106 P108	R82-E84 VanDerWaalsContact CD-OE1 3.25Å; R82-E84 WeakPolarHBondContact CD-OE1 3.19Å; R82-E84 IonicContact CZ-OE1 2.86Å; R82-E84 IonicContact CZ-OE2 3.17Å; R82-E84 IonicContact NE-OE1 3.11Å; R82-E84 PolarHBondContact NE-OE1 3.01Å; R82-E84 IonicContact NH1-OE1 3.5Å; R82-E84 PolarHBondContact NH1-OE1 2.91Å; R82-E84 IonicContact NH1-OE2 2.78Å; R82-N106 WeakPolarHBondContact CA-O 3.33Å; R82-P108 HydrophobicContact CG-CG 4.37Å
83	L	94.1	Very high	95.9	Very high	2 Å²	2	45 Å²	45	1%	0.01	25%	0.247	C	C	.	.			trans	-101.8	83.5	-177.7	-63.1	175.7	0	0	0	110	L57 F79 T81 N85 L86 N106 L107	L57-L83 HydrophobicContact CB-CD1 4.38Å; L57-L83 HydrophobicContact CB-CD2 4.32Å; L57-L83 HydrophobicContact CD1-CD1 3.77Å; F79-L83 HydrophobicContact CD1-CD1 4.27Å; T81-L83 PolarHBondContact O-N 2.93Å; L83-N85 PolarHBondContact O-N 2.8Å; L83-L86 HydrophobicContact CB-CB 3.8Å; L83-L86 HydrophobicContact CD1-CB 4.46Å; L83-L86 HydrophobicContact CD1-CD2 4.03Å; L83-L86 PolarHBondContact O-N 3.07Å; L83-N106 PolarHBondContact N-O 2.89Å; L83-L107 HydrophobicContact CB-CD2 3.94Å; L83-L107 HydrophobicContact CD1-CD2 3.86Å; L83-L107 HydrophobicContact CG-CD2 4.23Å
84	E	94.8	Very high	95.9	Very high	82 Å²	82	41.8 Å²	41.8	38%	0.383	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.2	-175.1	-62	-69.7	176.7	0	0	113.6	R82 P108 N109	R82-E84 VanDerWaalsContact CD-OE1 3.25Å; R82-E84 WeakPolarHBondContact CD-OE1 3.19Å; R82-E84 IonicContact CZ-OE1 2.86Å; R82-E84 IonicContact CZ-OE2 3.17Å; R82-E84 IonicContact NE-OE1 3.11Å; R82-E84 PolarHBondContact NE-OE1 3.01Å; R82-E84 IonicContact NH1-OE1 3.5Å; R82-E84 PolarHBondContact NH1-OE1 2.91Å; R82-E84 IonicContact NH1-OE2 2.78Å; E84-P108 WeakPolarHBondContact OE2-CG 3.35Å; E84-N109 PolarHBondContact O-ND2 2.9Å
85	N	96	Very high	95.9	Very high	87 Å²	87	46.4 Å²	46.4	47%	0.465	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-11.5	-176.9	-63	-51.6	0	0	0	113.7	A59 T61 K62 L83 A87	A59-N85 PolarHBondContact O-ND2 3.37Å; T61-N85 CarbonylContact O-C 3.47Å; K62-N85 WeakPolarHBondContact CA-O 3.21Å; L83-N85 PolarHBondContact O-N 2.8Å; N85-A87 PolarHBondContact O-N 3.14Å; N85-A87 VanDerWaalsContact O-N 3.16Å
86	L	97.6	Very high	96	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.			trans	-71.1	115.5	-173.3	-169.5	77.2	0	0	0	109.5	T61 L64 L83 L107 N109 L110	T61-L86 HydrophobicContact CG2-CD1 3.73Å; T61-L86 VanDerWaalsContact O-CA 3.29Å; T61-L86 WeakPolarHBondContact O-CA 3.46Å; T61-L86 PolarHBondContact O-N 3.16Å; L64-L86 HydrophobicContact CB-CD1 3.66Å; L83-L86 HydrophobicContact CB-CB 3.8Å; L83-L86 HydrophobicContact CD1-CB 4.46Å; L83-L86 HydrophobicContact CD1-CD2 4.03Å; L83-L86 PolarHBondContact O-N 3.07Å; L86-L107 HydrophobicContact CD2-CD1 4.12Å; L86-L107 HydrophobicContact CD2-CD2 3.69Å; L86-L107 HydrophobicContact CD2-CG 4.44Å; L86-N109 CarbonylContact O-C 3.17Å; L86-N109 VanDerWaalsContact O-C 3.3Å; L86-L110 PolarHBondContact O-N 2.72Å
87	A	98.4	Very high	96.2	Very high	18 Å²	18	43.6 Å²	43.6	15%	0.149	24%	0.236	C	C	.	.			trans	-112.5	-29.3	-177.4	0	0	0	0	0	112.2	K62 N85 N109 V111 Q112	K62-A87 HydrophobicContact CG-CB 4.13Å; K62-A87 PolarHBondContact O-N 3.39Å; N85-A87 PolarHBondContact O-N 3.14Å; N85-A87 VanDerWaalsContact O-N 3.16Å; A87-N109 WeakPolarHBondContact CA-O 3.29Å; A87-V111 WeakPolarHBondContact O-CA 3.28Å; A87-V111 PolarHBondContact O-N 3.24Å; A87-Q112 PolarHBondContact O-N 3.24Å
88	E	98.8	Very high	96.4	Very high	56 Å²	56	41.6 Å²	41.6	26%	0.262	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.8	-175.2	-60.8	166.9	-158.4	0	0	110.4	K62 S63 L64 Y90 Q112	K62-E88 PolarHBondContact O-N 3.45Å; S63-E88 WeakPolarHBondContact CA-O 3.22Å; S63-E88 PolarHBondContact OG-OE2 3.49Å; L64-E88 PolarHBondContact N-O 3.11Å; E88-Y90 HydrophobicContact CB-CE2 3.82Å; E88-Y90 PolarHBondContact OE2-OH 2.63Å; E88-Q112 WeakPolarHBondContact CA-O 3.24Å; E88-Q112 HydrophobicContact CG-CB 4.27Å
89	M	98.4	Very high	96.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.5	176.6	-169.1	174.6	-173.7	0	0	111.3	I53 L64 V66 F79 L91 L107 L110 Q112 L113 D114	I53-M89 HydrophobicContact CD1-CE 3.74Å; L64-M89 HydrophobicContact CB-CG 4.49Å; L64-M89 HydrophobicContact CD2-CE 3.68Å; L64-M89 HydrophobicContact CD2-CG 4.34Å; L64-M89 HydrophobicContact CD2-SD 4.31Å; L64-M89 HydrophobicContact CG-CE 4.48Å; L64-M89 WeakPolarHBondContact O-CA 3.41Å; V66-M89 HydrophobicContact CG2-CE 4.42Å; F79-M89 HydrophobicContact CE1-CE 3.73Å; F79-M89 HydrophobicContact CE1-SD 4.02Å; F79-M89 HydrophobicContact CZ-CE 3.41Å; F79-M89 VanDerWaalsContact CZ-CE 3.41Å; F79-M89 HydrophobicContact CZ-SD 3.59Å; F79-M89 VanDerWaalsContact CZ-SD 3.59Å; M89-L91 HydrophobicContact CE-CD1 3.48Å; M89-L91 VanDerWaalsContact CE-CD1 3.48Å; M89-L91 HydrophobicContact CE-CD2 3.7Å; M89-L91 HydrophobicContact CE-CG 3.65Å; M89-L91 HydrophobicContact CG-CD1 4.12Å; M89-L91 HydrophobicContact CG-CG 4.22Å; M89-L91 HydrophobicContact SD-CD1 3.79Å; M89-L91 HydrophobicContact SD-CG 4.36Å; M89-L107 HydrophobicContact SD-CD1 4.24Å; M89-L110 HydrophobicContact CB-CD1 3.83Å; M89-Q112 PolarHBondContact N-O 3.46Å; M89-L113 HydrophobicContact CB-CD1 4.18Å; M89-L113 HydrophobicContact CG-CD1 4.45Å; M89-L113 WeakPolarHBondContact O-CA 3.22Å; M89-D114 PolarHBondContact O-N 3.17Å
90	Y	98.8	Very high	96.6	Very high	41 Å²	41	43.5 Å²	43.5	16%	0.161	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	112.5	-179.6	-56.3	-95.3	0	0	0	110.1	L64 F65 V66 E88 Q112 D114	L64-Y90 PolarHBondContact O-N 2.85Å; F65-Y90 AromaticContact CD1-CD2 3.49Å; F65-Y90 HydrophobicContact CD1-CD2 3.49Å; F65-Y90 VanDerWaalsContact CD1-CD2 3.49Å; F65-Y90 HydrophobicContact CD1-CE2 4.14Å; F65-Y90 AromaticContact CD1-CG 3.79Å; F65-Y90 HydrophobicContact CD1-CG 3.79Å; F65-Y90 HydrophobicContact CE1-CD1 4.38Å; F65-Y90 AromaticContact CE1-CD2 3.29Å; F65-Y90 HydrophobicContact CE1-CD2 3.29Å; F65-Y90 HydrophobicContact CE1-CE1 4.49Å; F65-Y90 AromaticContact CE1-CE2 3.44Å; F65-Y90 HydrophobicContact CE1-CE2 3.44Å; F65-Y90 VanDerWaalsContact CE1-CE2 3.44Å; F65-Y90 AromaticContact CE1-CG 3.81Å; F65-Y90 HydrophobicContact CE1-CG 3.81Å; F65-Y90 HydrophobicContact CE2-CD2 4.36Å; F65-Y90 HydrophobicContact CE2-CE2 4.36Å; F65-Y90 HydrophobicContact CG-CD2 4.12Å; F65-Y90 AromaticContact CZ-CD2 3.77Å; F65-Y90 HydrophobicContact CZ-CD2 3.77Å; F65-Y90 AromaticContact CZ-CE2 3.57Å; F65-Y90 HydrophobicContact CZ-CE2 3.57Å; V66-Y90 PolarHBondContact N-O 2.81Å; E88-Y90 HydrophobicContact CB-CE2 3.82Å; E88-Y90 PolarHBondContact OE2-OH 2.63Å; Y90-Q112 VanDerWaalsContact CE1-NE2 3.35Å; Y90-Q112 PolarHBondContact OH-NE2 3.43Å; Y90-Q112 VanDerWaalsContact OH-NE2 3.09Å; Y90-D114 HydrophobicContact CD1-CB 3.77Å; Y90-D114 HydrophobicContact CE1-CB 4.48Å; Y90-D114 HydrophobicContact CG-CB 4.48Å
91	L	98.4	Very high	96.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.			trans	-119.3	18.1	-178	-75.2	158.8	0	0	0	111.7	I53 V66 I71 I74 M89 N94 M96 L113 D114 L115 N118	I53-L91 HydrophobicContact CD1-CD2 3.65Å; V66-L91 HydrophobicContact CB-CD2 4Å; V66-L91 HydrophobicContact CG2-CD2 4.43Å; I71-L91 HydrophobicContact CD1-CD2 4.44Å; I74-L91 HydrophobicContact CD1-CD1 3.36Å; I74-L91 HydrophobicContact CD1-CD2 4.04Å; I74-L91 HydrophobicContact CD1-CG 4.31Å; M89-L91 HydrophobicContact CE-CD1 3.48Å; M89-L91 VanDerWaalsContact CE-CD1 3.48Å; M89-L91 HydrophobicContact CE-CD2 3.7Å; M89-L91 HydrophobicContact CE-CG 3.65Å; M89-L91 HydrophobicContact CG-CD1 4.12Å; M89-L91 HydrophobicContact CG-CG 4.22Å; M89-L91 HydrophobicContact SD-CD1 3.79Å; M89-L91 HydrophobicContact SD-CG 4.36Å; L91-N94 PolarHBondContact O-ND2 2.77Å; L91-M96 HydrophobicContact CB-CE 4.27Å; L91-M96 HydrophobicContact CD1-CE 4.16Å; L91-M96 HydrophobicContact CD2-CE 4.33Å; L91-M96 HydrophobicContact CG-CE 4.5Å; L91-L113 HydrophobicContact CD1-CD1 4.08Å; L91-D114 CarbonylContact C-O 3.19Å; L91-D114 WeakPolarHBondContact CA-O 3.45Å; L91-D114 WeakPolarHBondContact CB-O 3.35Å; L91-D114 PolarHBondContact N-O 2.89Å; L91-L115 HydrophobicContact CB-CD2 3.9Å; L91-L115 HydrophobicContact CD1-CD2 3.84Å; L91-N118 PolarHBondContact O-ND2 3.09Å; L91-N118 VanDerWaalsContact O-ND2 3.12Å
92	S	98.5	Very high	97	Very high	22 Å²	22	39.5 Å²	39.5	15%	0.154	21%	0.211	C	C	.	.			trans	-68.5	147.8	-176.5	44.9	0	0	0	0	113.7	T67 G68 D114 S116	T67-S92 CarbonylContact C-O 3.27Å; T67-S92 WeakPolarHBondContact CA-O 3.46Å; T67-S92 WeakPolarHBondContact CB-O 3.45Å; T67-S92 WeakPolarHBondContact CG2-OG 3.34Å; G68-S92 PolarHBondContact N-O 2.92Å; S92-D114 VanDerWaalsContact CB-OD2 3.24Å; S92-D114 WeakPolarHBondContact CB-OD2 3.46Å; S92-D114 PolarHBondContact N-O 3.11Å; S92-D114 PolarHBondContact OG-OD2 2.56Å; S92-S116 CarbonylContact C-O 3.58Å; S92-S116 WeakPolarHBondContact CA-O 3.49Å; S92-S116 WeakPolarHBondContact CB-O 3.46Å; S92-S116 VanDerWaalsContact CB-OG 3.24Å; S92-S116 WeakPolarHBondContact CB-OG 3.19Å
93	G	98.1	Very high	97.2	Very high	32 Å²	32	32.9 Å²	32.9	33%	0.33	19%	0.186	S	C	.	.	S	Bend	trans	67.8	36.9	-179.4	0	0	0	0	0	112.9	G68 N69 S116 N117	G68-G93 CarbonylContact C-O 3.6Å; G68-G93 WeakPolarHBondContact CA-O 3.42Å; G68-G93 PolarHBondContact N-O 3.42Å; N69-G93 PolarHBondContact N-O 3.48Å; G93-S116 PolarHBondContact N-O 3.17Å; G93-N117 WeakPolarHBondContact CA-O 3.15Å; G93-N117 PolarHBondContact N-O 3.4Å; G93-N117 VanDerWaalsContact N-O 3.12Å
94	N	98.4	Very high	97.3	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	19%	0.185	C	C	.	.	S	Bend	trans	-101	-172.7	169.6	-82.2	-83.8	0	0	0	109.8	V66 N69 R70 I71 L91 N117 N118	V66-N94 PolarHBondContact O-ND2 3.49Å; N69-N94 VanDerWaalsContact CA-OD1 3.25Å; N69-N94 WeakPolarHBondContact CA-OD1 3.39Å; N69-N94 WeakPolarHBondContact CB-OD1 3.41Å; N69-N94 PolarHBondContact N-OD1 3.39Å; N69-N94 WeakPolarHBondContact O-CA 3.46Å; N69-N94 PolarHBondContact O-OD1 2.94Å; R70-N94 PolarHBondContact N-OD1 2.9Å; I71-N94 HydrophobicContact CB-CB 4.44Å; I71-N94 PolarHBondContact N-OD1 2.79Å; L91-N94 PolarHBondContact O-ND2 2.77Å; N94-N117 PolarHBondContact N-O 3.08Å; N94-N118 WeakPolarHBondContact CA-OD1 3.44Å; N94-N118 WeakPolarHBondContact CB-OD1 3.31Å; N94-N118 PolarHBondContact N-OD1 3.28Å; N94-N118 PolarHBondContact O-OD1 2.81Å; N94-N118 VanDerWaalsContact O-OD1 3.09Å
95	E	97.2	Very high	97.4	Very high	96 Å²	96	35.7 Å²	35.7	45%	0.449	20%	0.196	S	C	.	.			trans	-107.6	33.5	176.5	-64.9	171.3	-176.8	0	0	109.6	R70 I71 A72 E97	R70-E95 WeakPolarHBondContact CG-OE1 3.18Å; I71-E95 CarbonylContact O-C 3.27Å; I71-E95 VanDerWaalsContact O-C 3.3Å; I71-E95 PolarHBondContact O-N 2.66Å; A72-E95 WeakPolarHBondContact CA-O 3.2Å; E95-E97 PolarHBondContact O-N 2.67Å
96	M	97.6	Very high	97.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.			trans	-69.8	119.6	-169.2	-168	176.1	-56.3	0	0	111.1	I71 A72 I74 L91 V99 L115 N118 I119 I120	I71-M96 VanDerWaalsContact O-CA 3.27Å; I71-M96 WeakPolarHBondContact O-CA 3.39Å; I71-M96 PolarHBondContact O-N 2.95Å; I71-M96 VanDerWaalsContact O-N 3.09Å; A72-M96 CarbonylContact O-C 3.49Å; A72-M96 WeakPolarHBondContact O-CA 3.39Å; I74-M96 HydrophobicContact CD1-CE 3.41Å; I74-M96 VanDerWaalsContact CD1-CE 3.41Å; I74-M96 HydrophobicContact CD1-SD 4.24Å; I74-M96 HydrophobicContact CG1-CE 3.71Å; I74-M96 HydrophobicContact CG1-SD 4.26Å; L91-M96 HydrophobicContact CB-CE 4.27Å; L91-M96 HydrophobicContact CD1-CE 4.16Å; L91-M96 HydrophobicContact CD2-CE 4.33Å; L91-M96 HydrophobicContact CG-CE 4.5Å; M96-V99 HydrophobicContact CG-CG2 4.5Å; M96-V99 HydrophobicContact SD-CG2 3.65Å; M96-L115 HydrophobicContact CE-CD2 3.71Å; M96-L115 HydrophobicContact SD-CD2 3.57Å; M96-L115 VanDerWaalsContact SD-CD2 3.57Å; M96-N118 HydrophobicContact CB-CB 4.03Å; M96-N118 WeakPolarHBondContact CB-OD1 3.29Å; M96-N118 PolarHBondContact N-OD1 2.98Å; M96-I119 CarbonylContact O-C 3.16Å; M96-I119 WeakPolarHBondContact O-CA 3.4Å; M96-I119 PolarHBondContact O-N 3.28Å; M96-I120 HydrophobicContact CG-CG1 4.48Å; M96-I120 WeakPolarHBondContact O-CA 2.97Å; M96-I120 WeakPolarHBondContact O-CG1 3.43Å; M96-I120 PolarHBondContact O-N 3.17Å
97	E	96.9	Very high	97.3	Very high	74 Å²	74	33.9 Å²	33.9	35%	0.346	19%	0.187	S	C	.	.			trans	-101	-35.2	176.8	-66.2	-177.1	-144.7	0	0	111.1	A72 E95 I119 I120 Q121 N122	A72-E97 PolarHBondContact O-N 2.9Å; E95-E97 PolarHBondContact O-N 2.67Å; E97-I119 HydrophobicContact CG-CD1 3.68Å; E97-I119 HydrophobicContact CG-CG1 3.85Å; E97-I120 CarbonylContact O-C 3.57Å; E97-I120 WeakPolarHBondContact O-CA 3.27Å; E97-Q121 PolarHBondContact O-N 2.88Å; E97-Q121 PolarHBondContact OE2-NE2 2.85Å; E97-Q121 VanDerWaalsContact OE2-NE2 3.16Å; E97-N122 PolarHBondContact O-N 3.04Å
98	D	97	Very high	97.1	Very high	38 Å²	38	33.5 Å²	33.5	20%	0.203	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.8	-169.4	-67.3	-56.6	0	0	0	113.2	A72 E73 I74 L100 N122	A72-D98 PolarHBondContact O-N 3.2Å; E73-D98 WeakPolarHBondContact CA-O 3.49Å; E73-D98 HydrophobicContact CB-CB 4.44Å; E73-D98 HydrophobicContact CG-CB 4.04Å; I74-D98 PolarHBondContact N-O 3.39Å; D98-L100 HydrophobicContact CB-CD2 3.93Å; D98-L100 HydrophobicContact CB-CG 4.35Å; D98-N122 VanDerWaalsContact OD1-CB 3.28Å; D98-N122 WeakPolarHBondContact OD1-CB 3.48Å; D98-N122 PolarHBondContact OD1-ND2 2.88Å
99	V	97.4	Very high	97	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	99.4	165.1	-177.4	0	0	0	0	108	M96 A103 F104 I120 N122 F123 S124 A127	M96-V99 HydrophobicContact CG-CG2 4.5Å; M96-V99 HydrophobicContact SD-CG2 3.65Å; V99-A103 HydrophobicContact CG1-CB 3.9Å; V99-F104 HydrophobicContact CG1-CE2 3.65Å; V99-F104 HydrophobicContact CG1-CZ 4.05Å; V99-I120 HydrophobicContact CG2-CD1 4.43Å; V99-N122 PolarHBondContact N-O 2.85Å; V99-F123 HydrophobicContact CB-CD1 4.33Å; V99-F123 HydrophobicContact CB-CD2 3.99Å; V99-F123 HydrophobicContact CB-CE1 4.44Å; V99-F123 HydrophobicContact CB-CE2 4.12Å; V99-F123 HydrophobicContact CB-CG 4.09Å; V99-F123 HydrophobicContact CB-CZ 4.33Å; V99-F123 HydrophobicContact CG1-CD1 4.29Å; V99-F123 HydrophobicContact CG1-CD2 4.44Å; V99-F123 HydrophobicContact CG1-CE1 3.98Å; V99-F123 HydrophobicContact CG1-CE2 4.14Å; V99-F123 HydrophobicContact CG1-CZ 3.89Å; V99-F123 HydrophobicContact CG2-CD2 3.94Å; V99-F123 HydrophobicContact CG2-CE2 3.92Å; V99-F123 HydrophobicContact CG2-CZ 4.49Å; V99-S124 WeakPolarHBondContact O-CB 3.4Å; V99-S124 PolarHBondContact O-N 3.21Å; V99-A127 HydrophobicContact CG1-CB 3.79Å
100	L	96.9	Very high	97	Very high	63 Å²	63	34.4 Å²	34.4	33%	0.33	19%	0.189	S	C	.	.			trans	-84.5	170.6	-172.2	-59.1	-168.9	0	0	0	113.2	E73 I74 N75 D98 G102 A103	E73-L100 HydrophobicContact CG-CD1 3.99Å; E73-L100 HydrophobicContact CG-CG 4.02Å; E73-L100 WeakPolarHBondContact OE1-CD1 3.43Å; I74-L100 PolarHBondContact O-N 3.11Å; N75-L100 HydrophobicContact CB-CB 3.99Å; N75-L100 HydrophobicContact CB-CD1 4.1Å; N75-L100 HydrophobicContact CB-CG 4.41Å; D98-L100 HydrophobicContact CB-CD2 3.93Å; D98-L100 HydrophobicContact CB-CG 4.35Å; L100-G102 PolarHBondContact O-N 3.04Å; L100-A103 WeakPolarHBondContact O-CB 3.33Å; L100-A103 PolarHBondContact O-N 3.34Å; L100-A103 VanDerWaalsContact O-N 3.16Å
101	A	95.5	Very high	97	Very high	52 Å²	52	34.4 Å²	34.4	43%	0.43	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	134.9	177.8	0	0	0	0	0	111.6	A103 S126	A101-A103 PolarHBondContact O-N 3.02Å; A101-S126 VanDerWaalsContact CB-OG 3.3Å; A101-S126 WeakPolarHBondContact CB-OG 3.37Å
102	G	95.3	Very high	97	Very high	16 Å²	16	37.2 Å²	37.2	17%	0.165	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	9.8	178.9	0	0	0	0	0	115.7	L100 F104 K105 S126	L100-G102 PolarHBondContact O-N 3.04Å; G102-F104 PolarHBondContact O-N 2.86Å; G102-K105 VanDerWaalsContact O-CB 3.32Å; G102-K105 WeakPolarHBondContact O-CB 3.2Å; G102-K105 PolarHBondContact O-N 3.29Å; G102-S126 PolarHBondContact N-O 3.17Å
103	A	97.2	Very high	97	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-38.7	178.8	0	0	0	0	0	113.9	I74 F79 V99 L100 A101 A127	I74-A103 HydrophobicContact CB-CB 4.42Å; I74-A103 HydrophobicContact CG2-CB 3.77Å; F79-A103 VanDerWaalsContact CD2-O 3.28Å; F79-A103 WeakPolarHBondContact CD2-O 3.29Å; F79-A103 WeakPolarHBondContact CE2-O 3.49Å; V99-A103 HydrophobicContact CG1-CB 3.9Å; L100-A103 WeakPolarHBondContact O-CB 3.33Å; L100-A103 PolarHBondContact O-N 3.34Å; L100-A103 VanDerWaalsContact O-N 3.16Å; A101-A103 PolarHBondContact O-N 3.02Å; A103-A127 HydrophobicContact CB-CB 4.48Å; A103-A127 PolarHBondContact N-O 2.8Å
104	F	96.8	Very high	97.1	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	11.8	-176.3	-51.3	-63.2	0	0	0	113.7	I74 F79 V99 G102 N106 L107 L110 L113 F123 A127 F128	I74-F104 HydrophobicContact CG2-CE1 4.37Å; F79-F104 HydrophobicContact CE2-CD1 4.44Å; V99-F104 HydrophobicContact CG1-CE2 3.65Å; V99-F104 HydrophobicContact CG1-CZ 4.05Å; G102-F104 PolarHBondContact O-N 2.86Å; F104-N106 PolarHBondContact O-N 3.34Å; F104-L107 HydrophobicContact CB-CD1 4.43Å; F104-L107 HydrophobicContact CD1-CD1 3.91Å; F104-L107 PolarHBondContact O-N 3.44Å; F104-L110 HydrophobicContact CD1-CD2 4.47Å; F104-L113 HydrophobicContact CD2-CD2 4.36Å; F104-L113 HydrophobicContact CE1-CD1 4.23Å; F104-L113 HydrophobicContact CE1-CD2 4.01Å; F104-L113 HydrophobicContact CE2-CD2 3.77Å; F104-L113 HydrophobicContact CZ-CD1 4.39Å; F104-L113 HydrophobicContact CZ-CD2 3.57Å; F104-F123 HydrophobicContact CE2-CZ 4.44Å; F104-A127 HydrophobicContact CD2-CB 4.36Å; F104-A127 HydrophobicContact CE2-CB 4.5Å; F104-A127 PolarHBondContact N-O 2.96Å; F104-F128 HydrophobicContact CB-CD1 4.09Å; F104-F128 HydrophobicContact CB-CE1 4.38Å; F104-F128 AromaticContact CD2-CD1 3.62Å; F104-F128 HydrophobicContact CD2-CD1 3.62Å; F104-F128 AromaticContact CD2-CE1 3.33Å; F104-F128 HydrophobicContact CD2-CE1 3.33Å; F104-F128 HydrophobicContact CD2-CE2 4.47Å; F104-F128 HydrophobicContact CD2-CG 4.3Å; F104-F128 AromaticContact CD2-CZ 3.82Å; F104-F128 HydrophobicContact CD2-CZ 3.82Å; F104-F128 HydrophobicContact CE2-CD1 4.47Å; F104-F128 AromaticContact CE2-CE1 3.8Å; F104-F128 HydrophobicContact CE2-CE1 3.8Å; F104-F128 AromaticContact CE2-CZ 3.85Å; F104-F128 HydrophobicContact CE2-CZ 3.85Å; F104-F128 HydrophobicContact CG-CD1 4.18Å; F104-F128 HydrophobicContact CG-CE1 4.02Å
105	K	95.4	Very high	97.1	Very high	142 Å²	142	35.1 Å²	35.1	62%	0.617	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.7	-177.1	-179.3	179.5	176.3	179.2	0	113.6	G102 L107	G102-K105 VanDerWaalsContact O-CB 3.32Å; G102-K105 WeakPolarHBondContact O-CB 3.2Å; G102-K105 PolarHBondContact O-N 3.29Å; K105-L107 VanDerWaalsContact C-N 3.28Å; K105-L107 PolarHBondContact O-N 2.95Å
106	N	95.3	Very high	97.2	Very high	46 Å²	46	30.9 Å²	30.9	25%	0.246	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	10.4	-179.1	-77.1	-26.8	0	0	0	113.8	F79 R82 L83 F104 P108	F79-N106 HydrophobicContact CB-CB 4.12Å; F79-N106 PolarHBondContact O-ND2 2.9Å; R82-N106 WeakPolarHBondContact CA-O 3.33Å; L83-N106 PolarHBondContact N-O 2.89Å; F104-N106 PolarHBondContact O-N 3.34Å; N106-P108 VanDerWaalsContact C-CD 3.43Å; N106-P108 WeakPolarHBondContact O-CD 3.19Å
107	L	96.4	Very high	97.2	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.183	C	C	.	.			trans	-120.3	63	-178.9	-49.4	-177.7	0	0	0	111.2	F79 L83 L86 M89 F104 K105 N109 L110	F79-L107 HydrophobicContact CB-CD2 4.46Å; F79-L107 HydrophobicContact CD1-CD2 4Å; F79-L107 HydrophobicContact CD2-CD1 4.3Å; F79-L107 HydrophobicContact CD2-CG 4.45Å; F79-L107 HydrophobicContact CE1-CD1 4.29Å; F79-L107 HydrophobicContact CE1-CD2 4.39Å; F79-L107 HydrophobicContact CE2-CD1 4.02Å; F79-L107 HydrophobicContact CG-CD2 4.08Å; F79-L107 HydrophobicContact CG-CG 4.45Å; F79-L107 HydrophobicContact CZ-CD1 4.01Å; L83-L107 HydrophobicContact CB-CD2 3.94Å; L83-L107 HydrophobicContact CD1-CD2 3.86Å; L83-L107 HydrophobicContact CG-CD2 4.23Å; L86-L107 HydrophobicContact CD2-CD1 4.12Å; L86-L107 HydrophobicContact CD2-CD2 3.69Å; L86-L107 HydrophobicContact CD2-CG 4.44Å; M89-L107 HydrophobicContact SD-CD1 4.24Å; F104-L107 HydrophobicContact CB-CD1 4.43Å; F104-L107 HydrophobicContact CD1-CD1 3.91Å; F104-L107 PolarHBondContact O-N 3.44Å; K105-L107 VanDerWaalsContact C-N 3.28Å; K105-L107 PolarHBondContact O-N 2.95Å; L107-N109 PolarHBondContact O-N 2.85Å; L107-N109 VanDerWaalsContact O-N 3.13Å; L107-L110 HydrophobicContact CB-CB 4.08Å; L107-L110 HydrophobicContact CD1-CD2 4.17Å; L107-L110 WeakPolarHBondContact O-CB 3.17Å; L107-L110 PolarHBondContact O-N 2.83Å
108	P	95	Very high	97.3	Very high	9 Å²	9	30.9 Å²	30.9	6%	0.058	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.1	-167.5	28.4	-37.8	0	0	0	114.5	R82 E84 N106 K133	R82-P108 HydrophobicContact CG-CG 4.37Å; E84-P108 WeakPolarHBondContact OE2-CG 3.35Å; N106-P108 VanDerWaalsContact C-CD 3.43Å; N106-P108 WeakPolarHBondContact O-CD 3.19Å; P108-K133 WeakPolarHBondContact O-CG 3.13Å
109	N	97	Very high	97.3	Very high	70 Å²	70	32.4 Å²	32.4	37%	0.374	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	18.7	-177.8	-65.7	-53.8	0	0	0	112.7	E84 L86 A87 L107 V111	E84-N109 PolarHBondContact O-ND2 2.9Å; L86-N109 CarbonylContact O-C 3.17Å; L86-N109 VanDerWaalsContact O-C 3.3Å; A87-N109 WeakPolarHBondContact CA-O 3.29Å; L107-N109 PolarHBondContact O-N 2.85Å; L107-N109 VanDerWaalsContact O-N 3.13Å; N109-V111 WeakPolarHBondContact O-CG2 3.32Å; N109-V111 PolarHBondContact O-N 2.96Å
110	L	98.3	Very high	97.3	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.026	18%	0.177	C	C	.	.			trans	-64.8	121	176.6	-170.9	68.9	0	0	0	110	L86 M89 F104 L107 L113 K133 L134	L86-L110 PolarHBondContact O-N 2.72Å; M89-L110 HydrophobicContact CB-CD1 3.83Å; F104-L110 HydrophobicContact CD1-CD2 4.47Å; L107-L110 HydrophobicContact CB-CB 4.08Å; L107-L110 HydrophobicContact CD1-CD2 4.17Å; L107-L110 WeakPolarHBondContact O-CB 3.17Å; L107-L110 PolarHBondContact O-N 2.83Å; L110-L113 HydrophobicContact CD2-CB 4.22Å; L110-L113 HydrophobicContact CD2-CD2 4.46Å; L110-K133 CarbonylContact O-C 3.29Å; L110-L134 HydrophobicContact CD2-CD1 4.23Å; L110-L134 HydrophobicContact CG-CD1 4.15Å; L110-L134 VanDerWaalsContact O-CA 3.31Å; L110-L134 WeakPolarHBondContact O-CA 3.13Å; L110-L134 PolarHBondContact O-N 2.92Å; L110-L134 VanDerWaalsContact O-N 3.07Å
111	V	98.6	Very high	97.1	Very high	41 Å²	41	32.9 Å²	32.9	25%	0.248	18%	0.177	C	C	.	.			trans	-106.4	-36.4	-179.1	176.3	0	0	0	0	110.9	A87 N109 Q135 F136	A87-V111 WeakPolarHBondContact O-CA 3.28Å; A87-V111 PolarHBondContact O-N 3.24Å; N109-V111 WeakPolarHBondContact O-CG2 3.32Å; N109-V111 PolarHBondContact O-N 2.96Å; V111-Q135 HydrophobicContact CG1-CB 3.91Å; V111-Q135 HydrophobicContact CG1-CG 4.03Å; V111-Q135 PolarHBondContact O-N 2.85Å; V111-F136 HydrophobicContact CG1-CD2 4.27Å; V111-F136 HydrophobicContact CG1-CE2 4.49Å; V111-F136 PolarHBondContact O-N 3.33Å
112	Q	98.8	Very high	97.1	Very high	59 Å²	59	34.9 Å²	34.9	28%	0.276	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.8	-176.5	178.8	169	-22.7	0	0	111.3	A87 E88 M89 Y90 F136	A87-Q112 PolarHBondContact O-N 3.24Å; E88-Q112 WeakPolarHBondContact CA-O 3.24Å; E88-Q112 HydrophobicContact CG-CB 4.27Å; M89-Q112 PolarHBondContact N-O 3.46Å; Y90-Q112 VanDerWaalsContact CE1-NE2 3.35Å; Y90-Q112 PolarHBondContact OH-NE2 3.43Å; Y90-Q112 VanDerWaalsContact OH-NE2 3.09Å; Q112-F136 WeakPolarHBondContact CA-O 3.46Å; Q112-F136 HydrophobicContact CB-CB 4.19Å; Q112-F136 HydrophobicContact CG-CB 3.99Å
113	L	98.8	Very high	97.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.3	177.1	179.7	59.4	0	0	0	109.9	M89 L91 F104 L110 L115 F128 L134 F136 L137 N138	M89-L113 HydrophobicContact CB-CD1 4.18Å; M89-L113 HydrophobicContact CG-CD1 4.45Å; M89-L113 WeakPolarHBondContact O-CA 3.22Å; L91-L113 HydrophobicContact CD1-CD1 4.08Å; F104-L113 HydrophobicContact CD2-CD2 4.36Å; F104-L113 HydrophobicContact CE1-CD1 4.23Å; F104-L113 HydrophobicContact CE1-CD2 4.01Å; F104-L113 HydrophobicContact CE2-CD2 3.77Å; F104-L113 HydrophobicContact CZ-CD1 4.39Å; F104-L113 HydrophobicContact CZ-CD2 3.57Å; L110-L113 HydrophobicContact CD2-CB 4.22Å; L110-L113 HydrophobicContact CD2-CD2 4.46Å; L113-L115 HydrophobicContact CD1-CG 4.18Å; L113-L115 HydrophobicContact CD2-CD1 3.87Å; L113-L115 HydrophobicContact CD2-CG 4.29Å; L113-L115 HydrophobicContact CG-CD1 4.13Å; L113-L115 HydrophobicContact CG-CG 4.01Å; L113-F128 HydrophobicContact CD2-CE1 3.85Å; L113-F128 HydrophobicContact CD2-CZ 3.82Å; L113-L134 HydrophobicContact CB-CD1 3.7Å; L113-F136 PolarHBondContact N-O 3.17Å; L113-L137 HydrophobicContact CB-CD1 4.23Å; L113-L137 HydrophobicContact CD2-CD1 4.04Å; L113-L137 HydrophobicContact CG-CD1 4.17Å; L113-N138 PolarHBondContact O-N 2.89Å
114	D	98.9	Very high	97.1	Very high	19 Å²	19	36.4 Å²	36.4	10%	0.102	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	110.5	173.8	176.4	22.6	0	0	0	110.5	M89 Y90 L91 S92 S116 N138	M89-D114 PolarHBondContact O-N 3.17Å; Y90-D114 HydrophobicContact CD1-CB 3.77Å; Y90-D114 HydrophobicContact CE1-CB 4.48Å; Y90-D114 HydrophobicContact CG-CB 4.48Å; L91-D114 CarbonylContact C-O 3.19Å; L91-D114 WeakPolarHBondContact CA-O 3.45Å; L91-D114 WeakPolarHBondContact CB-O 3.35Å; L91-D114 PolarHBondContact N-O 2.89Å; S92-D114 VanDerWaalsContact CB-OD2 3.24Å; S92-D114 WeakPolarHBondContact CB-OD2 3.46Å; S92-D114 PolarHBondContact N-O 3.11Å; S92-D114 PolarHBondContact OG-OD2 2.56Å; D114-S116 VanDerWaalsContact OD1-CB 3.22Å; D114-S116 WeakPolarHBondContact OD1-CB 3.45Å; D114-S116 PolarHBondContact OD1-N 2.75Å; D114-S116 PolarHBondContact OD1-OG 2.83Å; D114-N138 HydrophobicContact CB-CB 4.42Å; D114-N138 PolarHBondContact OD1-ND2 3.29Å
115	L	98.6	Very high	96.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.			trans	-112.5	14.3	176	-72.6	169.7	0	0	0	111.5	L91 M96 L113 N118 I120 F123 L137 N138 L139 S142	L91-L115 HydrophobicContact CB-CD2 3.9Å; L91-L115 HydrophobicContact CD1-CD2 3.84Å; M96-L115 HydrophobicContact CE-CD2 3.71Å; M96-L115 HydrophobicContact SD-CD2 3.57Å; M96-L115 VanDerWaalsContact SD-CD2 3.57Å; L113-L115 HydrophobicContact CD1-CG 4.18Å; L113-L115 HydrophobicContact CD2-CD1 3.87Å; L113-L115 HydrophobicContact CD2-CG 4.29Å; L113-L115 HydrophobicContact CG-CD1 4.13Å; L113-L115 HydrophobicContact CG-CG 4.01Å; L115-N118 PolarHBondContact O-ND2 2.91Å; L115-I120 HydrophobicContact CB-CD1 4.29Å; L115-I120 HydrophobicContact CD1-CD1 4.4Å; L115-F123 HydrophobicContact CD1-CE2 3.89Å; L115-F123 HydrophobicContact CD1-CZ 4.48Å; L115-L137 HydrophobicContact CD1-CD1 4.46Å; L115-N138 CarbonylContact C-O 3Å; L115-N138 WeakPolarHBondContact CA-O 3.22Å; L115-N138 PolarHBondContact N-O 2.8Å; L115-L139 HydrophobicContact CB-CD2 3.84Å; L115-L139 HydrophobicContact CD1-CD2 3.96Å; L115-S142 VanDerWaalsContact O-CB 3.26Å; L115-S142 WeakPolarHBondContact O-CB 3.42Å
116	S	98.8	Very high	96.7	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.049	21%	0.206	C	C	.	.			trans	-62.3	156.7	-176.8	62.4	0	0	0	0	113.3	S92 G93 D114 N118 N138 S140	S92-S116 CarbonylContact C-O 3.58Å; S92-S116 WeakPolarHBondContact CA-O 3.49Å; S92-S116 WeakPolarHBondContact CB-O 3.46Å; S92-S116 VanDerWaalsContact CB-OG 3.24Å; S92-S116 WeakPolarHBondContact CB-OG 3.19Å; G93-S116 PolarHBondContact N-O 3.17Å; D114-S116 VanDerWaalsContact OD1-CB 3.22Å; D114-S116 WeakPolarHBondContact OD1-CB 3.45Å; D114-S116 PolarHBondContact OD1-N 2.75Å; D114-S116 PolarHBondContact OD1-OG 2.83Å; S116-N118 PolarHBondContact O-ND2 2.9Å; S116-N138 PolarHBondContact N-O 2.76Å; S116-S140 CarbonylContact C-O 3.46Å; S116-S140 WeakPolarHBondContact CA-O 3.44Å; S116-S140 WeakPolarHBondContact CB-O 3.35Å; S116-S140 WeakPolarHBondContact CB-OG 3.18Å
117	N	98.3	Very high	96.7	Very high	63 Å²	63	36.1 Å²	36.1	34%	0.337	19%	0.194	S	C	.	.	S	Bend	trans	56.6	55.5	179.5	-53.9	-92.2	0	0	0	111.6	G93 N94 S140 R141	G93-N117 WeakPolarHBondContact CA-O 3.15Å; G93-N117 PolarHBondContact N-O 3.4Å; G93-N117 VanDerWaalsContact N-O 3.12Å; N94-N117 PolarHBondContact N-O 3.08Å; N117-S140 PolarHBondContact N-O 3.15Å; N117-R141 CarbonylContact C-O 3.15Å; N117-R141 WeakPolarHBondContact CA-O 3.43Å; N117-R141 PolarHBondContact N-O 3.12Å; N117-R141 WeakPolarHBondContact OD1-CD 3.4Å; N117-R141 PolarHBondContact OD1-NH1 2.86Å; N117-R141 VanDerWaalsContact OD1-NH1 3.07Å
118	N	98.2	Very high	96.7	Very high	11 Å²	11	37 Å²	37	6%	0.059	20%	0.198	C	C	.	.			trans	-130	-170.3	174.2	-82.7	-73.7	0	0	0	109.5	L91 N94 M96 L115 S116 I120 R141 S142	L91-N118 PolarHBondContact O-ND2 3.09Å; L91-N118 VanDerWaalsContact O-ND2 3.12Å; N94-N118 WeakPolarHBondContact CA-OD1 3.44Å; N94-N118 WeakPolarHBondContact CB-OD1 3.31Å; N94-N118 PolarHBondContact N-OD1 3.28Å; N94-N118 PolarHBondContact O-OD1 2.81Å; N94-N118 VanDerWaalsContact O-OD1 3.09Å; M96-N118 HydrophobicContact CB-CB 4.03Å; M96-N118 WeakPolarHBondContact CB-OD1 3.29Å; M96-N118 PolarHBondContact N-OD1 2.98Å; L115-N118 PolarHBondContact O-ND2 2.91Å; S116-N118 PolarHBondContact O-ND2 2.9Å; N118-I120 HydrophobicContact CB-CG1 4.11Å; N118-R141 PolarHBondContact N-O 2.99Å; N118-R141 VanDerWaalsContact N-O 3.16Å; N118-S142 CarbonylContact C-O 3.52Å; N118-S142 WeakPolarHBondContact O-CA 2.92Å
119	I	97	Very high	96.6	Very high	71 Å²	71	37.9 Å²	37.9	36%	0.364	20%	0.203	S	C	.	.			trans	-133.9	43.8	-176.8	52.2	168.2	0	0	0	111.4	M96 E97 Q121 S142	M96-I119 CarbonylContact O-C 3.16Å; M96-I119 WeakPolarHBondContact O-CA 3.4Å; M96-I119 PolarHBondContact O-N 3.28Å; E97-I119 HydrophobicContact CG-CD1 3.68Å; E97-I119 HydrophobicContact CG-CG1 3.85Å; I119-Q121 PolarHBondContact O-N 2.62Å; I119-S142 CarbonylContact C-O 3.3Å
120	I	97.4	Very high	96.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-63.7	122.6	-172	-54.9	172.8	0	0	0	109	M96 E97 V99 L115 N118 F123 L139 S142 L143 N144 T148	M96-I120 HydrophobicContact CG-CG1 4.48Å; M96-I120 WeakPolarHBondContact O-CA 2.97Å; M96-I120 WeakPolarHBondContact O-CG1 3.43Å; M96-I120 PolarHBondContact O-N 3.17Å; E97-I120 CarbonylContact O-C 3.57Å; E97-I120 WeakPolarHBondContact O-CA 3.27Å; V99-I120 HydrophobicContact CG2-CD1 4.43Å; L115-I120 HydrophobicContact CB-CD1 4.29Å; L115-I120 HydrophobicContact CD1-CD1 4.4Å; N118-I120 HydrophobicContact CB-CG1 4.11Å; I120-F123 HydrophobicContact CG2-CB 4.4Å; I120-F123 HydrophobicContact CG2-CD2 4.34Å; I120-L139 HydrophobicContact CD1-CD2 3.88Å; I120-S142 WeakPolarHBondContact CA-O 3.03Å; I120-S142 WeakPolarHBondContact CB-O 3.41Å; I120-S142 PolarHBondContact N-O 3.21Å; I120-L143 HydrophobicContact CB-CD2 4.44Å; I120-N144 PolarHBondContact O-N 3.03Å; I120-T148 HydrophobicContact CG2-CG2 3.84Å
121	Q	94.6	Very high	95.8	Very high	72 Å²	72	45.2 Å²	45.2	34%	0.336	24%	0.243	S	C	.	.			trans	-103.1	-43.3	174.8	-68.7	170	59.4	0	0	109.8	E97 I119 N144 T148	E97-Q121 PolarHBondContact O-N 2.88Å; E97-Q121 PolarHBondContact OE2-NE2 2.85Å; E97-Q121 VanDerWaalsContact OE2-NE2 3.16Å; I119-Q121 PolarHBondContact O-N 2.62Å; Q121-N144 HydrophobicContact CG-CB 3.89Å; Q121-T148 PolarHBondContact O-OG1 2.69Å
122	N	94.9	Very high	95.6	Very high	94 Å²	94	43.6 Å²	43.6	50%	0.503	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.9	-179.3	-51.3	-56	0	0	0	111.3	E97 D98 V99	E97-N122 PolarHBondContact O-N 3.04Å; D98-N122 VanDerWaalsContact OD1-CB 3.28Å; D98-N122 WeakPolarHBondContact OD1-CB 3.48Å; D98-N122 PolarHBondContact OD1-ND2 2.88Å; V99-N122 PolarHBondContact N-O 2.85Å
123	F	96.2	Very high	95.5	Very high	16 Å²	16	44.8 Å²	44.8	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	114.8	173	-158.1	-59.6	0	0	0	108.1	V99 F104 L115 I120 A127 F128 L139 T148 F151	V99-F123 HydrophobicContact CB-CD1 4.33Å; V99-F123 HydrophobicContact CB-CD2 3.99Å; V99-F123 HydrophobicContact CB-CE1 4.44Å; V99-F123 HydrophobicContact CB-CE2 4.12Å; V99-F123 HydrophobicContact CB-CG 4.09Å; V99-F123 HydrophobicContact CB-CZ 4.33Å; V99-F123 HydrophobicContact CG1-CD1 4.29Å; V99-F123 HydrophobicContact CG1-CD2 4.44Å; V99-F123 HydrophobicContact CG1-CE1 3.98Å; V99-F123 HydrophobicContact CG1-CE2 4.14Å; V99-F123 HydrophobicContact CG1-CZ 3.89Å; V99-F123 HydrophobicContact CG2-CD2 3.94Å; V99-F123 HydrophobicContact CG2-CE2 3.92Å; V99-F123 HydrophobicContact CG2-CZ 4.49Å; F104-F123 HydrophobicContact CE2-CZ 4.44Å; L115-F123 HydrophobicContact CD1-CE2 3.89Å; L115-F123 HydrophobicContact CD1-CZ 4.48Å; I120-F123 HydrophobicContact CG2-CB 4.4Å; I120-F123 HydrophobicContact CG2-CD2 4.34Å; F123-A127 HydrophobicContact CD1-CB 4.19Å; F123-A127 HydrophobicContact CE1-CB 3.67Å; F123-F128 HydrophobicContact CE1-CD2 4.27Å; F123-F128 AromaticContact CE1-CE2 3.62Å; F123-F128 HydrophobicContact CE1-CE2 3.62Å; F123-F128 HydrophobicContact CE1-CZ 4.38Å; F123-F128 AromaticContact CZ-CE2 3.57Å; F123-F128 HydrophobicContact CZ-CE2 3.57Å; F123-F128 AromaticContact CZ-CZ 3.92Å; F123-F128 HydrophobicContact CZ-CZ 3.92Å; F123-L139 HydrophobicContact CE2-CD2 4.26Å; F123-T148 HydrophobicContact CB-CG2 3.69Å; F123-F151 HydrophobicContact CB-CB 4.22Å; F123-F151 HydrophobicContact CB-CD1 3.65Å; F123-F151 HydrophobicContact CB-CE1 4.26Å; F123-F151 HydrophobicContact CB-CG 4.1Å; F123-F151 HydrophobicContact CD1-CB 4.17Å; F123-F151 AromaticContact CD1-CD1 3.74Å; F123-F151 HydrophobicContact CD1-CD1 3.74Å; F123-F151 AromaticContact CD1-CD2 3.82Å; F123-F151 HydrophobicContact CD1-CD2 3.82Å; F123-F151 HydrophobicContact CD1-CE1 4.02Å; F123-F151 HydrophobicContact CD1-CE2 4.09Å; F123-F151 AromaticContact CD1-CG 3.66Å; F123-F151 HydrophobicContact CD1-CG 3.66Å; F123-F151 HydrophobicContact CD1-CZ 4.16Å; F123-F151 HydrophobicContact CD2-CD1 4.19Å; F123-F151 AromaticContact CD2-CE1 3.95Å; F123-F151 HydrophobicContact CD2-CE1 3.95Å; F123-F151 HydrophobicContact CD2-CZ 4.41Å; F123-F151 HydrophobicContact CE1-CD1 4.47Å; F123-F151 HydrophobicContact CE1-CD2 4.07Å; F123-F151 HydrophobicContact CE1-CE1 4.37Å; F123-F151 AromaticContact CE1-CE2 3.96Å; F123-F151 HydrophobicContact CE1-CE2 3.96Å; F123-F151 HydrophobicContact CE1-CG 4.35Å; F123-F151 HydrophobicContact CE1-CZ 4.09Å; F123-F151 HydrophobicContact CE2-CE1 4.31Å; F123-F151 HydrophobicContact CE2-CZ 4.34Å; F123-F151 AromaticContact CG-CD1 3.59Å; F123-F151 HydrophobicContact CG-CD1 3.59Å; F123-F151 HydrophobicContact CG-CD2 4.5Å; F123-F151 AromaticContact CG-CE1 3.81Å; F123-F151 HydrophobicContact CG-CE1 3.81Å; F123-F151 AromaticContact CG-CG 3.98Å; F123-F151 HydrophobicContact CG-CG 3.98Å; F123-F151 HydrophobicContact CG-CZ 4.34Å; F123-F151 HydrophobicContact CZ-CE2 4.44Å; F123-F151 HydrophobicContact CZ-CZ 4.2Å; F123-F151 VanDerWaalsContact O-CB 3.31Å; F123-F151 WeakPolarHBondContact O-CB 3.49Å
124	S	95.1	Very high	95.5	Very high	34 Å²	34	44.8 Å²	44.8	24%	0.238	24%	0.237	C	C	.	.			trans	-71.3	136.5	-176.4	-174.6	0	0	0	0	111.9	V99 S126 A127	V99-S124 WeakPolarHBondContact O-CB 3.4Å; V99-S124 PolarHBondContact O-N 3.21Å; S124-S126 PolarHBondContact O-N 3.33Å; S124-S126 VanDerWaalsContact O-N 3.11Å; S124-S126 PolarHBondContact OG-N 3.37Å; S124-S126 PolarHBondContact OG-OG 3.35Å; S124-A127 VanDerWaalsContact O-CB 3.22Å; S124-A127 WeakPolarHBondContact O-CB 3.42Å; S124-A127 PolarHBondContact O-N 3.02Å
125	E	91.9	Very high	95.4	Very high	118 Å²	118	47.5 Å²	47.5	55%	0.551	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.1	172.1	-51.3	166.9	-137.3	0	0	112.8	H154	E125-H154 HydrophobicContact CB-CB 4.03Å; E125-H154 HydrophobicContact CG-CB 3.89Å; E125-H154 WeakPolarHBondContact OE2-CB 3.44Å; E125-H154 IonicContact OE2-CD2 3.17Å; E125-H154 IonicContact OE2-CG 2.9Å; E125-H154 IonicContact OE2-ND1 3.84Å
126	S	92.9	Very high	95.5	Very high	65 Å²	65	51.3 Å²	51.3	46%	0.455	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	20.4	-178	64.1	0	0	0	0	113.3	A101 G102 S124 F128	A101-S126 VanDerWaalsContact CB-OG 3.3Å; A101-S126 WeakPolarHBondContact CB-OG 3.37Å; G102-S126 PolarHBondContact N-O 3.17Å; S124-S126 PolarHBondContact O-N 3.33Å; S124-S126 VanDerWaalsContact O-N 3.11Å; S124-S126 PolarHBondContact OG-N 3.37Å; S124-S126 PolarHBondContact OG-OG 3.35Å; S126-F128 VanDerWaalsContact C-N 3.28Å; S126-F128 PolarHBondContact O-N 3.22Å
127	A	95.9	Very high	95.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-63	-36.1	177.1	0	0	0	0	0	112.4	V99 A103 F104 F123 S124	V99-A127 HydrophobicContact CG1-CB 3.79Å; A103-A127 HydrophobicContact CB-CB 4.48Å; A103-A127 PolarHBondContact N-O 2.8Å; F104-A127 HydrophobicContact CD2-CB 4.36Å; F104-A127 HydrophobicContact CE2-CB 4.5Å; F104-A127 PolarHBondContact N-O 2.96Å; F123-A127 HydrophobicContact CD1-CB 4.19Å; F123-A127 HydrophobicContact CE1-CB 3.67Å; S124-A127 VanDerWaalsContact O-CB 3.22Å; S124-A127 WeakPolarHBondContact O-CB 3.42Å; S124-A127 PolarHBondContact O-N 3.02Å
128	F	95.4	Very high	95.5	Very high	22 Å²	22	50 Å²	50	10%	0.096	26%	0.259	C	S	.	.	S	Bend	trans	-99.9	149.3	178.1	-61.7	-77	0	0	0	111.7	F104 L113 F123 S126 L134 L157	F104-F128 HydrophobicContact CB-CD1 4.09Å; F104-F128 HydrophobicContact CB-CE1 4.38Å; F104-F128 AromaticContact CD2-CD1 3.62Å; F104-F128 HydrophobicContact CD2-CD1 3.62Å; F104-F128 AromaticContact CD2-CE1 3.33Å; F104-F128 HydrophobicContact CD2-CE1 3.33Å; F104-F128 HydrophobicContact CD2-CE2 4.47Å; F104-F128 HydrophobicContact CD2-CG 4.3Å; F104-F128 AromaticContact CD2-CZ 3.82Å; F104-F128 HydrophobicContact CD2-CZ 3.82Å; F104-F128 HydrophobicContact CE2-CD1 4.47Å; F104-F128 AromaticContact CE2-CE1 3.8Å; F104-F128 HydrophobicContact CE2-CE1 3.8Å; F104-F128 AromaticContact CE2-CZ 3.85Å; F104-F128 HydrophobicContact CE2-CZ 3.85Å; F104-F128 HydrophobicContact CG-CD1 4.18Å; F104-F128 HydrophobicContact CG-CE1 4.02Å; L113-F128 HydrophobicContact CD2-CE1 3.85Å; L113-F128 HydrophobicContact CD2-CZ 3.82Å; F123-F128 HydrophobicContact CE1-CD2 4.27Å; F123-F128 AromaticContact CE1-CE2 3.62Å; F123-F128 HydrophobicContact CE1-CE2 3.62Å; F123-F128 HydrophobicContact CE1-CZ 4.38Å; F123-F128 AromaticContact CZ-CE2 3.57Å; F123-F128 HydrophobicContact CZ-CE2 3.57Å; F123-F128 AromaticContact CZ-CZ 3.92Å; F123-F128 HydrophobicContact CZ-CZ 3.92Å; S126-F128 VanDerWaalsContact C-N 3.28Å; S126-F128 PolarHBondContact O-N 3.22Å; F128-L134 HydrophobicContact CD1-CD2 4.38Å; F128-L134 HydrophobicContact CE1-CD2 3.68Å; F128-L134 HydrophobicContact CZ-CD2 3.79Å; F128-L157 HydrophobicContact CB-CD2 4.01Å; F128-L157 HydrophobicContact CD2-CD1 4.47Å; F128-L157 HydrophobicContact CD2-CD2 3.93Å; F128-L157 HydrophobicContact CE2-CD1 4.45Å; F128-L157 HydrophobicContact CG-CD2 3.9Å
129	P	92.1	Very high	95.5	Very high	27 Å²	27	49.5 Å²	49.5	18%	0.175	26%	0.256	C	S	.	.			trans	-73.7	151.2	168.6	32.6	-34.9	0	0	0	111.6	D131 S132	P129-D131 PolarHBondContact O-N 3.41Å; P129-D131 VanDerWaalsContact O-N 3.15Å; P129-S132 WeakPolarHBondContact O-CB 3.18Å; P129-S132 PolarHBondContact O-N 3.16Å
130	D	88.4	Confident	95.5	Very high	138 Å²	138	46.9 Å²	46.9	74%	0.738	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.3	-177.9	-62.7	-29.8	0	0	0	113.9	S132	D130-S132 VanDerWaalsContact C-N 3.31Å
131	D	90.6	Very high	95.6	Very high	92 Å²	92	54 Å²	54	49%	0.492	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	14.6	-178.7	69.8	-30.6	0	0	0	114	P129 K133	P129-D131 PolarHBondContact O-N 3.41Å; P129-D131 VanDerWaalsContact O-N 3.15Å; D131-K133 WeakPolarHBondContact O-CE 3.18Å; D131-K133 PolarHBondContact O-NZ 3.34Å
132	S	93.9	Very high	95.7	Very high	7 Å²	7	50.6 Å²	50.6	5%	0.049	26%	0.255	C	S	.	.			trans	-44.2	133.9	-176.8	-179.6	0	0	0	0	113.5	P129 D130 L134 N159	P129-S132 WeakPolarHBondContact O-CB 3.18Å; P129-S132 PolarHBondContact O-N 3.16Å; D130-S132 VanDerWaalsContact C-N 3.31Å; S132-L134 VanDerWaalsContact C-N 3.34Å; S132-L134 WeakPolarHBondContact OG-CB 3.41Å; S132-L134 PolarHBondContact OG-N 3.08Å; S132-N159 PolarHBondContact O-ND2 3.42Å
133	K	97.2	Very high	95.7	Very high	84 Å²	84	47 Å²	47	37%	0.365	24%	0.235	S	C	.	.			trans	-94.8	9.5	175.2	-55.1	-53.4	177.3	-145.5	0	112.8	P108 L110 D131 Q135	P108-K133 WeakPolarHBondContact O-CG 3.13Å; L110-K133 CarbonylContact O-C 3.29Å; D131-K133 WeakPolarHBondContact O-CE 3.18Å; D131-K133 PolarHBondContact O-NZ 3.34Å; K133-Q135 PolarHBondContact O-N 3.4Å
134	L	98.3	Very high	95.4	Very high	1 Å²	1	51 Å²	51	1%	0.005	26%	0.258	C	S	.	.			trans	-62.1	125.6	-176.1	-166.4	74.2	0	0	0	110.4	L110 L113 F128 S132 L137 N159 L160	L110-L134 HydrophobicContact CD2-CD1 4.23Å; L110-L134 HydrophobicContact CG-CD1 4.15Å; L110-L134 VanDerWaalsContact O-CA 3.31Å; L110-L134 WeakPolarHBondContact O-CA 3.13Å; L110-L134 PolarHBondContact O-N 2.92Å; L110-L134 VanDerWaalsContact O-N 3.07Å; L113-L134 HydrophobicContact CB-CD1 3.7Å; F128-L134 HydrophobicContact CD1-CD2 4.38Å; F128-L134 HydrophobicContact CE1-CD2 3.68Å; F128-L134 HydrophobicContact CZ-CD2 3.79Å; S132-L134 VanDerWaalsContact C-N 3.34Å; S132-L134 WeakPolarHBondContact OG-CB 3.41Å; S132-L134 PolarHBondContact OG-N 3.08Å; L134-L137 HydrophobicContact CD2-CB 4.09Å; L134-L137 HydrophobicContact CD2-CD1 4.41Å; L134-L137 HydrophobicContact CD2-CD2 4.44Å; L134-N159 CarbonylContact O-C 3.51Å; L134-L160 HydrophobicContact CD2-CD1 4.07Å; L134-L160 HydrophobicContact CG-CD1 4.12Å; L134-L160 WeakPolarHBondContact O-CA 3.31Å; L134-L160 PolarHBondContact O-N 3.42Å
135	Q	98.6	Very high	94.9	Very high	75 Å²	75	52.7 Å²	52.7	35%	0.35	26%	0.264	S	S	.	.			trans	-114	-31	178.9	-67.7	175.7	21.2	0	0	112	V111 K133 N159 T161 S162	V111-Q135 HydrophobicContact CG1-CB 3.91Å; V111-Q135 HydrophobicContact CG1-CG 4.03Å; V111-Q135 PolarHBondContact O-N 2.85Å; K133-Q135 PolarHBondContact O-N 3.4Å; Q135-N159 WeakPolarHBondContact CA-O 3.24Å; Q135-N159 WeakPolarHBondContact CG-O 3.27Å; Q135-T161 PolarHBondContact O-N 2.99Å; Q135-T161 PolarHBondContact O-OG1 3.41Å; Q135-T161 VanDerWaalsContact O-OG1 3.12Å; Q135-S162 PolarHBondContact O-N 2.99Å
136	F	98.8	Very high	94.3	Very high	81 Å²	81	53.3 Å²	53.3	36%	0.355	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.4	-176.7	-57.8	-89.6	0	0	0	110	V111 Q112 L113 S162	V111-F136 HydrophobicContact CG1-CD2 4.27Å; V111-F136 HydrophobicContact CG1-CE2 4.49Å; V111-F136 PolarHBondContact O-N 3.33Å; Q112-F136 WeakPolarHBondContact CA-O 3.46Å; Q112-F136 HydrophobicContact CB-CB 4.19Å; Q112-F136 HydrophobicContact CG-CB 3.99Å; L113-F136 PolarHBondContact N-O 3.17Å; F136-S162 VanDerWaalsContact CD1-CB 3.45Å
137	L	98.7	Very high	93.8	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.016	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.5	174.1	-179.7	56.3	0	0	0	109.4	L113 L115 L134 L139 F151 F152 L160 S162 L163 D164	L113-L137 HydrophobicContact CB-CD1 4.23Å; L113-L137 HydrophobicContact CD2-CD1 4.04Å; L113-L137 HydrophobicContact CG-CD1 4.17Å; L115-L137 HydrophobicContact CD1-CD1 4.46Å; L134-L137 HydrophobicContact CD2-CB 4.09Å; L134-L137 HydrophobicContact CD2-CD1 4.41Å; L134-L137 HydrophobicContact CD2-CD2 4.44Å; L137-L139 HydrophobicContact CD1-CD1 4.48Å; L137-L139 HydrophobicContact CD1-CG 4.18Å; L137-L139 HydrophobicContact CD2-CD1 3.91Å; L137-L139 HydrophobicContact CD2-CG 4.46Å; L137-L139 HydrophobicContact CG-CD1 4.06Å; L137-L139 HydrophobicContact CG-CG 4.08Å; L137-F151 HydrophobicContact CD2-CZ 4.35Å; L137-F152 HydrophobicContact CD2-CE1 4.12Å; L137-F152 HydrophobicContact CD2-CZ 3.93Å; L137-L160 HydrophobicContact CB-CD1 3.74Å; L137-S162 PolarHBondContact N-O 3.06Å; L137-L163 HydrophobicContact CB-CD1 4.21Å; L137-L163 HydrophobicContact CD2-CD1 4.16Å; L137-L163 HydrophobicContact CG-CD1 4.16Å; L137-D164 PolarHBondContact O-N 3Å
138	N	98.8	Very high	93.2	Very high	40 Å²	40	53 Å²	53	21%	0.214	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.1	174.5	-174.9	1.4	0	0	0	110.2	L113 D114 L115 S116 S140 D164	L113-N138 PolarHBondContact O-N 2.89Å; D114-N138 HydrophobicContact CB-CB 4.42Å; D114-N138 PolarHBondContact OD1-ND2 3.29Å; L115-N138 CarbonylContact C-O 3Å; L115-N138 WeakPolarHBondContact CA-O 3.22Å; L115-N138 PolarHBondContact N-O 2.8Å; S116-N138 PolarHBondContact N-O 2.76Å; N138-S140 VanDerWaalsContact OD1-CB 3.27Å; N138-S140 WeakPolarHBondContact OD1-CB 3.22Å; N138-S140 PolarHBondContact OD1-N 2.84Å; N138-S140 PolarHBondContact OD1-OG 2.97Å; N138-D164 HydrophobicContact CB-CB 4.45Å
139	L	98.3	Very high	92.9	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.253	C	S	.	.			trans	-120.2	27.3	175.5	-71.9	167.9	0	0	0	110	L115 I120 F123 L137 R141 S142 F151 F152 D164 L165 N168	L115-L139 HydrophobicContact CB-CD2 3.84Å; L115-L139 HydrophobicContact CD1-CD2 3.96Å; I120-L139 HydrophobicContact CD1-CD2 3.88Å; F123-L139 HydrophobicContact CE2-CD2 4.26Å; L137-L139 HydrophobicContact CD1-CD1 4.48Å; L137-L139 HydrophobicContact CD1-CG 4.18Å; L137-L139 HydrophobicContact CD2-CD1 3.91Å; L137-L139 HydrophobicContact CD2-CG 4.46Å; L137-L139 HydrophobicContact CG-CD1 4.06Å; L137-L139 HydrophobicContact CG-CG 4.08Å; L139-R141 PolarHBondContact O-N 3.16Å; L139-S142 VanDerWaalsContact C-OG 3.22Å; L139-S142 VanDerWaalsContact CA-OG 3.26Å; L139-S142 WeakPolarHBondContact CA-OG 3.32Å; L139-S142 WeakPolarHBondContact CB-OG 3.42Å; L139-S142 WeakPolarHBondContact CD2-OG 3.21Å; L139-S142 PolarHBondContact O-OG 3.41Å; L139-F151 HydrophobicContact CD1-CE1 4.13Å; L139-F151 HydrophobicContact CD1-CZ 4.19Å; L139-F152 HydrophobicContact CD1-CE2 4.02Å; L139-F152 HydrophobicContact CD1-CZ 3.88Å; L139-D164 CarbonylContact C-O 3.57Å; L139-D164 WeakPolarHBondContact CA-O 3.42Å; L139-D164 PolarHBondContact N-O 3.31Å; L139-L165 HydrophobicContact CB-CD2 3.93Å; L139-L165 HydrophobicContact CD1-CD2 4.12Å; L139-N168 PolarHBondContact O-ND2 3.13Å
140	S	98.5	Very high	92.7	Very high	16 Å²	16	54.4 Å²	54.4	11%	0.112	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	133.5	178.8	58.4	0	0	0	0	111.3	S116 N117 N138 S142 D164 S166	S116-S140 CarbonylContact C-O 3.46Å; S116-S140 WeakPolarHBondContact CA-O 3.44Å; S116-S140 WeakPolarHBondContact CB-O 3.35Å; S116-S140 WeakPolarHBondContact CB-OG 3.18Å; N117-S140 PolarHBondContact N-O 3.15Å; N138-S140 VanDerWaalsContact OD1-CB 3.27Å; N138-S140 WeakPolarHBondContact OD1-CB 3.22Å; N138-S140 PolarHBondContact OD1-N 2.84Å; N138-S140 PolarHBondContact OD1-OG 2.97Å; S140-S142 PolarHBondContact O-N 3.04Å; S140-D164 PolarHBondContact N-O 3.02Å; S140-S166 CarbonylContact C-O 3.53Å; S140-S166 WeakPolarHBondContact CA-O 3.11Å; S140-S166 WeakPolarHBondContact CB-O 3.24Å; S140-S166 WeakPolarHBondContact CB-OG 3.37Å
141	R	97.7	Very high	92.8	Very high	150 Å²	150	48.1 Å²	48.1	57%	0.566	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	48.7	-175.5	-165.3	-167.5	-70	166.8	-9.8	112	N117 N118 L139 S166 N167 N168	N117-R141 CarbonylContact C-O 3.15Å; N117-R141 WeakPolarHBondContact CA-O 3.43Å; N117-R141 PolarHBondContact N-O 3.12Å; N117-R141 WeakPolarHBondContact OD1-CD 3.4Å; N117-R141 PolarHBondContact OD1-NH1 2.86Å; N117-R141 VanDerWaalsContact OD1-NH1 3.07Å; N118-R141 PolarHBondContact N-O 2.99Å; N118-R141 VanDerWaalsContact N-O 3.16Å; L139-R141 PolarHBondContact O-N 3.16Å; R141-S166 PolarHBondContact N-O 3.19Å; R141-N167 VanDerWaalsContact CA-O 3.24Å; R141-N167 WeakPolarHBondContact CA-O 3.38Å; R141-N167 HydrophobicContact CB-CB 4.07Å; R141-N168 PolarHBondContact N-OD1 2.95Å
142	S	97.1	Very high	92.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.207	C	C	.	.			trans	-127.6	-15.4	-177.5	75.3	0	0	0	0	114.5	L115 N118 I119 I120 L139 S140 N168	L115-S142 VanDerWaalsContact O-CB 3.26Å; L115-S142 WeakPolarHBondContact O-CB 3.42Å; N118-S142 CarbonylContact C-O 3.52Å; N118-S142 WeakPolarHBondContact O-CA 2.92Å; I119-S142 CarbonylContact C-O 3.3Å; I120-S142 WeakPolarHBondContact CA-O 3.03Å; I120-S142 WeakPolarHBondContact CB-O 3.41Å; I120-S142 PolarHBondContact N-O 3.21Å; L139-S142 VanDerWaalsContact C-OG 3.22Å; L139-S142 VanDerWaalsContact CA-OG 3.26Å; L139-S142 WeakPolarHBondContact CA-OG 3.32Å; L139-S142 WeakPolarHBondContact CB-OG 3.42Å; L139-S142 WeakPolarHBondContact CD2-OG 3.21Å; L139-S142 PolarHBondContact O-OG 3.41Å; S140-S142 PolarHBondContact O-N 3.04Å; S142-N168 PolarHBondContact N-OD1 3.19Å
143	L	95.1	Very high	92.7	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.089	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-98.6	124	-173.1	-53.7	180	0	0	0	109.8	I120 T148 L149 L165 N168 L170	I120-L143 HydrophobicContact CB-CD2 4.44Å; L143-T148 HydrophobicContact CD2-CG2 3.71Å; L143-L149 HydrophobicContact CD1-CD2 3.68Å; L143-L149 HydrophobicContact CD1-CG 4.2Å; L143-L165 HydrophobicContact CD1-CD2 4.02Å; L143-N168 HydrophobicContact CB-CB 4.35Å; L143-N168 HydrophobicContact CD1-CB 4.47Å; L143-N168 PolarHBondContact N-OD1 3.33Å; L143-L170 HydrophobicContact CD1-CD2 3.89Å
144	N	89.4	Confident	92.4	Very high	102 Å²	102	47.2 Å²	47.2	55%	0.545	23%	0.227	S	C	.	.	S	Bend	trans	-89.4	-20	178.8	-164.3	35	0	0	0	112.5	I120 Q121	I120-N144 PolarHBondContact O-N 3.03Å; Q121-N144 HydrophobicContact CG-CB 3.89Å
145	N	84.7	Confident	91.9	Very high	69 Å²	69	47.5 Å²	47.5	37%	0.369	23%	0.229	S	C	.	.	S	Bend	trans	-142.8	150.6	176	-168.8	1	0	0	0	110.4	T147 T148	N145-T147 VanDerWaalsContact C-N 3.27Å; N145-T147 PolarHBondContact ND2-OG1 3.03Å; N145-T147 VanDerWaalsContact ND2-OG1 3.11Å; N145-T147 PolarHBondContact O-N 3.12Å; N145-T148 WeakPolarHBondContact O-CB 3.33Å; N145-T148 PolarHBondContact O-N 3.04Å; N145-T148 PolarHBondContact O-OG1 2.64Å; N145-T148 VanDerWaalsContact O-OG1 3.09Å
146	Y	80.4	Confident	91.5	Very high	131 Å²	131	48.1 Å²	48.1	51%	0.514	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-66.6	-28	177.6	70.4	-90.8	0	0	0	112.5	T148 L149	Y146-T148 PolarHBondContact O-N 3.33Å; Y146-T148 VanDerWaalsContact O-N 3.1Å; Y146-L149 WeakPolarHBondContact O-CB 3.34Å; Y146-L149 PolarHBondContact O-N 3.07Å
147	T	81	Confident	91.3	Very high	54 Å²	54	44.3 Å²	44.3	33%	0.331	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-59.8	-22.4	178.1	58.2	0	0	0	0	112.7	N145 L149 D150	N145-T147 VanDerWaalsContact C-N 3.27Å; N145-T147 PolarHBondContact ND2-OG1 3.03Å; N145-T147 VanDerWaalsContact ND2-OG1 3.11Å; N145-T147 PolarHBondContact O-N 3.12Å; T147-L149 PolarHBondContact O-N 2.92Å; T147-D150 VanDerWaalsContact O-CB 3.31Å; T147-D150 WeakPolarHBondContact O-CB 3.49Å; T147-D150 PolarHBondContact O-N 3.03Å; T147-D150 VanDerWaalsContact O-N 3.09Å
148	T	84.2	Confident	91	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.025	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-60.3	-29	175.2	-47.1	0	0	0	0	110.9	I120 Q121 F123 L143 N145 Y146 D150 F151	I120-T148 HydrophobicContact CG2-CG2 3.84Å; Q121-T148 PolarHBondContact O-OG1 2.69Å; F123-T148 HydrophobicContact CB-CG2 3.69Å; L143-T148 HydrophobicContact CD2-CG2 3.71Å; N145-T148 WeakPolarHBondContact O-CB 3.33Å; N145-T148 PolarHBondContact O-N 3.04Å; N145-T148 PolarHBondContact O-OG1 2.64Å; N145-T148 VanDerWaalsContact O-OG1 3.09Å; Y146-T148 PolarHBondContact O-N 3.33Å; Y146-T148 VanDerWaalsContact O-N 3.1Å; T148-D150 PolarHBondContact O-N 3.32Å; T148-F151 WeakPolarHBondContact O-CD1 3.39Å; T148-F151 PolarHBondContact O-N 2.78Å
149	L	89.6	Confident	90.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-66	-16.7	176.9	-68.6	-176.9	0	0	0	114.4	L143 Y146 T147 F151 F152 L165 L170 L173 P174 M177	L143-L149 HydrophobicContact CD1-CD2 3.68Å; L143-L149 HydrophobicContact CD1-CG 4.2Å; Y146-L149 WeakPolarHBondContact O-CB 3.34Å; Y146-L149 PolarHBondContact O-N 3.07Å; T147-L149 PolarHBondContact O-N 2.92Å; L149-F151 PolarHBondContact O-N 3.09Å; L149-F152 HydrophobicContact CD2-CD2 3.89Å; L149-F152 HydrophobicContact CD2-CE2 3.96Å; L149-F152 WeakPolarHBondContact O-CB 3.26Å; L149-F152 PolarHBondContact O-N 2.64Å; L149-L165 HydrophobicContact CD2-CD1 4.17Å; L149-L165 HydrophobicContact CD2-CD2 3.91Å; L149-L170 HydrophobicContact CD1-CD1 4.1Å; L149-L170 HydrophobicContact CD1-CD2 3.61Å; L149-L170 HydrophobicContact CD1-CG 4.28Å; L149-L170 HydrophobicContact CD2-CD2 4.44Å; L149-L170 HydrophobicContact CG-CD2 4.07Å; L149-L173 HydrophobicContact CD1-CD2 4.09Å; L149-P174 HydrophobicContact CB-CG 3.73Å; L149-M177 HydrophobicContact CD1-CE 4.42Å; L149-M177 HydrophobicContact CD2-CE 4.15Å
150	D	88.1	Confident	90.9	Very high	78 Å²	78	46.9 Å²	46.9	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-60.5	-21	179.7	-66.3	-14.3	0	0	0	112.3	T147 T148 F152 V153 H154	T147-D150 VanDerWaalsContact O-CB 3.31Å; T147-D150 WeakPolarHBondContact O-CB 3.49Å; T147-D150 PolarHBondContact O-N 3.03Å; T147-D150 VanDerWaalsContact O-N 3.09Å; T148-D150 PolarHBondContact O-N 3.32Å; D150-F152 PolarHBondContact O-N 2.99Å; D150-V153 WeakPolarHBondContact O-CB 3.5Å; D150-V153 PolarHBondContact O-N 3.47Å; D150-H154 PolarHBondContact O-ND1 3.47Å
151	F	90.9	Very high	90.9	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-60	-36.3	173.2	95.9	-106	0	0	0	111.5	F123 L137 L139 T148 L149 V153 H154 A155	F123-F151 HydrophobicContact CB-CB 4.22Å; F123-F151 HydrophobicContact CB-CD1 3.65Å; F123-F151 HydrophobicContact CB-CE1 4.26Å; F123-F151 HydrophobicContact CB-CG 4.1Å; F123-F151 HydrophobicContact CD1-CB 4.17Å; F123-F151 AromaticContact CD1-CD1 3.74Å; F123-F151 HydrophobicContact CD1-CD1 3.74Å; F123-F151 AromaticContact CD1-CD2 3.82Å; F123-F151 HydrophobicContact CD1-CD2 3.82Å; F123-F151 HydrophobicContact CD1-CE1 4.02Å; F123-F151 HydrophobicContact CD1-CE2 4.09Å; F123-F151 AromaticContact CD1-CG 3.66Å; F123-F151 HydrophobicContact CD1-CG 3.66Å; F123-F151 HydrophobicContact CD1-CZ 4.16Å; F123-F151 HydrophobicContact CD2-CD1 4.19Å; F123-F151 AromaticContact CD2-CE1 3.95Å; F123-F151 HydrophobicContact CD2-CE1 3.95Å; F123-F151 HydrophobicContact CD2-CZ 4.41Å; F123-F151 HydrophobicContact CE1-CD1 4.47Å; F123-F151 HydrophobicContact CE1-CD2 4.07Å; F123-F151 HydrophobicContact CE1-CE1 4.37Å; F123-F151 AromaticContact CE1-CE2 3.96Å; F123-F151 HydrophobicContact CE1-CE2 3.96Å; F123-F151 HydrophobicContact CE1-CG 4.35Å; F123-F151 HydrophobicContact CE1-CZ 4.09Å; F123-F151 HydrophobicContact CE2-CE1 4.31Å; F123-F151 HydrophobicContact CE2-CZ 4.34Å; F123-F151 AromaticContact CG-CD1 3.59Å; F123-F151 HydrophobicContact CG-CD1 3.59Å; F123-F151 HydrophobicContact CG-CD2 4.5Å; F123-F151 AromaticContact CG-CE1 3.81Å; F123-F151 HydrophobicContact CG-CE1 3.81Å; F123-F151 AromaticContact CG-CG 3.98Å; F123-F151 HydrophobicContact CG-CG 3.98Å; F123-F151 HydrophobicContact CG-CZ 4.34Å; F123-F151 HydrophobicContact CZ-CE2 4.44Å; F123-F151 HydrophobicContact CZ-CZ 4.2Å; F123-F151 VanDerWaalsContact O-CB 3.31Å; F123-F151 WeakPolarHBondContact O-CB 3.49Å; L137-F151 HydrophobicContact CD2-CZ 4.35Å; L139-F151 HydrophobicContact CD1-CE1 4.13Å; L139-F151 HydrophobicContact CD1-CZ 4.19Å; T148-F151 WeakPolarHBondContact O-CD1 3.39Å; T148-F151 PolarHBondContact O-N 2.78Å; L149-F151 PolarHBondContact O-N 3.09Å; F151-V153 PolarHBondContact O-N 2.7Å; F151-H154 PolarHBondContact O-N 2.92Å; F151-A155 HydrophobicContact CD2-CB 3.89Å; F151-A155 HydrophobicContact CE2-CB 4.21Å; F151-A155 WeakPolarHBondContact O-CB 3.48Å; F151-A155 PolarHBondContact O-N 3.26Å
152	F	91.3	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.8	-24.5	-178.7	-78.2	-68.4	0	0	0	112.8	L137 L139 L149 D150 H154 L163 L165 M177 L181	L137-F152 HydrophobicContact CD2-CE1 4.12Å; L137-F152 HydrophobicContact CD2-CZ 3.93Å; L139-F152 HydrophobicContact CD1-CE2 4.02Å; L139-F152 HydrophobicContact CD1-CZ 3.88Å; L149-F152 HydrophobicContact CD2-CD2 3.89Å; L149-F152 HydrophobicContact CD2-CE2 3.96Å; L149-F152 WeakPolarHBondContact O-CB 3.26Å; L149-F152 PolarHBondContact O-N 2.64Å; D150-F152 PolarHBondContact O-N 2.99Å; F152-H154 PolarHBondContact O-N 3.47Å; F152-L163 HydrophobicContact CE1-CD1 4.22Å; F152-L163 HydrophobicContact CE1-CD2 3.98Å; F152-L163 HydrophobicContact CE2-CD1 4.49Å; F152-L163 HydrophobicContact CE2-CD2 4.41Å; F152-L163 HydrophobicContact CZ-CD1 3.62Å; F152-L163 HydrophobicContact CZ-CD2 3.81Å; F152-L163 HydrophobicContact CZ-CG 4.39Å; F152-L165 HydrophobicContact CE2-CD2 4.24Å; F152-M177 HydrophobicContact CB-CB 3.91Å; F152-M177 HydrophobicContact CB-CE 4.22Å; F152-M177 HydrophobicContact CD2-CE 3.88Å; F152-M177 HydrophobicContact CG-CE 4.2Å; F152-L181 HydrophobicContact CD1-CD1 4.04Å; F152-L181 HydrophobicContact CD1-CD2 4.49Å; F152-L181 HydrophobicContact CE1-CD1 4.31Å
153	V	90.4	Very high	90.9	Very high	46 Å²	46	42.1 Å²	42.1	28%	0.279	22%	0.222	S	C	.	.	H	α-helix	trans	-64.5	-32	175.4	-178.3	0	0	0	0	111	D150 F151 P174 M177	D150-V153 WeakPolarHBondContact O-CB 3.5Å; D150-V153 PolarHBondContact O-N 3.47Å; F151-V153 PolarHBondContact O-N 2.7Å; V153-P174 HydrophobicContact CG2-CB 3.89Å; V153-M177 HydrophobicContact CG2-CB 4.36Å
154	H	90	Very high	91.1	Very high	119 Å²	119	43 Å²	43	55%	0.551	23%	0.227	S	C	*	.	H	α-helix	trans	-106.9	-21.9	-176	-57.3	94.2	0	0	0	113.4	E125 D150 F151 F152	E125-H154 HydrophobicContact CB-CB 4.03Å; E125-H154 HydrophobicContact CG-CB 3.89Å; E125-H154 WeakPolarHBondContact OE2-CB 3.44Å; E125-H154 IonicContact OE2-CD2 3.17Å; E125-H154 IonicContact OE2-CG 2.9Å; E125-H154 IonicContact OE2-ND1 3.84Å; D150-H154 PolarHBondContact O-ND1 3.47Å; F151-H154 PolarHBondContact O-N 2.92Å; F152-H154 PolarHBondContact O-N 3.47Å
155	A	88.2	Confident	91.5	Very high	6 Å²	6	38.1 Å²	38.1	5%	0.05	20%	0.201	C	C	.	.			trans	-69.8	142.2	-179.2	0	0	0	0	0	111.6	F151 G180	F151-A155 HydrophobicContact CD2-CB 3.89Å; F151-A155 HydrophobicContact CE2-CB 4.21Å; F151-A155 WeakPolarHBondContact O-CB 3.48Å; F151-A155 PolarHBondContact O-N 3.26Å; A155-G180 WeakPolarHBondContact O-CA 3.42Å
156	N	91.2	Very high	92.2	Very high	88 Å²	88	35.1 Å²	35.1	47%	0.471	19%	0.186	S	C	.	.			trans	-115.1	103	172.5	-174.8	27.4	0	0	0	109.4	P158	N156-P158 VanDerWaalsContact C-CD 3.49Å; N156-P158 WeakPolarHBondContact O-CD 3.5Å
157	L	94.1	Very high	93	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	18%	0.176	C	C	.	.			trans	-122	72.7	179.5	-58.9	171	0	0	0	109.1	F128 N159 L160 G180 L181	F128-L157 HydrophobicContact CB-CD2 4.01Å; F128-L157 HydrophobicContact CD2-CD1 4.47Å; F128-L157 HydrophobicContact CD2-CD2 3.93Å; F128-L157 HydrophobicContact CE2-CD1 4.45Å; F128-L157 HydrophobicContact CG-CD2 3.9Å; L157-N159 PolarHBondContact O-N 2.97Å; L157-L160 HydrophobicContact CB-CB 3.91Å; L157-L160 HydrophobicContact CD1-CD2 4.21Å; L157-L160 WeakPolarHBondContact O-CB 3.35Å; L157-L160 PolarHBondContact O-N 3.36Å; L157-G180 CarbonylContact C-O 3.56Å; L157-G180 VanDerWaalsContact C-O 3.27Å; L157-G180 PolarHBondContact N-O 3.09Å; L157-L181 HydrophobicContact CB-CD2 3.69Å; L157-L181 HydrophobicContact CD1-CD2 4.17Å; L157-L181 HydrophobicContact CG-CD2 4.34Å
158	P	93.1	Very high	93.7	Very high	40 Å²	40	29.3 Å²	29.3	26%	0.26	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.2	-169.4	26	-36	0	0	0	113.6	N156 P182 S183	N156-P158 VanDerWaalsContact C-CD 3.49Å; N156-P158 WeakPolarHBondContact O-CD 3.5Å; P158-P182 HydrophobicContact CB-CG 4.44Å; P158-S183 WeakPolarHBondContact O-CB 3.38Å; P158-S183 PolarHBondContact O-OG 3.07Å
159	N	96.3	Very high	94.2	Very high	57 Å²	57	34.9 Å²	34.9	31%	0.305	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-1.7	-179	-65.2	-31.3	0	0	0	113.4	S132 L134 Q135 L157 T161	S132-N159 PolarHBondContact O-ND2 3.42Å; L134-N159 CarbonylContact O-C 3.51Å; Q135-N159 WeakPolarHBondContact CA-O 3.24Å; Q135-N159 WeakPolarHBondContact CG-O 3.27Å; L157-N159 PolarHBondContact O-N 2.97Å; N159-T161 WeakPolarHBondContact O-CG2 3.44Å; N159-T161 PolarHBondContact O-N 3.47Å
160	L	97.3	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.			trans	-67.8	119.2	-177.6	-165.2	73.8	0	0	0	109.5	L134 L137 L157 L163 L181 S183 L184	L134-L160 HydrophobicContact CD2-CD1 4.07Å; L134-L160 HydrophobicContact CG-CD1 4.12Å; L134-L160 WeakPolarHBondContact O-CA 3.31Å; L134-L160 PolarHBondContact O-N 3.42Å; L137-L160 HydrophobicContact CB-CD1 3.74Å; L157-L160 HydrophobicContact CB-CB 3.91Å; L157-L160 HydrophobicContact CD1-CD2 4.21Å; L157-L160 WeakPolarHBondContact O-CB 3.35Å; L157-L160 PolarHBondContact O-N 3.36Å; L160-L163 HydrophobicContact CD2-CB 4.18Å; L160-L181 HydrophobicContact CB-CD2 4.24Å; L160-L181 HydrophobicContact CD2-CD1 4.24Å; L160-L181 HydrophobicContact CD2-CD2 3.77Å; L160-S183 CarbonylContact O-C 3.57Å; L160-L184 HydrophobicContact CD2-CD1 4.39Å; L160-L184 HydrophobicContact CG-CD1 4.44Å; L160-L184 WeakPolarHBondContact O-CA 3.38Å; L160-L184 PolarHBondContact O-N 3.01Å; L160-L184 VanDerWaalsContact O-N 3.17Å
161	T	97.9	Very high	94.5	Very high	35 Å²	35	35.2 Å²	35.2	22%	0.215	19%	0.192	C	C	.	.			trans	-109.8	-24.8	-177.5	63.5	0	0	0	0	112.8	Q135 N159 T185 T186	Q135-T161 PolarHBondContact O-N 2.99Å; Q135-T161 PolarHBondContact O-OG1 3.41Å; Q135-T161 VanDerWaalsContact O-OG1 3.12Å; N159-T161 WeakPolarHBondContact O-CG2 3.44Å; N159-T161 PolarHBondContact O-N 3.47Å; T161-T185 WeakPolarHBondContact O-CA 3.43Å; T161-T185 PolarHBondContact O-N 3.33Å; T161-T185 PolarHBondContact O-OG1 3.25Å; T161-T186 PolarHBondContact O-N 3.05Å
162	S	98.6	Very high	94.5	Very high	29 Å²	29	40.1 Å²	40.1	20%	0.203	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	123.5	-178.7	-172.7	0	0	0	0	110.4	Q135 F136 L137 T186	Q135-S162 PolarHBondContact O-N 2.99Å; F136-S162 VanDerWaalsContact CD1-CB 3.45Å; L137-S162 PolarHBondContact N-O 3.06Å; S162-T186 WeakPolarHBondContact CA-O 3.47Å
163	L	98.2	Very high	94.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.8	176.4	176.6	56.9	0	0	0	109.4	L137 F152 L160 L165 L181 L184 T186 L187 N188	L137-L163 HydrophobicContact CB-CD1 4.21Å; L137-L163 HydrophobicContact CD2-CD1 4.16Å; L137-L163 HydrophobicContact CG-CD1 4.16Å; F152-L163 HydrophobicContact CE1-CD1 4.22Å; F152-L163 HydrophobicContact CE1-CD2 3.98Å; F152-L163 HydrophobicContact CE2-CD1 4.49Å; F152-L163 HydrophobicContact CE2-CD2 4.41Å; F152-L163 HydrophobicContact CZ-CD1 3.62Å; F152-L163 HydrophobicContact CZ-CD2 3.81Å; F152-L163 HydrophobicContact CZ-CG 4.39Å; L160-L163 HydrophobicContact CD2-CB 4.18Å; L163-L165 HydrophobicContact CD1-CD2 4.35Å; L163-L165 HydrophobicContact CD1-CG 4.06Å; L163-L165 HydrophobicContact CD2-CD1 3.86Å; L163-L165 HydrophobicContact CD2-CG 4.26Å; L163-L165 HydrophobicContact CG-CD1 4.09Å; L163-L165 HydrophobicContact CG-CG 3.96Å; L163-L181 HydrophobicContact CD2-CD1 4.11Å; L163-L184 HydrophobicContact CB-CD1 3.71Å; L163-T186 PolarHBondContact N-O 3.06Å; L163-L187 HydrophobicContact CB-CD1 4.25Å; L163-L187 HydrophobicContact CD2-CD1 4.16Å; L163-L187 HydrophobicContact CG-CD1 4.19Å; L163-N188 PolarHBondContact O-N 3.25Å
164	D	98.8	Very high	94.5	Very high	35 Å²	35	40.6 Å²	40.6	19%	0.187	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.2	173.3	-163	-29.5	0	0	0	110.5	L137 N138 L139 S140 S166 N188	L137-D164 PolarHBondContact O-N 3Å; N138-D164 HydrophobicContact CB-CB 4.45Å; L139-D164 CarbonylContact C-O 3.57Å; L139-D164 WeakPolarHBondContact CA-O 3.42Å; L139-D164 PolarHBondContact N-O 3.31Å; S140-D164 PolarHBondContact N-O 3.02Å; D164-S166 WeakPolarHBondContact OD1-CB 3.34Å; D164-S166 PolarHBondContact OD1-N 3Å; D164-S166 PolarHBondContact OD1-OG 3.27Å; D164-N188 HydrophobicContact CB-CB 4.36Å; D164-N188 PolarHBondContact OD1-ND2 3.39Å; D164-N188 PolarHBondContact OD2-ND2 3.32Å
165	L	97.7	Very high	94.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.			trans	-120.4	17.5	176.8	-71	172.1	0	0	0	111.2	L139 L143 L149 F152 L163 N168 L170 M177 N188 L189 S192	L139-L165 HydrophobicContact CB-CD2 3.93Å; L139-L165 HydrophobicContact CD1-CD2 4.12Å; L143-L165 HydrophobicContact CD1-CD2 4.02Å; L149-L165 HydrophobicContact CD2-CD1 4.17Å; L149-L165 HydrophobicContact CD2-CD2 3.91Å; F152-L165 HydrophobicContact CE2-CD2 4.24Å; L163-L165 HydrophobicContact CD1-CD2 4.35Å; L163-L165 HydrophobicContact CD1-CG 4.06Å; L163-L165 HydrophobicContact CD2-CD1 3.86Å; L163-L165 HydrophobicContact CD2-CG 4.26Å; L163-L165 HydrophobicContact CG-CD1 4.09Å; L163-L165 HydrophobicContact CG-CG 3.96Å; L165-N168 VanDerWaalsContact C-ND2 3.29Å; L165-N168 PolarHBondContact O-ND2 2.94Å; L165-L170 HydrophobicContact CB-CD1 4.26Å; L165-M177 HydrophobicContact CD1-CE 4.03Å; L165-N188 CarbonylContact C-O 3.56Å; L165-N188 WeakPolarHBondContact CA-O 3.21Å; L165-N188 PolarHBondContact N-O 3.06Å; L165-L189 HydrophobicContact CB-CD2 3.87Å; L165-L189 HydrophobicContact CD1-CD2 4.05Å; L165-S192 PolarHBondContact O-OG 2.79Å
166	S	98.4	Very high	94.3	Very high	7 Å²	7	41.7 Å²	41.7	5%	0.049	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	154.7	-177.8	64	0	0	0	0	112.4	S140 R141 D164 N168 N188 R190	S140-S166 CarbonylContact C-O 3.53Å; S140-S166 WeakPolarHBondContact CA-O 3.11Å; S140-S166 WeakPolarHBondContact CB-O 3.24Å; S140-S166 WeakPolarHBondContact CB-OG 3.37Å; R141-S166 PolarHBondContact N-O 3.19Å; D164-S166 WeakPolarHBondContact OD1-CB 3.34Å; D164-S166 PolarHBondContact OD1-N 3Å; D164-S166 PolarHBondContact OD1-OG 3.27Å; S166-N168 VanDerWaalsContact C-N 3.28Å; S166-N168 PolarHBondContact O-N 2.97Å; S166-N168 PolarHBondContact O-ND2 3.43Å; S166-N188 PolarHBondContact N-O 2.9Å; S166-R190 CarbonylContact C-O 3.56Å; S166-R190 WeakPolarHBondContact CA-O 3.09Å; S166-R190 WeakPolarHBondContact CB-O 3.26Å
167	N	97.6	Very high	94.2	Very high	60 Å²	60	37.5 Å²	37.5	32%	0.321	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	34.9	175.9	-51.7	-87.4	0	0	0	113.5	R141 R190 N191 S192	R141-N167 VanDerWaalsContact CA-O 3.24Å; R141-N167 WeakPolarHBondContact CA-O 3.38Å; R141-N167 HydrophobicContact CB-CB 4.07Å; N167-R190 PolarHBondContact N-O 2.83Å; N167-N191 WeakPolarHBondContact CA-O 3.46Å; N167-N191 PolarHBondContact N-O 3.03Å; N167-N191 PolarHBondContact OD1-ND2 2.85Å; N167-S192 PolarHBondContact N-OG 3.4Å
168	N	96.7	Very high	94	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	21%	0.211	C	C	.	.	S	Bend	trans	-120.3	147.6	173.4	-68.1	-62.1	0	0	0	110.5	L139 R141 S142 L143 L165 S166 L170 S192	L139-N168 PolarHBondContact O-ND2 3.13Å; R141-N168 PolarHBondContact N-OD1 2.95Å; S142-N168 PolarHBondContact N-OD1 3.19Å; L143-N168 HydrophobicContact CB-CB 4.35Å; L143-N168 HydrophobicContact CD1-CB 4.47Å; L143-N168 PolarHBondContact N-OD1 3.33Å; L165-N168 VanDerWaalsContact C-ND2 3.29Å; L165-N168 PolarHBondContact O-ND2 2.94Å; S166-N168 VanDerWaalsContact C-N 3.28Å; S166-N168 PolarHBondContact O-N 2.97Å; S166-N168 PolarHBondContact O-ND2 3.43Å; N168-L170 HydrophobicContact CB-CD2 3.81Å; N168-L170 HydrophobicContact CB-CG 3.95Å; N168-L170 PolarHBondContact O-N 3.47Å; N168-S192 CarbonylContact O-C 3.5Å; N168-S192 WeakPolarHBondContact O-CA 3.45Å; N168-S192 WeakPolarHBondContact O-CB 3.47Å; N168-S192 VanDerWaalsContact O-O 3.08Å
169	D	93.6	Very high	93.8	Very high	121 Å²	121	43 Å²	43	65%	0.647	23%	0.226	S	C	*	.			trans	-85.3	76.1	179.9	-68.8	-51.1	0	0	0	112.3	S193	D169-S193 PolarHBondContact OD1-OG 2.98Å; D169-S193 VanDerWaalsContact OD1-OG 3.06Å
170	L	92.1	Very high	93.5	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.216	C	C	.	.			trans	-83.1	-35.6	-170.3	-60.1	-177.3	0	0	0	113.7	L143 L149 L165 N168 F172 L173 L189 S192 L194	L143-L170 HydrophobicContact CD1-CD2 3.89Å; L149-L170 HydrophobicContact CD1-CD1 4.1Å; L149-L170 HydrophobicContact CD1-CD2 3.61Å; L149-L170 HydrophobicContact CD1-CG 4.28Å; L149-L170 HydrophobicContact CD2-CD2 4.44Å; L149-L170 HydrophobicContact CG-CD2 4.07Å; L165-L170 HydrophobicContact CB-CD1 4.26Å; N168-L170 HydrophobicContact CB-CD2 3.81Å; N168-L170 HydrophobicContact CB-CG 3.95Å; N168-L170 PolarHBondContact O-N 3.47Å; L170-F172 PolarHBondContact O-N 2.8Å; L170-F172 VanDerWaalsContact O-O 3.11Å; L170-L173 HydrophobicContact CD1-CD2 3.9Å; L170-L189 HydrophobicContact CD1-CD2 3.94Å; L170-S192 PolarHBondContact N-O 2.72Å; L170-S192 VanDerWaalsContact N-O 3.09Å; L170-L194 HydrophobicContact CB-CD2 3.89Å
171	L	92.1	Very high	93.3	Very high	83 Å²	83	40.9 Å²	40.9	44%	0.435	22%	0.216	S	C	.	.	S	Bend	trans	58.8	-50.5	-170.5	-62.3	172	0	0	0	114.7	I195	L171-I195 PolarHBondContact O-N 2.9Å; L171-I195 VanDerWaalsContact O-N 3.13Å
172	F	90.3	Very high	93	Very high	108 Å²	108	43 Å²	43	47%	0.474	23%	0.231	S	C	.	.	S	Bend	trans	-139.3	162.7	178.7	-52.3	-86.9	0	0	0	110.4	L170 I195	L170-F172 PolarHBondContact O-N 2.8Å; L170-F172 VanDerWaalsContact O-O 3.11Å; F172-I195 HydrophobicContact CD1-CD1 4.41Å; F172-I195 HydrophobicContact CD1-CG1 4.14Å; F172-I195 HydrophobicContact CE1-CD1 3.36Å; F172-I195 HydrophobicContact CE1-CG1 3.52Å; F172-I195 HydrophobicContact CE2-CD1 4.25Å; F172-I195 HydrophobicContact CZ-CD1 3.26Å; F172-I195 HydrophobicContact CZ-CG1 3.83Å
173	L	91.6	Very high	92.8	Very high	28 Å²	28	43.9 Å²	43.9	15%	0.147	24%	0.237	C	C	.	.			trans	-107.6	133.1	171.3	-62.9	179.1	0	0	0	108	L149 L170 M177 F178 L189 L194 F197	L149-L173 HydrophobicContact CD1-CD2 4.09Å; L170-L173 HydrophobicContact CD1-CD2 3.9Å; L173-M177 HydrophobicContact CB-SD 3.68Å; L173-M177 HydrophobicContact CD1-SD 4.44Å; L173-M177 HydrophobicContact CD2-SD 3.88Å; L173-M177 HydrophobicContact CG-SD 4.19Å; L173-F178 HydrophobicContact CD1-CE2 4.16Å; L173-F178 HydrophobicContact CD1-CZ 4.06Å; L173-L189 HydrophobicContact CD1-CD1 3.78Å; L173-L189 HydrophobicContact CD1-CD2 4.4Å; L173-L189 HydrophobicContact CD2-CD2 3.96Å; L173-L194 HydrophobicContact CD2-CD2 4.13Å; L173-L194 HydrophobicContact CG-CD2 4.06Å; L173-F197 HydrophobicContact CD1-CD2 3.82Å; L173-F197 HydrophobicContact CD1-CE2 3.9Å
174	P	90.3	Very high	92.6	Very high	29 Å²	29	44 Å²	44	19%	0.188	24%	0.237	C	C	.	.			trans	-61.5	139.4	176	-22	32.2	0	0	0	112.1	L149 V153 G176 M177	L149-P174 HydrophobicContact CB-CG 3.73Å; V153-P174 HydrophobicContact CG2-CB 3.89Å; P174-G176 PolarHBondContact O-N 2.93Å; P174-M177 HydrophobicContact CB-CB 4.42Å; P174-M177 WeakPolarHBondContact O-CB 3.21Å; P174-M177 WeakPolarHBondContact O-CG 3.33Å; P174-M177 PolarHBondContact O-N 2.99Å
175	D	87	Confident	92.5	Very high	135 Å²	135	44 Å²	44	72%	0.722	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	136.1	174	-58.2	-16	0	0	0	109.9	M177	D175-M177 VanDerWaalsContact C-N 3.26Å; D175-M177 PolarHBondContact O-N 2.82Å
176	G	86.9	Confident	92.6	Very high	13 Å²	13	46.1 Å²	46.1	13%	0.134	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	3.8	-179.9	0	0	0	0	0	115.3	P174 F178 K179 D201	P174-G176 PolarHBondContact O-N 2.93Å; G176-F178 PolarHBondContact O-N 2.86Å; G176-K179 WeakPolarHBondContact O-CB 3.33Å; G176-K179 PolarHBondContact O-N 2.91Å; G176-D201 WeakPolarHBondContact CA-OD2 3.49Å; G176-D201 PolarHBondContact N-OD2 3.32Å
177	M	90.1	Very high	92.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-20.2	179	74.5	171.7	-64.6	0	0	113.6	L149 F152 V153 L165 L173 P174 D175	L149-M177 HydrophobicContact CD1-CE 4.42Å; L149-M177 HydrophobicContact CD2-CE 4.15Å; F152-M177 HydrophobicContact CB-CB 3.91Å; F152-M177 HydrophobicContact CB-CE 4.22Å; F152-M177 HydrophobicContact CD2-CE 3.88Å; F152-M177 HydrophobicContact CG-CE 4.2Å; V153-M177 HydrophobicContact CG2-CB 4.36Å; L165-M177 HydrophobicContact CD1-CE 4.03Å; L173-M177 HydrophobicContact CB-SD 3.68Å; L173-M177 HydrophobicContact CD1-SD 4.44Å; L173-M177 HydrophobicContact CD2-SD 3.88Å; L173-M177 HydrophobicContact CG-SD 4.19Å; P174-M177 HydrophobicContact CB-CB 4.42Å; P174-M177 WeakPolarHBondContact O-CB 3.21Å; P174-M177 WeakPolarHBondContact O-CG 3.33Å; P174-M177 PolarHBondContact O-N 2.99Å; D175-M177 VanDerWaalsContact C-N 3.26Å; D175-M177 PolarHBondContact O-N 2.82Å
178	F	90.8	Very high	92.6	Very high	25 Å²	25	44.4 Å²	44.4	11%	0.11	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-3.9	-180	-59.7	-62.9	0	0	0	113.7	L173 G176 G180 L181 L184 L187 L206	L173-F178 HydrophobicContact CD1-CE2 4.16Å; L173-F178 HydrophobicContact CD1-CZ 4.06Å; G176-F178 PolarHBondContact O-N 2.86Å; F178-G180 VanDerWaalsContact C-N 3.34Å; F178-G180 PolarHBondContact O-N 2.78Å; F178-L181 HydrophobicContact CD1-CD1 4.11Å; F178-L181 PolarHBondContact O-N 2.7Å; F178-L184 HydrophobicContact CD1-CD2 4.02Å; F178-L184 HydrophobicContact CE1-CD2 4.25Å; F178-L187 HydrophobicContact CE1-CD1 4.24Å; F178-L187 HydrophobicContact CE1-CD2 3.72Å; F178-L187 HydrophobicContact CZ-CD2 3.66Å; F178-L206 HydrophobicContact CB-CD2 3.72Å; F178-L206 HydrophobicContact CB-CG 4.13Å; F178-L206 HydrophobicContact CD1-CD1 4.37Å; F178-L206 HydrophobicContact CD1-CD2 4.05Å; F178-L206 HydrophobicContact CD2-CD1 4.07Å; F178-L206 HydrophobicContact CE2-CD1 4.4Å; F178-L206 HydrophobicContact CG-CD1 4.06Å; F178-L206 HydrophobicContact CG-CD2 3.9Å; F178-L206 HydrophobicContact CG-CG 4.2Å
179	K	88.4	Confident	92.6	Very high	133 Å²	133	44.3 Å²	44.3	58%	0.578	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-49.7	-178	-171.8	175.3	-166.9	118.9	0	113.4	G176 L181 E204	G176-K179 WeakPolarHBondContact O-CB 3.33Å; G176-K179 PolarHBondContact O-N 2.91Å; K179-L181 PolarHBondContact O-N 2.95Å; K179-E204 VanDerWaalsContact CA-OE2 3.27Å; K179-E204 WeakPolarHBondContact CA-OE2 3.42Å; K179-E204 WeakPolarHBondContact CB-OE2 3.5Å; K179-E204 WeakPolarHBondContact CD-OE1 3.36Å; K179-E204 WeakPolarHBondContact CE-OE1 3.29Å; K179-E204 VanDerWaalsContact CG-CD 3.45Å; K179-E204 WeakPolarHBondContact CG-OE1 3.31Å; K179-E204 WeakPolarHBondContact CG-OE2 3.45Å; K179-E204 IonicContact NZ-OE1 3.46Å; K179-E204 PolarHBondContact NZ-OE1 3.44Å
180	G	89.5	Confident	92.8	Very high	9 Å²	9	43.1 Å²	43.1	9%	0.093	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	6.7	-176.9	0	0	0	0	0	114	A155 L157 F178 P182	A155-G180 WeakPolarHBondContact O-CA 3.42Å; L157-G180 CarbonylContact C-O 3.56Å; L157-G180 VanDerWaalsContact C-O 3.27Å; L157-G180 PolarHBondContact N-O 3.09Å; F178-G180 VanDerWaalsContact C-N 3.34Å; F178-G180 PolarHBondContact O-N 2.78Å; G180-P182 VanDerWaalsContact O-CD 3.29Å; G180-P182 WeakPolarHBondContact O-CD 3.04Å
181	L	92.4	Very high	93.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.246	C	C	.	.			trans	-119.6	50.7	-172.9	-49.4	-176.8	0	0	0	112.8	F152 L157 L160 L163 F178 K179 S183 L184	F152-L181 HydrophobicContact CD1-CD1 4.04Å; F152-L181 HydrophobicContact CD1-CD2 4.49Å; F152-L181 HydrophobicContact CE1-CD1 4.31Å; L157-L181 HydrophobicContact CB-CD2 3.69Å; L157-L181 HydrophobicContact CD1-CD2 4.17Å; L157-L181 HydrophobicContact CG-CD2 4.34Å; L160-L181 HydrophobicContact CB-CD2 4.24Å; L160-L181 HydrophobicContact CD2-CD1 4.24Å; L160-L181 HydrophobicContact CD2-CD2 3.77Å; L163-L181 HydrophobicContact CD2-CD1 4.11Å; F178-L181 HydrophobicContact CD1-CD1 4.11Å; F178-L181 PolarHBondContact O-N 2.7Å; K179-L181 PolarHBondContact O-N 2.95Å; L181-S183 PolarHBondContact O-N 3.25Å; L181-S183 VanDerWaalsContact O-N 3.12Å; L181-L184 HydrophobicContact CB-CB 4.2Å; L181-L184 HydrophobicContact CD1-CD2 4.36Å; L181-L184 VanDerWaalsContact O-CB 3.31Å; L181-L184 WeakPolarHBondContact O-CB 3.43Å; L181-L184 PolarHBondContact O-N 2.8Å; L181-L184 VanDerWaalsContact O-N 3.11Å
182	P	91.7	Very high	93.3	Very high	81 Å²	81	42.6 Å²	42.6	53%	0.526	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.9	-171.6	27.4	-37.5	0	0	0	114.6	P158 G180	P158-P182 HydrophobicContact CB-CG 4.44Å; G180-P182 VanDerWaalsContact O-CD 3.29Å; G180-P182 WeakPolarHBondContact O-CD 3.04Å
183	S	94.3	Very high	93.5	Very high	47 Å²	47	38.6 Å²	38.6	33%	0.329	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	7	-179.4	-59.9	0	0	0	0	113.6	P158 L160 L181 T185	P158-S183 WeakPolarHBondContact O-CB 3.38Å; P158-S183 PolarHBondContact O-OG 3.07Å; L160-S183 CarbonylContact O-C 3.57Å; L181-S183 PolarHBondContact O-N 3.25Å; L181-S183 VanDerWaalsContact O-N 3.12Å; S183-T185 WeakPolarHBondContact O-CG2 3.34Å; S183-T185 PolarHBondContact O-N 3.29Å; S183-T185 VanDerWaalsContact O-N 3.17Å
184	L	95.3	Very high	93.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.204	C	C	.	.			trans	-67.1	117	-173.5	-168.8	69.2	0	0	0	111.1	L160 L163 F178 L181 L187 L206 A208 L209	L160-L184 HydrophobicContact CD2-CD1 4.39Å; L160-L184 HydrophobicContact CG-CD1 4.44Å; L160-L184 WeakPolarHBondContact O-CA 3.38Å; L160-L184 PolarHBondContact O-N 3.01Å; L160-L184 VanDerWaalsContact O-N 3.17Å; L163-L184 HydrophobicContact CB-CD1 3.71Å; F178-L184 HydrophobicContact CD1-CD2 4.02Å; F178-L184 HydrophobicContact CE1-CD2 4.25Å; L181-L184 HydrophobicContact CB-CB 4.2Å; L181-L184 HydrophobicContact CD1-CD2 4.36Å; L181-L184 VanDerWaalsContact O-CB 3.31Å; L181-L184 WeakPolarHBondContact O-CB 3.43Å; L181-L184 PolarHBondContact O-N 2.8Å; L181-L184 VanDerWaalsContact O-N 3.11Å; L184-L187 HydrophobicContact CD2-CB 4.34Å; L184-L187 HydrophobicContact CD2-CD1 4.47Å; L184-L206 HydrophobicContact CB-CD2 4.32Å; L184-L206 HydrophobicContact CD2-CD2 4.03Å; L184-A208 CarbonylContact O-C 3.33Å; L184-A208 VanDerWaalsContact O-C 3.29Å; L184-L209 HydrophobicContact CG-CD1 4.48Å; L184-L209 WeakPolarHBondContact O-CA 3.47Å; L184-L209 PolarHBondContact O-N 2.91Å
185	T	96.6	Very high	94	Very high	37 Å²	37	39.7 Å²	39.7	23%	0.227	22%	0.215	C	C	.	.			trans	-107.3	-29.2	-178.6	68.6	0	0	0	0	113.1	T161 S183 A208 R210 H211	T161-T185 WeakPolarHBondContact O-CA 3.43Å; T161-T185 PolarHBondContact O-N 3.33Å; T161-T185 PolarHBondContact O-OG1 3.25Å; S183-T185 WeakPolarHBondContact O-CG2 3.34Å; S183-T185 PolarHBondContact O-N 3.29Å; S183-T185 VanDerWaalsContact O-N 3.17Å; T185-A208 WeakPolarHBondContact CA-O 3.48Å; T185-A208 HydrophobicContact CG2-CB 4.48Å; T185-R210 PolarHBondContact O-N 3.42Å; T185-H211 PolarHBondContact O-N 3.27Å
186	T	98.2	Very high	94.3	Very high	43 Å²	43	37.4 Å²	37.4	26%	0.264	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120	-174.6	-57.1	0	0	0	0	109	T161 S162 L163 H211	T161-T186 PolarHBondContact O-N 3.05Å; S162-T186 WeakPolarHBondContact CA-O 3.47Å; L163-T186 PolarHBondContact N-O 3.06Å; T186-H211 WeakPolarHBondContact CA-O 3.38Å; T186-H211 HydrophobicContact CG2-CB 4.12Å
187	L	97.7	Very high	94.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.8	177.1	178.4	57.8	0	0	0	109.2	L163 F178 L184 L189 L209 H211 L212 D213	L163-L187 HydrophobicContact CB-CD1 4.25Å; L163-L187 HydrophobicContact CD2-CD1 4.16Å; L163-L187 HydrophobicContact CG-CD1 4.19Å; F178-L187 HydrophobicContact CE1-CD1 4.24Å; F178-L187 HydrophobicContact CE1-CD2 3.72Å; F178-L187 HydrophobicContact CZ-CD2 3.66Å; L184-L187 HydrophobicContact CD2-CB 4.34Å; L184-L187 HydrophobicContact CD2-CD1 4.47Å; L187-L189 HydrophobicContact CD1-CD1 4.37Å; L187-L189 HydrophobicContact CD1-CD2 4.45Å; L187-L189 HydrophobicContact CD1-CG 4.08Å; L187-L189 HydrophobicContact CD2-CD1 3.75Å; L187-L189 HydrophobicContact CD2-CG 4.35Å; L187-L189 HydrophobicContact CG-CD1 3.9Å; L187-L189 HydrophobicContact CG-CG 3.96Å; L187-L209 HydrophobicContact CB-CD1 3.84Å; L187-H211 PolarHBondContact N-O 3Å; L187-L212 HydrophobicContact CB-CD1 4.15Å; L187-L212 HydrophobicContact CD2-CD1 4.02Å; L187-L212 HydrophobicContact CG-CD1 4.09Å; L187-L212 WeakPolarHBondContact O-CA 3.24Å; L187-D213 PolarHBondContact O-N 3.49Å
188	N	98.6	Very high	94.4	Very high	31 Å²	31	41.5 Å²	41.5	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	113.9	175.9	-175.5	5.8	0	0	0	109.9	L163 D164 L165 S166 R190	L163-N188 PolarHBondContact O-N 3.25Å; D164-N188 HydrophobicContact CB-CB 4.36Å; D164-N188 PolarHBondContact OD1-ND2 3.39Å; D164-N188 PolarHBondContact OD2-ND2 3.32Å; L165-N188 CarbonylContact C-O 3.56Å; L165-N188 WeakPolarHBondContact CA-O 3.21Å; L165-N188 PolarHBondContact N-O 3.06Å; S166-N188 PolarHBondContact N-O 2.9Å; N188-R190 WeakPolarHBondContact OD1-CB 3.04Å; N188-R190 PolarHBondContact OD1-N 2.85Å; N188-R190 VanDerWaalsContact OD1-N 3.09Å
189	L	97.8	Very high	93.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.			trans	-121.5	21.9	178.4	-71.3	165.6	0	0	0	110.8	L165 L170 L173 L187 S192 L194 F197 L212 D213 L214 N217	L165-L189 HydrophobicContact CB-CD2 3.87Å; L165-L189 HydrophobicContact CD1-CD2 4.05Å; L170-L189 HydrophobicContact CD1-CD2 3.94Å; L173-L189 HydrophobicContact CD1-CD1 3.78Å; L173-L189 HydrophobicContact CD1-CD2 4.4Å; L173-L189 HydrophobicContact CD2-CD2 3.96Å; L187-L189 HydrophobicContact CD1-CD1 4.37Å; L187-L189 HydrophobicContact CD1-CD2 4.45Å; L187-L189 HydrophobicContact CD1-CG 4.08Å; L187-L189 HydrophobicContact CD2-CD1 3.75Å; L187-L189 HydrophobicContact CD2-CG 4.35Å; L187-L189 HydrophobicContact CG-CD1 3.9Å; L187-L189 HydrophobicContact CG-CG 3.96Å; L189-S192 WeakPolarHBondContact O-CB 3.16Å; L189-S192 PolarHBondContact O-OG 2.95Å; L189-L194 HydrophobicContact CB-CD1 3.93Å; L189-L194 HydrophobicContact CD1-CD1 4.07Å; L189-L194 HydrophobicContact CD2-CD1 4.25Å; L189-L194 HydrophobicContact CG-CD1 4.33Å; L189-F197 HydrophobicContact CD1-CD2 3.99Å; L189-F197 HydrophobicContact CD1-CE2 3.73Å; L189-L212 HydrophobicContact CD1-CD1 4.34Å; L189-D213 CarbonylContact C-O 3.46Å; L189-D213 WeakPolarHBondContact CA-O 3.43Å; L189-D213 PolarHBondContact N-O 3.48Å; L189-L214 HydrophobicContact CB-CD2 4.01Å; L189-L214 HydrophobicContact CD1-CD2 3.89Å; L189-N217 PolarHBondContact O-ND2 3.02Å
190	R	98.4	Very high	92.4	Very high	96 Å²	96	36 Å²	36	36%	0.362	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	138.9	-177.2	177.9	175	-178.9	-159.5	-1.9	111.4	S166 N167 N188 S192 D213 R215 D216	S166-R190 CarbonylContact C-O 3.56Å; S166-R190 WeakPolarHBondContact CA-O 3.09Å; S166-R190 WeakPolarHBondContact CB-O 3.26Å; N167-R190 PolarHBondContact N-O 2.83Å; N188-R190 WeakPolarHBondContact OD1-CB 3.04Å; N188-R190 PolarHBondContact OD1-N 2.85Å; N188-R190 VanDerWaalsContact OD1-N 3.09Å; R190-S192 VanDerWaalsContact C-N 3.28Å; R190-S192 PolarHBondContact O-N 3.24Å; R190-S192 PolarHBondContact O-OG 2.94Å; R190-D213 PolarHBondContact N-O 3.12Å; R190-R215 CarbonylContact C-O 3.49Å; R190-R215 VanDerWaalsContact CA-O 3.29Å; R190-R215 WeakPolarHBondContact CA-O 3.4Å; R190-R215 HydrophobicContact CG-CB 4.05Å; R190-D216 HydrophobicContact CG-CB 4.49Å; R190-D216 IonicContact CZ-OD2 2.81Å; R190-D216 VanDerWaalsContact CZ-OD2 3.3Å; R190-D216 IonicContact NE-OD2 2.94Å; R190-D216 PolarHBondContact NE-OD2 3.49Å; R190-D216 IonicContact NH2-OD2 2.77Å; R190-D216 PolarHBondContact NH2-OD2 3.26Å
191	N	97.8	Very high	91	Very high	74 Å²	74	37.8 Å²	37.8	40%	0.396	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	43.9	174.2	-169.7	40.5	0	0	0	112	N167 R215 D216	N167-N191 WeakPolarHBondContact CA-O 3.46Å; N167-N191 PolarHBondContact N-O 3.03Å; N167-N191 PolarHBondContact OD1-ND2 2.85Å; N191-R215 PolarHBondContact N-O 3.43Å; N191-D216 WeakPolarHBondContact CA-O 3.2Å; N191-D216 HydrophobicContact CB-CB 4.06Å
192	S	95.7	Very high	89.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-113.6	19	-175.5	-60.4	0	0	0	0	114.5	L165 N167 N168 L170 L189 R190 L194 N217	L165-S192 PolarHBondContact O-OG 2.79Å; N167-S192 PolarHBondContact N-OG 3.4Å; N168-S192 CarbonylContact O-C 3.5Å; N168-S192 WeakPolarHBondContact O-CA 3.45Å; N168-S192 WeakPolarHBondContact O-CB 3.47Å; N168-S192 VanDerWaalsContact O-O 3.08Å; L170-S192 PolarHBondContact N-O 2.72Å; L170-S192 VanDerWaalsContact N-O 3.09Å; L189-S192 WeakPolarHBondContact O-CB 3.16Å; L189-S192 PolarHBondContact O-OG 2.95Å; R190-S192 VanDerWaalsContact C-N 3.28Å; R190-S192 PolarHBondContact O-N 3.24Å; R190-S192 PolarHBondContact O-OG 2.94Å; S192-L194 PolarHBondContact O-N 2.87Å; S192-N217 VanDerWaalsContact C-OD1 3.29Å; S192-N217 WeakPolarHBondContact CA-OD1 3.39Å; S192-N217 PolarHBondContact N-OD1 3.15Å
193	S	95.5	Very high	87.2	Confident	24 Å²	24	50.3 Å²	50.3	17%	0.168	26%	0.26	C	S	.	.			trans	57.2	19.3	177.7	-58.5	0	0	0	0	114.8	D169 I195 N217	D169-S193 PolarHBondContact OD1-OG 2.98Å; D169-S193 VanDerWaalsContact OD1-OG 3.06Å; S193-I195 PolarHBondContact O-N 2.78Å; S193-N217 PolarHBondContact N-OD1 2.85Å
194	L	95.8	Very high	85.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.			trans	-66.5	128.4	-175.6	-68.4	173.7	0	0	0	111.5	L170 L173 L189 S192 L214 N217 H218 L219	L170-L194 HydrophobicContact CB-CD2 3.89Å; L173-L194 HydrophobicContact CD2-CD2 4.13Å; L173-L194 HydrophobicContact CG-CD2 4.06Å; L189-L194 HydrophobicContact CB-CD1 3.93Å; L189-L194 HydrophobicContact CD1-CD1 4.07Å; L189-L194 HydrophobicContact CD2-CD1 4.25Å; L189-L194 HydrophobicContact CG-CD1 4.33Å; S192-L194 PolarHBondContact O-N 2.87Å; L194-L214 HydrophobicContact CD1-CD2 4.13Å; L194-N217 HydrophobicContact CB-CB 4.12Å; L194-N217 WeakPolarHBondContact CB-OD1 3.31Å; L194-N217 PolarHBondContact N-OD1 2.85Å; L194-H218 CarbonylContact O-C 3.3Å; L194-H218 VanDerWaalsContact O-CA 3.22Å; L194-H218 WeakPolarHBondContact O-CA 3.4Å; L194-H218 WeakPolarHBondContact O-CB 3.46Å; L194-H218 PolarHBondContact O-N 3.4Å; L194-L219 HydrophobicContact CB-CD2 4.36Å; L194-L219 PolarHBondContact O-N 3.09Å
195	I	95.8	Very high	84.1	Confident	80 Å²	80	53.2 Å²	53.2	41%	0.41	27%	0.273	S	S	.	.	S	Bend	trans	-93.3	-19.7	176.3	69.2	171.5	0	0	0	112.8	L171 F172 S193 H218	L171-I195 PolarHBondContact O-N 2.9Å; L171-I195 VanDerWaalsContact O-N 3.13Å; F172-I195 HydrophobicContact CD1-CD1 4.41Å; F172-I195 HydrophobicContact CD1-CG1 4.14Å; F172-I195 HydrophobicContact CE1-CD1 3.36Å; F172-I195 HydrophobicContact CE1-CG1 3.52Å; F172-I195 HydrophobicContact CE2-CD1 4.25Å; F172-I195 HydrophobicContact CZ-CD1 3.26Å; F172-I195 HydrophobicContact CZ-CG1 3.83Å; S193-I195 PolarHBondContact O-N 2.78Å; I195-H218 HydrophobicContact CG2-CB 4.03Å
196	M	92.9	Very high	83	Confident	88 Å²	88	52 Å²	52	43%	0.433	27%	0.265	S	S	.	.			trans	-147.3	148.9	-179.9	-175.3	169.5	70	0	0	109.6
197	F	92.4	Very high	82.2	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.009	29%	0.286	C	S	.	.			trans	-136.2	134	170.2	177.9	-93	0	0	0	108.9	L173 L189 L212 L214 L219 P223 T226 F230	L173-F197 HydrophobicContact CD1-CD2 3.82Å; L173-F197 HydrophobicContact CD1-CE2 3.9Å; L189-F197 HydrophobicContact CD1-CD2 3.99Å; L189-F197 HydrophobicContact CD1-CE2 3.73Å; F197-L212 HydrophobicContact CE1-CD2 3.76Å; F197-L212 HydrophobicContact CE2-CD1 4.39Å; F197-L212 HydrophobicContact CZ-CD1 4.2Å; F197-L212 HydrophobicContact CZ-CD2 3.79Å; F197-L214 HydrophobicContact CB-CD1 4.28Å; F197-L214 HydrophobicContact CB-CD2 4.2Å; F197-L214 HydrophobicContact CD1-CD1 3.88Å; F197-L214 HydrophobicContact CD2-CD1 4.42Å; F197-L214 HydrophobicContact CD2-CD2 3.73Å; F197-L214 HydrophobicContact CE1-CD1 4.36Å; F197-L214 HydrophobicContact CE2-CD2 4.28Å; F197-L214 HydrophobicContact CG-CD1 3.91Å; F197-L214 HydrophobicContact CG-CD2 3.92Å; F197-L219 HydrophobicContact CB-CD2 4.23Å; F197-P223 WeakPolarHBondContact O-CD 3.34Å; F197-T226 HydrophobicContact CD1-CG2 4.07Å; F197-T226 HydrophobicContact CE1-CG2 4.24Å; F197-F230 HydrophobicContact CD1-CZ 4.16Å; F197-F230 HydrophobicContact CE1-CE1 4.06Å; F197-F230 AromaticContact CE1-CZ 3.65Å; F197-F230 HydrophobicContact CE1-CZ 3.65Å
198	Q	86.6	Confident	81.8	Confident	97 Å²	97	57.8 Å²	57.8	45%	0.453	30%	0.298	S	S	.	.			trans	-133.6	128.4	176.7	179.7	166.3	-17.2	0	0	108.8	V200	Q198-V200 WeakPolarHBondContact CG-O 3.41Å; Q198-V200 PolarHBondContact NE2-O 2.8Å
199	S	73.6	Confident	81.5	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.042	29%	0.292	C	S	.	.			trans	-96.6	-5	-179.5	60.8	0	0	0	0	114.2	D229	S199-D229 WeakPolarHBondContact CB-OD2 3.35Å; S199-D229 PolarHBondContact OG-OD2 3.21Å
200	V	64.3	Low	81.4	Confident	37 Å²	37	62.8 Å²	62.8	22%	0.224	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	106	-174.6	-177	0	0	0	0	108.5	Q198 D229	Q198-V200 WeakPolarHBondContact CG-O 3.41Å; Q198-V200 PolarHBondContact NE2-O 2.8Å; V200-D229 HydrophobicContact CG2-CB 3.55Å
201	D	59.7	Low	81.4	Confident	45 Å²	45	62.3 Å²	62.3	24%	0.241	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	142.4	149.9	-74.5	-35.5	0	0	0	107.5	G176 N203 E204	G176-D201 WeakPolarHBondContact CA-OD2 3.49Å; G176-D201 PolarHBondContact N-OD2 3.32Å; D201-N203 PolarHBondContact O-N 3.32Å; D201-E204 HydrophobicContact CB-CB 4.18Å; D201-E204 PolarHBondContact O-N 2.81Å
202	E	52.8	Low	81.4	Confident	191 Å²	191	59 Å²	59	89%	0.893	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-8.4	-166.5	-65.7	-176.2	158	0	0	115.3
203	N	52.6	Low	81.5	Confident	156 Å²	156	59.6 Å²	59.6	83%	0.834	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.5	4.3	174.7	-76.2	-39	0	0	0	114.9	D201	D201-N203 PolarHBondContact O-N 3.32Å
204	E	59.8	Low	81.7	Confident	45 Å²	45	58.5 Å²	58.5	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	103	-163.3	-60.5	178	-172	0	0	110.3	K179 D201	K179-E204 VanDerWaalsContact CA-OE2 3.27Å; K179-E204 WeakPolarHBondContact CA-OE2 3.42Å; K179-E204 WeakPolarHBondContact CB-OE2 3.5Å; K179-E204 WeakPolarHBondContact CD-OE1 3.36Å; K179-E204 WeakPolarHBondContact CE-OE1 3.29Å; K179-E204 VanDerWaalsContact CG-CD 3.45Å; K179-E204 WeakPolarHBondContact CG-OE1 3.31Å; K179-E204 WeakPolarHBondContact CG-OE2 3.45Å; K179-E204 IonicContact NZ-OE1 3.46Å; K179-E204 PolarHBondContact NZ-OE1 3.44Å; D201-E204 HydrophobicContact CB-CB 4.18Å; D201-E204 PolarHBondContact O-N 2.81Å
205	T	63	Low	81.8	Confident	65 Å²	65	61.4 Å²	61.4	40%	0.399	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.6	178.5	38.4	0	0	0	0	109.1	L207	T205-L207 PolarHBondContact O-N 3.16Å; T205-L207 WeakPolarHBondContact OG1-CD2 3.41Å; T205-L207 VanDerWaalsContact OG1-CG 3.31Å; T205-L207 WeakPolarHBondContact OG1-CG 3.46Å
206	L	75.4	Confident	81.9	Confident	11 Å²	11	60.4 Å²	60.4	6%	0.058	30%	0.301	C	S	.	.			trans	-68	63.4	168.5	-78.3	171.6	0	0	0	110.3	F178 L184 A208 L209 R233	F178-L206 HydrophobicContact CB-CD2 3.72Å; F178-L206 HydrophobicContact CB-CG 4.13Å; F178-L206 HydrophobicContact CD1-CD1 4.37Å; F178-L206 HydrophobicContact CD1-CD2 4.05Å; F178-L206 HydrophobicContact CD2-CD1 4.07Å; F178-L206 HydrophobicContact CE2-CD1 4.4Å; F178-L206 HydrophobicContact CG-CD1 4.06Å; F178-L206 HydrophobicContact CG-CD2 3.9Å; F178-L206 HydrophobicContact CG-CG 4.2Å; L184-L206 HydrophobicContact CB-CD2 4.32Å; L184-L206 HydrophobicContact CD2-CD2 4.03Å; L206-A208 VanDerWaalsContact C-N 3.26Å; L206-A208 PolarHBondContact O-N 3.25Å; L206-L209 HydrophobicContact CB-CB 4Å; L206-L209 HydrophobicContact CB-CD2 4.42Å; L206-L209 HydrophobicContact CD1-CD2 4.13Å; L206-L209 WeakPolarHBondContact O-CB 3.44Å; L206-L209 PolarHBondContact O-N 2.91Å; L206-L209 VanDerWaalsContact O-N 3.14Å; L206-R233 PolarHBondContact O-NE 2.88Å; L206-R233 PolarHBondContact O-NH2 3.05Å
207	L	79.6	Confident	82.2	Confident	134 Å²	134	56.3 Å²	56.3	70%	0.702	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-33.6	-169.4	-69	174.9	0	0	0	113	T205	T205-L207 PolarHBondContact O-N 3.16Å; T205-L207 WeakPolarHBondContact OG1-CD2 3.41Å; T205-L207 VanDerWaalsContact OG1-CG 3.31Å; T205-L207 WeakPolarHBondContact OG1-CG 3.46Å
208	A	89.9	Confident	82.4	Confident	32 Å²	32	60.9 Å²	60.9	26%	0.264	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.3	-178	0	0	0	0	0	114	L184 T185 L206 R210	L184-A208 CarbonylContact O-C 3.33Å; L184-A208 VanDerWaalsContact O-C 3.29Å; T185-A208 WeakPolarHBondContact CA-O 3.48Å; T185-A208 HydrophobicContact CG2-CB 4.48Å; L206-A208 VanDerWaalsContact C-N 3.26Å; L206-A208 PolarHBondContact O-N 3.25Å; A208-R210 PolarHBondContact O-N 2.97Å
209	L	93.4	Very high	82.9	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	28%	0.28	C	S	.	.			trans	-67.6	127.2	-172.6	-164.6	75.5	0	0	0	111.5	L184 L187 L206 L212 L236	L184-L209 HydrophobicContact CG-CD1 4.48Å; L184-L209 WeakPolarHBondContact O-CA 3.47Å; L184-L209 PolarHBondContact O-N 2.91Å; L187-L209 HydrophobicContact CB-CD1 3.84Å; L206-L209 HydrophobicContact CB-CB 4Å; L206-L209 HydrophobicContact CB-CD2 4.42Å; L206-L209 HydrophobicContact CD1-CD2 4.13Å; L206-L209 WeakPolarHBondContact O-CB 3.44Å; L206-L209 PolarHBondContact O-N 2.91Å; L206-L209 VanDerWaalsContact O-N 3.14Å; L209-L212 HydrophobicContact CD2-CB 4.15Å; L209-L212 HydrophobicContact CD2-CD2 4.38Å; L209-L236 HydrophobicContact CB-CD1 4.44Å; L209-L236 HydrophobicContact CD2-CD1 4.05Å; L209-L236 HydrophobicContact CG-CD1 4.04Å
210	R	95.4	Very high	84	Confident	131 Å²	131	61 Å²	61	49%	0.494	30%	0.3	S	S	.	.			trans	-120.5	-28.9	-178.4	-65.8	178.7	-176.1	-129.5	-1.3	112.7	T185 A208 L236 R237	T185-R210 PolarHBondContact O-N 3.42Å; A208-R210 PolarHBondContact O-N 2.97Å; R210-L236 CarbonylContact O-C 3.51Å; R210-L236 WeakPolarHBondContact O-CA 3.45Å; R210-R237 PolarHBondContact O-N 3.11Å
211	H	97.9	Very high	85.4	Confident	86 Å²	86	63 Å²	63	40%	0.398	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.9	-179.2	-58.6	95.3	0	0	0	109.8	T185 T186 L187 R237	T185-H211 PolarHBondContact O-N 3.27Å; T186-H211 WeakPolarHBondContact CA-O 3.38Å; T186-H211 HydrophobicContact CG2-CB 4.12Å; L187-H211 PolarHBondContact N-O 3Å; H211-R237 WeakPolarHBondContact CA-O 3.47Å
212	L	97.5	Very high	87	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	116	177.5	177.3	58.5	0	0	0	109.7	L187 L189 F197 L209 L214 F230 L236 R237 V238 Q239	L187-L212 HydrophobicContact CB-CD1 4.15Å; L187-L212 HydrophobicContact CD2-CD1 4.02Å; L187-L212 HydrophobicContact CG-CD1 4.09Å; L187-L212 WeakPolarHBondContact O-CA 3.24Å; L189-L212 HydrophobicContact CD1-CD1 4.34Å; F197-L212 HydrophobicContact CE1-CD2 3.76Å; F197-L212 HydrophobicContact CE2-CD1 4.39Å; F197-L212 HydrophobicContact CZ-CD1 4.2Å; F197-L212 HydrophobicContact CZ-CD2 3.79Å; L209-L212 HydrophobicContact CD2-CB 4.15Å; L209-L212 HydrophobicContact CD2-CD2 4.38Å; L212-L214 HydrophobicContact CD1-CD1 4.45Å; L212-L214 HydrophobicContact CD1-CD2 4.36Å; L212-L214 HydrophobicContact CD1-CG 4.02Å; L212-L214 HydrophobicContact CD2-CD1 3.78Å; L212-L214 HydrophobicContact CD2-CG 4.23Å; L212-L214 HydrophobicContact CG-CD1 4.02Å; L212-L214 HydrophobicContact CG-CG 3.93Å; L212-F230 HydrophobicContact CD2-CE1 3.95Å; L212-F230 HydrophobicContact CD2-CE2 4.3Å; L212-F230 HydrophobicContact CD2-CZ 3.44Å; L212-F230 VanDerWaalsContact CD2-CZ 3.44Å; L212-L236 HydrophobicContact CB-CD1 4.36Å; L212-R237 PolarHBondContact N-O 2.03Å; L212-V238 HydrophobicContact CB-CG1 4.47Å; L212-V238 HydrophobicContact CD2-CG1 4.27Å; L212-V238 HydrophobicContact CG-CG1 4.38Å; L212-V238 CarbonylContact O-C 3.47Å; L212-V238 WeakPolarHBondContact O-CA 3.45Å; L212-Q239 PolarHBondContact O-N 3.21Å
213	D	98.5	Very high	88.9	Confident	14 Å²	14	53.9 Å²	53.9	8%	0.075	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.6	174.5	-167.7	-6.9	0	0	0	110	L187 L189 R190 R215	L187-D213 PolarHBondContact O-N 3.49Å; L189-D213 CarbonylContact C-O 3.46Å; L189-D213 WeakPolarHBondContact CA-O 3.43Å; L189-D213 PolarHBondContact N-O 3.48Å; R190-D213 PolarHBondContact N-O 3.12Å; D213-R215 VanDerWaalsContact OD1-CB 3.28Å; D213-R215 WeakPolarHBondContact OD1-CB 3.16Å; D213-R215 WeakPolarHBondContact OD1-CG 3.21Å; D213-R215 IonicContact OD1-CZ 2.67Å; D213-R215 PolarHBondContact OD1-N 3.42Å; D213-R215 IonicContact OD1-NE 3.32Å; D213-R215 PolarHBondContact OD1-NE 2.86Å; D213-R215 IonicContact OD1-NH2 2.79Å; D213-R215 IonicContact OD2-CZ 2.66Å; D213-R215 IonicContact OD2-NE 3.92Å; D213-R215 PolarHBondContact OD2-NE 3.04Å; D213-R215 VanDerWaalsContact OD2-NE 3.17Å; D213-R215 IonicContact OD2-NH2 2.9Å; D213-R215 PolarHBondContact OD2-NH2 3.18Å
214	L	98.1	Very high	90.7	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.			trans	-113.3	17.2	176.7	-72.4	168.6	0	0	0	111.5	L189 L194 F197 L212 N217 L219 Q239 L240 N243	L189-L214 HydrophobicContact CB-CD2 4.01Å; L189-L214 HydrophobicContact CD1-CD2 3.89Å; L194-L214 HydrophobicContact CD1-CD2 4.13Å; F197-L214 HydrophobicContact CB-CD1 4.28Å; F197-L214 HydrophobicContact CB-CD2 4.2Å; F197-L214 HydrophobicContact CD1-CD1 3.88Å; F197-L214 HydrophobicContact CD2-CD1 4.42Å; F197-L214 HydrophobicContact CD2-CD2 3.73Å; F197-L214 HydrophobicContact CE1-CD1 4.36Å; F197-L214 HydrophobicContact CE2-CD2 4.28Å; F197-L214 HydrophobicContact CG-CD1 3.91Å; F197-L214 HydrophobicContact CG-CD2 3.92Å; L212-L214 HydrophobicContact CD1-CD1 4.45Å; L212-L214 HydrophobicContact CD1-CD2 4.36Å; L212-L214 HydrophobicContact CD1-CG 4.02Å; L212-L214 HydrophobicContact CD2-CD1 3.78Å; L212-L214 HydrophobicContact CD2-CG 4.23Å; L212-L214 HydrophobicContact CG-CD1 4.02Å; L212-L214 HydrophobicContact CG-CG 3.93Å; L214-N217 VanDerWaalsContact C-ND2 3.33Å; L214-N217 PolarHBondContact O-ND2 2.94Å; L214-L219 HydrophobicContact CB-CD1 4.13Å; L214-L219 HydrophobicContact CD1-CD1 4.2Å; L214-L219 HydrophobicContact CD2-CD1 4.49Å; L214-Q239 CarbonylContact C-O 3.59Å; L214-Q239 WeakPolarHBondContact CA-O 3.27Å; L214-Q239 WeakPolarHBondContact CB-O 3.17Å; L214-Q239 PolarHBondContact N-O 2.8Å; L214-L240 HydrophobicContact CB-CD2 4.01Å; L214-L240 HydrophobicContact CD1-CD2 4Å; L214-N243 PolarHBondContact O-ND2 3.47Å
215	R	98.6	Very high	92	Very high	62 Å²	62	49.3 Å²	49.3	23%	0.234	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	155.5	-177.8	-69.7	177.9	-66.3	172.4	-0	112.5	R190 N191 D213 N217 Q239 A241	R190-R215 CarbonylContact C-O 3.49Å; R190-R215 VanDerWaalsContact CA-O 3.29Å; R190-R215 WeakPolarHBondContact CA-O 3.4Å; R190-R215 HydrophobicContact CG-CB 4.05Å; N191-R215 PolarHBondContact N-O 3.43Å; D213-R215 VanDerWaalsContact OD1-CB 3.28Å; D213-R215 WeakPolarHBondContact OD1-CB 3.16Å; D213-R215 WeakPolarHBondContact OD1-CG 3.21Å; D213-R215 IonicContact OD1-CZ 2.67Å; D213-R215 PolarHBondContact OD1-N 3.42Å; D213-R215 IonicContact OD1-NE 3.32Å; D213-R215 PolarHBondContact OD1-NE 2.86Å; D213-R215 IonicContact OD1-NH2 2.79Å; D213-R215 IonicContact OD2-CZ 2.66Å; D213-R215 IonicContact OD2-NE 3.92Å; D213-R215 PolarHBondContact OD2-NE 3.04Å; D213-R215 VanDerWaalsContact OD2-NE 3.17Å; D213-R215 IonicContact OD2-NH2 2.9Å; D213-R215 PolarHBondContact OD2-NH2 3.18Å; R215-N217 PolarHBondContact O-N 2.9Å; R215-N217 PolarHBondContact O-ND2 3.24Å; R215-Q239 HydrophobicContact CG-CB 3.71Å; R215-A241 CarbonylContact C-O 3.58Å; R215-A241 WeakPolarHBondContact CA-O 3.08Å; R215-A241 WeakPolarHBondContact CB-O 3.49Å; R215-A241 HydrophobicContact CG-CB 4.23Å
216	D	98.1	Very high	93.3	Very high	59 Å²	59	46.2 Å²	46.2	32%	0.316	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	32.9	171.2	-52.3	-43.4	0	0	0	113.1	R190 N191 A241	R190-D216 HydrophobicContact CG-CB 4.49Å; R190-D216 IonicContact CZ-OD2 2.81Å; R190-D216 VanDerWaalsContact CZ-OD2 3.3Å; R190-D216 IonicContact NE-OD2 2.94Å; R190-D216 PolarHBondContact NE-OD2 3.49Å; R190-D216 IonicContact NH2-OD2 2.77Å; R190-D216 PolarHBondContact NH2-OD2 3.26Å; N191-D216 WeakPolarHBondContact CA-O 3.2Å; N191-D216 HydrophobicContact CB-CB 4.06Å; D216-A241 PolarHBondContact N-O 2.73Å
217	N	98.4	Very high	94.1	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.011	24%	0.242	C	C	.	.	S	Bend	trans	-101.8	-171.4	174.1	-78.8	-69.3	0	0	0	111.3	L189 S192 S193 L194 L214 R215 L219 N243 P244	L189-N217 PolarHBondContact O-ND2 3.02Å; S192-N217 VanDerWaalsContact C-OD1 3.29Å; S192-N217 WeakPolarHBondContact CA-OD1 3.39Å; S192-N217 PolarHBondContact N-OD1 3.15Å; S193-N217 PolarHBondContact N-OD1 2.85Å; L194-N217 HydrophobicContact CB-CB 4.12Å; L194-N217 WeakPolarHBondContact CB-OD1 3.31Å; L194-N217 PolarHBondContact N-OD1 2.85Å; L214-N217 VanDerWaalsContact C-ND2 3.33Å; L214-N217 PolarHBondContact O-ND2 2.94Å; R215-N217 PolarHBondContact O-N 2.9Å; R215-N217 PolarHBondContact O-ND2 3.24Å; N217-L219 HydrophobicContact CB-CG 4.15Å; N217-N243 VanDerWaalsContact CA-OD1 3.29Å; N217-N243 WeakPolarHBondContact CA-OD1 3.38Å; N217-N243 WeakPolarHBondContact CB-OD1 3.46Å; N217-N243 PolarHBondContact N-OD1 2.95Å; N217-N243 PolarHBondContact O-OD1 3.27Å; N217-N243 VanDerWaalsContact O-OD1 3.11Å; N217-P244 WeakPolarHBondContact O-CD 3.43Å
218	H	97.5	Very high	94.5	Very high	97 Å²	97	44.8 Å²	44.8	45%	0.449	24%	0.238	S	C	.	.			trans	-105.9	26.4	178.4	-68.6	-53.5	0	0	0	113.2	L194 I195 K220	L194-H218 CarbonylContact O-C 3.3Å; L194-H218 VanDerWaalsContact O-CA 3.22Å; L194-H218 WeakPolarHBondContact O-CA 3.4Å; L194-H218 WeakPolarHBondContact O-CB 3.46Å; L194-H218 PolarHBondContact O-N 3.4Å; I195-H218 HydrophobicContact CG2-CB 4.03Å; H218-K220 PolarHBondContact O-N 3.35Å
219	L	96.9	Very high	94.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.			trans	-66.7	125	179.8	-54.4	176.5	0	0	0	110.5	L194 F197 L214 N217 L222 N243 P244 W245	L194-L219 HydrophobicContact CB-CD2 4.36Å; L194-L219 PolarHBondContact O-N 3.09Å; F197-L219 HydrophobicContact CB-CD2 4.23Å; L214-L219 HydrophobicContact CB-CD1 4.13Å; L214-L219 HydrophobicContact CD1-CD1 4.2Å; L214-L219 HydrophobicContact CD2-CD1 4.49Å; N217-L219 HydrophobicContact CB-CG 4.15Å; L219-L222 HydrophobicContact CD1-CD2 4.33Å; L219-N243 HydrophobicContact CB-CB 4.15Å; L219-N243 VanDerWaalsContact CB-OD1 3.24Å; L219-N243 WeakPolarHBondContact CB-OD1 3.31Å; L219-N243 VanDerWaalsContact CG-OD1 3.28Å; L219-N243 WeakPolarHBondContact CG-OD1 3.34Å; L219-N243 PolarHBondContact N-OD1 2.94Å; L219-P244 CarbonylContact O-C 3.56Å; L219-P244 WeakPolarHBondContact O-CD 3.27Å; L219-W245 HydrophobicContact CB-CH2 4.1Å; L219-W245 HydrophobicContact CB-CZ3 4.34Å; L219-W245 HydrophobicContact CD1-CH2 4.44Å
220	K	95.8	Very high	94.3	Very high	105 Å²	105	43.5 Å²	43.5	46%	0.457	23%	0.227	S	C	.	.			trans	-97.6	-26	176	-66.1	-179.4	-177.3	172.7	0	112.6	H218 P244 R246	H218-K220 PolarHBondContact O-N 3.35Å; K220-P244 HydrophobicContact CG-CG 4.45Å; K220-R246 HydrophobicContact CB-CB 4.15Å; K220-R246 PolarHBondContact O-N 2.92Å
221	N	94.4	Very high	93.9	Very high	81 Å²	81	39 Å²	39	43%	0.433	22%	0.22	S	C	.	.			trans	-153.3	171.7	177.1	61.1	29.4	0	0	0	109.4
222	L	93.8	Very high	93.4	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.047	24%	0.235	C	C	.	.			trans	-116.3	133.4	165.8	-71.4	176	0	0	0	108.3	L219 M227 L240 W245 L254 W257	L219-L222 HydrophobicContact CD1-CD2 4.33Å; L222-M227 HydrophobicContact CB-CG 4.12Å; L222-M227 HydrophobicContact CB-SD 4.34Å; L222-M227 WeakPolarHBondContact O-CE 2.96Å; L222-L240 HydrophobicContact CD1-CD1 3.82Å; L222-L240 HydrophobicContact CD1-CD2 4.16Å; L222-W245 HydrophobicContact CD1-CH2 4.22Å; L222-W245 HydrophobicContact CD2-CH2 4.37Å; L222-W245 HydrophobicContact CG-CH2 3.88Å; L222-W245 HydrophobicContact CG-CZ3 4.02Å; L222-L254 HydrophobicContact CB-CD1 4.35Å; L222-L254 HydrophobicContact CD1-CD1 3.93Å; L222-L254 HydrophobicContact CG-CD1 4.37Å; L222-W257 HydrophobicContact CD1-CH2 4.4Å; L222-W257 HydrophobicContact CD1-CZ3 3.92Å
223	P	91.8	Very high	93	Very high	35 Å²	35	42.1 Å²	42.1	23%	0.227	24%	0.238	C	C	.	.			trans	-59	144.2	175.1	-23.3	33.5	0	0	0	111.9	F197 A225 T226 M227	F197-P223 WeakPolarHBondContact O-CD 3.34Å; P223-A225 VanDerWaalsContact C-N 3.26Å; P223-A225 PolarHBondContact O-N 3.16Å; P223-T226 WeakPolarHBondContact O-CB 3.46Å; P223-T226 PolarHBondContact O-N 3.38Å; P223-T226 VanDerWaalsContact O-N 3.08Å; P223-M227 PolarHBondContact O-N 2.75Å
224	A	90	Very high	92.4	Very high	53 Å²	53	48.8 Å²	48.8	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-56.8	-40.1	178	0	0	0	0	0	112.4	T226 M227 V228	A224-T226 VanDerWaalsContact C-N 3.31Å; A224-T226 PolarHBondContact O-N 3.01Å; A224-M227 HydrophobicContact CB-CE 4.42Å; A224-M227 PolarHBondContact O-N 3.2Å; A224-V228 WeakPolarHBondContact O-CG2 3.28Å; A224-V228 PolarHBondContact O-N 3.19Å
225	A	88.3	Confident	92.1	Very high	52 Å²	52	54.4 Å²	54.4	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-42	176.2	0	0	0	0	0	112.5	P223 V228 D229	P223-A225 VanDerWaalsContact C-N 3.26Å; P223-A225 PolarHBondContact O-N 3.16Å; A225-V228 PolarHBondContact O-N 3.22Å; A225-D229 VanDerWaalsContact O-CB 3.31Å; A225-D229 WeakPolarHBondContact O-CB 3.34Å; A225-D229 PolarHBondContact O-N 2.97Å
226	T	90.3	Very high	91.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-41.7	176.8	-55.3	0	0	0	0	111.7	F197 P223 A224 D229 F230	F197-T226 HydrophobicContact CD1-CG2 4.07Å; F197-T226 HydrophobicContact CE1-CG2 4.24Å; P223-T226 WeakPolarHBondContact O-CB 3.46Å; P223-T226 PolarHBondContact O-N 3.38Å; P223-T226 VanDerWaalsContact O-N 3.08Å; A224-T226 VanDerWaalsContact C-N 3.31Å; A224-T226 PolarHBondContact O-N 3.01Å; T226-D229 PolarHBondContact O-N 3.25Å; T226-F230 HydrophobicContact CG2-CD1 4.32Å; T226-F230 HydrophobicContact CG2-CD2 4.23Å; T226-F230 HydrophobicContact CG2-CE1 3.81Å; T226-F230 HydrophobicContact CG2-CE2 3.7Å; T226-F230 HydrophobicContact CG2-CZ 3.48Å; T226-F230 VanDerWaalsContact CG2-CZ 3.48Å; T226-F230 WeakPolarHBondContact O-CB 3.27Å; T226-F230 WeakPolarHBondContact O-CD1 3.28Å; T226-F230 WeakPolarHBondContact O-CG 3.49Å; T226-F230 PolarHBondContact O-N 3.13Å
227	M	91.2	Very high	91.8	Very high	14 Å²	14	55.7 Å²	55.7	7%	0.069	30%	0.303	C	S	.	.	H	α-helix	trans	-67.6	-37.3	177.6	-67.1	-177.6	-71.3	0	0	112.6	L222 P223 A224 G231 D253 L254 W257	L222-M227 HydrophobicContact CB-CG 4.12Å; L222-M227 HydrophobicContact CB-SD 4.34Å; L222-M227 WeakPolarHBondContact O-CE 2.96Å; P223-M227 PolarHBondContact O-N 2.75Å; A224-M227 HydrophobicContact CB-CE 4.42Å; A224-M227 PolarHBondContact O-N 3.2Å; M227-G231 PolarHBondContact O-N 3.2Å; M227-D253 HydrophobicContact CE-CB 3.67Å; M227-L254 VanDerWaalsContact SD-CA 3.56Å; M227-L254 HydrophobicContact SD-CB 4.12Å; M227-L254 HydrophobicContact SD-CD1 3.96Å; M227-W257 HydrophobicContact CB-CD2 4.37Å; M227-W257 HydrophobicContact CB-CG 4.18Å; M227-W257 HydrophobicContact CG-CD2 4.09Å; M227-W257 HydrophobicContact CG-CE3 4.21Å; M227-W257 HydrophobicContact CG-CG 4.26Å; M227-W257 HydrophobicContact SD-CB 3.91Å; M227-W257 HydrophobicContact SD-CD2 4.28Å; M227-W257 HydrophobicContact SD-CE3 4.18Å; M227-W257 HydrophobicContact SD-CG 4.2Å
228	V	88.9	Confident	91.8	Very high	101 Å²	101	55.6 Å²	55.6	61%	0.612	30%	0.303	S	S	*	.	H	α-helix	trans	-63	-48.8	173.5	170.7	0	0	0	0	110.3	A224 A225 F230 G231 L232	A224-V228 WeakPolarHBondContact O-CG2 3.28Å; A224-V228 PolarHBondContact O-N 3.19Å; A225-V228 PolarHBondContact O-N 3.22Å; V228-F230 PolarHBondContact O-N 2.81Å; V228-G231 WeakPolarHBondContact O-CA 3.08Å; V228-G231 PolarHBondContact O-N 3.35Å; V228-L232 PolarHBondContact O-N 3.34Å; V228-L232 VanDerWaalsContact O-N 3.13Å
229	D	87.6	Confident	91.8	Very high	10 Å²	10	53.9 Å²	53.9	5%	0.053	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-40.7	179.1	174.1	61.2	0	0	0	112.3	S199 V200 A225 T226 G231 L232 R233	S199-D229 WeakPolarHBondContact CB-OD2 3.35Å; S199-D229 PolarHBondContact OG-OD2 3.21Å; V200-D229 HydrophobicContact CG2-CB 3.55Å; A225-D229 VanDerWaalsContact O-CB 3.31Å; A225-D229 WeakPolarHBondContact O-CB 3.34Å; A225-D229 PolarHBondContact O-N 2.97Å; T226-D229 PolarHBondContact O-N 3.25Å; D229-G231 VanDerWaalsContact C-N 3.34Å; D229-G231 PolarHBondContact O-N 3.22Å; D229-L232 WeakPolarHBondContact O-CB 3.01Å; D229-L232 PolarHBondContact O-N 2.94Å; D229-R233 PolarHBondContact O-NH1 3.45Å; D229-R233 IonicContact OD1-CZ 3.67Å; D229-R233 IonicContact OD1-NH1 3.34Å; D229-R233 PolarHBondContact OD1-NH1 3.07Å; D229-R233 IonicContact OD1-NH2 2.63Å; D229-R233 PolarHBondContact OD1-NH2 2.92Å; D229-R233 IonicContact OD2-CZ 3.6Å; D229-R233 IonicContact OD2-NH1 3.18Å; D229-R233 PolarHBondContact OD2-NH1 3.15Å; D229-R233 IonicContact OD2-NH2 2.75Å; D229-R233 PolarHBondContact OD2-NH2 3.1Å
230	F	90.8	Very high	91.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-47	168.8	-69.5	-6.3	0	0	0	110.9	F197 L212 T226 V228 L232 R233 L236 V238 W257 Q263	F197-F230 HydrophobicContact CD1-CZ 4.16Å; F197-F230 HydrophobicContact CE1-CE1 4.06Å; F197-F230 AromaticContact CE1-CZ 3.65Å; F197-F230 HydrophobicContact CE1-CZ 3.65Å; L212-F230 HydrophobicContact CD2-CE1 3.95Å; L212-F230 HydrophobicContact CD2-CE2 4.3Å; L212-F230 HydrophobicContact CD2-CZ 3.44Å; L212-F230 VanDerWaalsContact CD2-CZ 3.44Å; T226-F230 HydrophobicContact CG2-CD1 4.32Å; T226-F230 HydrophobicContact CG2-CD2 4.23Å; T226-F230 HydrophobicContact CG2-CE1 3.81Å; T226-F230 HydrophobicContact CG2-CE2 3.7Å; T226-F230 HydrophobicContact CG2-CZ 3.48Å; T226-F230 VanDerWaalsContact CG2-CZ 3.48Å; T226-F230 WeakPolarHBondContact O-CB 3.27Å; T226-F230 WeakPolarHBondContact O-CD1 3.28Å; T226-F230 WeakPolarHBondContact O-CG 3.49Å; T226-F230 PolarHBondContact O-N 3.13Å; V228-F230 PolarHBondContact O-N 2.81Å; F230-L232 PolarHBondContact O-N 3.07Å; F230-L232 VanDerWaalsContact O-N 3.1Å; F230-R233 WeakPolarHBondContact O-CA 3.12Å; F230-R233 PolarHBondContact O-N 3.19Å; F230-L236 HydrophobicContact CB-CD2 3.89Å; F230-L236 HydrophobicContact CD1-CD2 3.47Å; F230-L236 VanDerWaalsContact CD1-CD2 3.47Å; F230-L236 HydrophobicContact CD2-CD2 4.45Å; F230-L236 HydrophobicContact CE1-CD2 4.06Å; F230-L236 HydrophobicContact CG-CD2 3.69Å; F230-V238 HydrophobicContact CD2-CG2 4.2Å; F230-V238 HydrophobicContact CE2-CG1 4.32Å; F230-V238 HydrophobicContact CE2-CG2 4.21Å; F230-W257 HydrophobicContact CB-CZ2 4.05Å; F230-W257 AromaticContact CD2-CH2 3.82Å; F230-W257 HydrophobicContact CD2-CH2 3.82Å; F230-W257 AromaticContact CD2-CZ2 3.7Å; F230-W257 HydrophobicContact CD2-CZ2 3.7Å; F230-W257 HydrophobicContact CE2-CH2 4.42Å; F230-W257 HydrophobicContact CG-CZ2 4.39Å; F230-Q263 PolarHBondContact O-NE2 2.89Å
231	G	88.2	Confident	91.9	Very high	35 Å²	35	49.3 Å²	49.3	36%	0.361	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-25.3	178.7	0	0	0	0	0	114.8	M227 V228 D229 R233	M227-G231 PolarHBondContact O-N 3.2Å; V228-G231 WeakPolarHBondContact O-CA 3.08Å; V228-G231 PolarHBondContact O-N 3.35Å; D229-G231 VanDerWaalsContact C-N 3.34Å; D229-G231 PolarHBondContact O-N 3.22Å; G231-R233 VanDerWaalsContact C-N 3.29Å
232	L	87.7	Confident	92.1	Very high	135 Å²	135	48 Å²	48	71%	0.707	28%	0.283	S	S	*	.	H	α-helix	trans	-72.8	-20.6	173.6	-63.1	173.9	0	0	0	113	V228 D229 F230	V228-L232 PolarHBondContact O-N 3.34Å; V228-L232 VanDerWaalsContact O-N 3.13Å; D229-L232 WeakPolarHBondContact O-CB 3.01Å; D229-L232 PolarHBondContact O-N 2.94Å; F230-L232 PolarHBondContact O-N 3.07Å; F230-L232 VanDerWaalsContact O-N 3.1Å
233	R	88.3	Confident	92.3	Very high	21 Å²	21	48 Å²	48	8%	0.079	28%	0.282	C	S	.	.			trans	-103.8	83.3	-176.6	-57.8	-170.2	-168.4	89.6	6.1	111.7	L206 D229 F230 G231 D235 L236 Q263	L206-R233 PolarHBondContact O-NE 2.88Å; L206-R233 PolarHBondContact O-NH2 3.05Å; D229-R233 PolarHBondContact O-NH1 3.45Å; D229-R233 IonicContact OD1-CZ 3.67Å; D229-R233 IonicContact OD1-NH1 3.34Å; D229-R233 PolarHBondContact OD1-NH1 3.07Å; D229-R233 IonicContact OD1-NH2 2.63Å; D229-R233 PolarHBondContact OD1-NH2 2.92Å; D229-R233 IonicContact OD2-CZ 3.6Å; D229-R233 IonicContact OD2-NH1 3.18Å; D229-R233 PolarHBondContact OD2-NH1 3.15Å; D229-R233 IonicContact OD2-NH2 2.75Å; D229-R233 PolarHBondContact OD2-NH2 3.1Å; F230-R233 WeakPolarHBondContact O-CA 3.12Å; F230-R233 PolarHBondContact O-N 3.19Å; G231-R233 VanDerWaalsContact C-N 3.29Å; R233-D235 PolarHBondContact O-N 3.3Å; R233-D235 VanDerWaalsContact O-N 3.11Å; R233-L236 HydrophobicContact CB-CB 3.76Å; R233-L236 HydrophobicContact CB-CD2 4.41Å; R233-L236 WeakPolarHBondContact O-CB 3.22Å; R233-L236 PolarHBondContact O-N 3.38Å; R233-Q263 PolarHBondContact O-NE2 2.73Å
234	L	85.8	Confident	92.5	Very high	154 Å²	154	48 Å²	48	81%	0.806	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-32.5	-174.3	-62.4	176.1	0	0	0	114.7	L236	L234-L236 VanDerWaalsContact C-N 3.35Å
235	D	91.5	Very high	92.9	Very high	118 Å²	118	45.6 Å²	45.6	63%	0.631	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-1.4	-180	-68.8	-29.4	0	0	0	114	R233 R237	R233-D235 PolarHBondContact O-N 3.3Å; R233-D235 VanDerWaalsContact O-N 3.11Å; D235-R237 PolarHBondContact O-N 2.84Å
236	L	94.4	Very high	93.2	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	26%	0.261	C	S	.	.			trans	-69.9	127.5	-178.7	179.7	66.6	0	0	0	110.9	L209 R210 L212 F230 R233 L234 V238 Q263	L209-L236 HydrophobicContact CB-CD1 4.44Å; L209-L236 HydrophobicContact CD2-CD1 4.05Å; L209-L236 HydrophobicContact CG-CD1 4.04Å; R210-L236 CarbonylContact O-C 3.51Å; R210-L236 WeakPolarHBondContact O-CA 3.45Å; L212-L236 HydrophobicContact CB-CD1 4.36Å; F230-L236 HydrophobicContact CB-CD2 3.89Å; F230-L236 HydrophobicContact CD1-CD2 3.47Å; F230-L236 VanDerWaalsContact CD1-CD2 3.47Å; F230-L236 HydrophobicContact CD2-CD2 4.45Å; F230-L236 HydrophobicContact CE1-CD2 4.06Å; F230-L236 HydrophobicContact CG-CD2 3.69Å; R233-L236 HydrophobicContact CB-CB 3.76Å; R233-L236 HydrophobicContact CB-CD2 4.41Å; R233-L236 WeakPolarHBondContact O-CB 3.22Å; R233-L236 PolarHBondContact O-N 3.38Å; L234-L236 VanDerWaalsContact C-N 3.35Å; L236-V238 HydrophobicContact CD1-CG2 4.38Å; L236-V238 HydrophobicContact CD2-CG2 3.77Å; L236-V238 HydrophobicContact CG-CG2 3.72Å; L236-Q263 WeakPolarHBondContact O-CA 3.12Å; L236-Q263 VanDerWaalsContact O-CB 3.22Å; L236-Q263 WeakPolarHBondContact O-CB 3.36Å; L236-Q263 WeakPolarHBondContact O-CG 3.34Å
237	R	96.9	Very high	93.5	Very high	144 Å²	144	48.2 Å²	48.2	54%	0.543	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.3	171.4	-63.1	-174.9	-176.4	-86.6	-3.1	109.1	R210 H211 L212 D235 Q263 V265	R210-R237 PolarHBondContact O-N 3.11Å; H211-R237 WeakPolarHBondContact CA-O 3.47Å; L212-R237 PolarHBondContact N-O 2.03Å; D235-R237 PolarHBondContact O-N 2.84Å; R237-Q263 CarbonylContact C-O 3.55Å; R237-Q263 WeakPolarHBondContact CA-O 3.26Å; R237-V265 HydrophobicContact CB-CG2 3.87Å; R237-V265 HydrophobicContact CG-CG2 4.27Å
238	V	97.1	Very high	93.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.6	-178.7	-167.4	0	0	0	0	109.5	L212 F230 L236 L240 Q263 V264 V265	L212-V238 HydrophobicContact CB-CG1 4.47Å; L212-V238 HydrophobicContact CD2-CG1 4.27Å; L212-V238 HydrophobicContact CG-CG1 4.38Å; L212-V238 CarbonylContact O-C 3.47Å; L212-V238 WeakPolarHBondContact O-CA 3.45Å; F230-V238 HydrophobicContact CD2-CG2 4.2Å; F230-V238 HydrophobicContact CE2-CG1 4.32Å; F230-V238 HydrophobicContact CE2-CG2 4.21Å; L236-V238 HydrophobicContact CD1-CG2 4.38Å; L236-V238 HydrophobicContact CD2-CG2 3.77Å; L236-V238 HydrophobicContact CG-CG2 3.72Å; V238-L240 HydrophobicContact CG1-CD1 4.4Å; V238-L240 HydrophobicContact CG1-CD2 4.01Å; V238-L240 HydrophobicContact CG1-CG 3.92Å; V238-Q263 PolarHBondContact N-O 3.4Å; V238-V264 WeakPolarHBondContact O-CA 3.43Å; V238-V265 PolarHBondContact O-N 2.8Å
239	Q	98.3	Very high	93.5	Very high	61 Å²	61	45.7 Å²	45.7	29%	0.285	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.3	171.2	-57.8	-172.2	-105.2	0	0	110.2	L212 L214 R215 V265 D266	L212-Q239 PolarHBondContact O-N 3.21Å; L214-Q239 CarbonylContact C-O 3.59Å; L214-Q239 WeakPolarHBondContact CA-O 3.27Å; L214-Q239 WeakPolarHBondContact CB-O 3.17Å; L214-Q239 PolarHBondContact N-O 2.8Å; R215-Q239 HydrophobicContact CG-CB 3.71Å; Q239-V265 HydrophobicContact CG-CB 4.49Å; Q239-D266 WeakPolarHBondContact CA-OD1 3.14Å; Q239-D266 WeakPolarHBondContact CA-OD2 3.37Å
240	L	97.9	Very high	93.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.			trans	-133.5	-3.5	-166.7	-73.8	179.8	0	0	0	114.1	L214 L222 V238 N243 W245 W257 V264 D266 L270	L214-L240 HydrophobicContact CB-CD2 4.01Å; L214-L240 HydrophobicContact CD1-CD2 4Å; L222-L240 HydrophobicContact CD1-CD1 3.82Å; L222-L240 HydrophobicContact CD1-CD2 4.16Å; V238-L240 HydrophobicContact CG1-CD1 4.4Å; V238-L240 HydrophobicContact CG1-CD2 4.01Å; V238-L240 HydrophobicContact CG1-CG 3.92Å; L240-N243 PolarHBondContact O-ND2 2.81Å; L240-W245 HydrophobicContact CB-CZ2 3.86Å; L240-W245 HydrophobicContact CD1-CH2 4.41Å; L240-W245 HydrophobicContact CD1-CZ2 4.27Å; L240-W245 HydrophobicContact CD2-CH2 4.09Å; L240-W245 HydrophobicContact CD2-CZ2 4.02Å; L240-W245 HydrophobicContact CG-CZ2 4.26Å; L240-W257 HydrophobicContact CD1-CH2 4.26Å; L240-W257 HydrophobicContact CD1-CZ3 3.88Å; L240-V264 HydrophobicContact CB-CG1 4.35Å; L240-V264 HydrophobicContact CD1-CG1 3.95Å; L240-V264 HydrophobicContact CD1-CG2 4.01Å; L240-V264 HydrophobicContact CG-CG1 4.33Å; L240-D266 VanDerWaalsContact N-CG 3.31Å; L240-D266 PolarHBondContact N-OD1 3.04Å; L240-D266 PolarHBondContact N-OD2 3Å; L240-L270 VanDerWaalsContact C-CD2 3.41Å; L240-L270 HydrophobicContact CB-CD1 4.18Å; L240-L270 HydrophobicContact CB-CD2 3.73Å; L240-L270 HydrophobicContact CD1-CD1 4.47Å
241	A	97.7	Very high	93.7	Very high	9 Å²	9	52.5 Å²	52.5	7%	0.074	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	154.4	-179.8	0	0	0	0	0	112.9	R215 D216 N243 D266 E269 L270	R215-A241 CarbonylContact C-O 3.58Å; R215-A241 WeakPolarHBondContact CA-O 3.08Å; R215-A241 WeakPolarHBondContact CB-O 3.49Å; R215-A241 HydrophobicContact CG-CB 4.23Å; D216-A241 PolarHBondContact N-O 2.73Å; A241-N243 VanDerWaalsContact C-N 3.29Å; A241-N243 PolarHBondContact O-N 2.76Å; A241-D266 HydrophobicContact CB-CB 4.3Å; A241-D266 WeakPolarHBondContact CB-OD2 3.45Å; A241-D266 PolarHBondContact N-OD2 2.79Å; A241-E269 HydrophobicContact CB-CB 4.31Å; A241-L270 HydrophobicContact CB-CD2 4.38Å
242	G	97.3	Very high	93.8	Very high	54 Å²	54	52.7 Å²	52.7	56%	0.557	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	5	178.8	0	0	0	0	0	115.5
243	N	98.3	Very high	94	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.043	26%	0.262	C	S	.	.			trans	-90.9	144.2	175.4	-77.7	-78.8	0	0	0	112.9	L214 N217 L219 L240 A241 W245	L214-N243 PolarHBondContact O-ND2 3.47Å; N217-N243 VanDerWaalsContact CA-OD1 3.29Å; N217-N243 WeakPolarHBondContact CA-OD1 3.38Å; N217-N243 WeakPolarHBondContact CB-OD1 3.46Å; N217-N243 PolarHBondContact N-OD1 2.95Å; N217-N243 PolarHBondContact O-OD1 3.27Å; N217-N243 VanDerWaalsContact O-OD1 3.11Å; L219-N243 HydrophobicContact CB-CB 4.15Å; L219-N243 VanDerWaalsContact CB-OD1 3.24Å; L219-N243 WeakPolarHBondContact CB-OD1 3.31Å; L219-N243 VanDerWaalsContact CG-OD1 3.28Å; L219-N243 WeakPolarHBondContact CG-OD1 3.34Å; L219-N243 PolarHBondContact N-OD1 2.94Å; L240-N243 PolarHBondContact O-ND2 2.81Å; A241-N243 VanDerWaalsContact C-N 3.29Å; A241-N243 PolarHBondContact O-N 2.76Å; N243-W245 VanDerWaalsContact C-N 3.28Å; N243-W245 HydrophobicContact CB-CD2 4.33Å; N243-W245 HydrophobicContact CB-CH2 4.48Å; N243-W245 HydrophobicContact CB-CZ2 3.68Å; N243-W245 PolarHBondContact O-N 3.31Å
244	P	97.3	Very high	94.3	Very high	37 Å²	37	49.8 Å²	49.8	24%	0.24	26%	0.259	C	S	.	.			trans	-80.4	66.8	-179.5	34.7	-38	0	0	0	112.8	N217 L219 K220 R246 A273	N217-P244 WeakPolarHBondContact O-CD 3.43Å; L219-P244 CarbonylContact O-C 3.56Å; L219-P244 WeakPolarHBondContact O-CD 3.27Å; K220-P244 HydrophobicContact CG-CG 4.45Å; P244-R246 PolarHBondContact O-N 3.35Å; P244-A273 HydrophobicContact CB-CB 3.77Å
245	W	97.1	Very high	94.7	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	127.7	-177.7	-61.3	107.4	0	0	0	113	L219 L222 L240 N243 L254 A273 D274 L283	L219-W245 HydrophobicContact CB-CH2 4.1Å; L219-W245 HydrophobicContact CB-CZ3 4.34Å; L219-W245 HydrophobicContact CD1-CH2 4.44Å; L222-W245 HydrophobicContact CD1-CH2 4.22Å; L222-W245 HydrophobicContact CD2-CH2 4.37Å; L222-W245 HydrophobicContact CG-CH2 3.88Å; L222-W245 HydrophobicContact CG-CZ3 4.02Å; L240-W245 HydrophobicContact CB-CZ2 3.86Å; L240-W245 HydrophobicContact CD1-CH2 4.41Å; L240-W245 HydrophobicContact CD1-CZ2 4.27Å; L240-W245 HydrophobicContact CD2-CH2 4.09Å; L240-W245 HydrophobicContact CD2-CZ2 4.02Å; L240-W245 HydrophobicContact CG-CZ2 4.26Å; N243-W245 VanDerWaalsContact C-N 3.28Å; N243-W245 HydrophobicContact CB-CD2 4.33Å; N243-W245 HydrophobicContact CB-CH2 4.48Å; N243-W245 HydrophobicContact CB-CZ2 3.68Å; N243-W245 PolarHBondContact O-N 3.31Å; W245-L254 HydrophobicContact CD2-CD2 4.17Å; W245-L254 HydrophobicContact CE3-CD2 3.5Å; W245-L254 VanDerWaalsContact CE3-CD2 3.5Å; W245-L254 HydrophobicContact CZ3-CD2 3.7Å; W245-A273 PolarHBondContact O-N 3.03Å; W245-D274 PolarHBondContact O-N 2.89Å; W245-L283 HydrophobicContact CB-CD1 3.96Å; W245-L283 HydrophobicContact CB-CD2 4.12Å; W245-L283 HydrophobicContact CD2-CD2 4.29Å; W245-L283 HydrophobicContact CG-CD1 4.21Å; W245-L283 HydrophobicContact CG-CD2 3.87Å
246	R	95.6	Very high	94.7	Very high	105 Å²	105	39.4 Å²	39.4	40%	0.396	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	103.4	176.6	177.4	-177.9	-79.8	-163.9	-5.7	110.2	K220 P244 N248 I251 D274	K220-R246 HydrophobicContact CB-CB 4.15Å; K220-R246 PolarHBondContact O-N 2.92Å; P244-R246 PolarHBondContact O-N 3.35Å; R246-N248 WeakPolarHBondContact CD-ND2 3.49Å; R246-N248 HydrophobicContact CG-CB 4.44Å; R246-N248 PolarHBondContact O-N 3.3Å; R246-I251 WeakPolarHBondContact O-CD1 3.31Å; R246-D274 CarbonylContact C-O 3.59Å; R246-D274 IonicContact NE-OD1 3.33Å
247	C	95	Very high	94.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	22%	0.215	C	C	.	.			trans	-90.5	63.8	-177.5	-64	0	0	0	0	113	I251 C272 D274 P275 V278 L291	C247-I251 HydrophobicContact CB-CD1 4.15Å; C247-I251 WeakPolarHBondContact SG-CD1 3.43Å; C247-C272 HydrophobicContact CB-CB 3.72Å; C247-C272 WeakPolarHBondContact CB-SG 3.32Å; C247-C272 VanDerWaalsContact SG-CA 3.51Å; C247-C272 WeakPolarHBondContact SG-CB 3.47Å; C247-C272 CovalentContact SG-SG 2.02Å; C247-C272 PolarHBondContact SG-SG 3.44Å; C247-D274 PolarHBondContact N-O 3.18Å; C247-P275 VanDerWaalsContact O-CD 3.31Å; C247-P275 WeakPolarHBondContact O-CD 3.3Å; C247-V278 HydrophobicContact CB-CG2 3.8Å; C247-L291 HydrophobicContact CB-CD2 4.33Å; C247-L291 WeakPolarHBondContact O-CD2 3.34Å
248	N	91.6	Very high	94.6	Very high	23 Å²	23	34 Å²	34	12%	0.123	19%	0.191	C	C	.	.	S	Bend	trans	-108.6	-167.9	170.9	69.5	6	0	0	0	110.8	R246 F250 I251 K292	R246-N248 WeakPolarHBondContact CD-ND2 3.49Å; R246-N248 HydrophobicContact CG-CB 4.44Å; R246-N248 PolarHBondContact O-N 3.3Å; N248-F250 PolarHBondContact O-N 3.45Å; N248-F250 VanDerWaalsContact O-N 3.1Å; N248-F250 WeakPolarHBondContact OD1-CB 3.43Å; N248-F250 PolarHBondContact OD1-N 3.35Å; N248-I251 WeakPolarHBondContact O-CG2 3.33Å; N248-I251 PolarHBondContact O-N 3.09Å; N248-I251 VanDerWaalsContact O-N 3.15Å; N248-K292 WeakPolarHBondContact CB-O 3.34Å
249	C	89.3	Confident	94.3	Very high	39 Å²	39	40 Å²	40	26%	0.264	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-61.5	-20.7	-178.6	77.7	0	0	0	0	114.8	I251 C293	C249-I251 VanDerWaalsContact C-N 3.29Å; C249-I251 PolarHBondContact O-N 3.49Å; C249-C293 VanDerWaalsContact CA-SG 3.54Å; C249-C293 HydrophobicContact CB-CB 3.66Å; C249-C293 WeakPolarHBondContact CB-SG 3.4Å; C249-C293 PolarHBondContact N-SG 2.95Å; C249-C293 WeakPolarHBondContact SG-CB 3.31Å; C249-C293 CovalentContact SG-SG 1.98Å; C249-C293 PolarHBondContact SG-SG 3.26Å
250	F	90	Very high	94	Very high	152 Å²	152	44.1 Å²	44.1	67%	0.667	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-79.6	-8.5	179.6	-57.7	-68.8	0	0	0	113.4	N248 S252	N248-F250 PolarHBondContact O-N 3.45Å; N248-F250 VanDerWaalsContact O-N 3.1Å; N248-F250 WeakPolarHBondContact OD1-CB 3.43Å; N248-F250 PolarHBondContact OD1-N 3.35Å; F250-S252 PolarHBondContact O-N 2.9Å
251	I	92.6	Very high	93.6	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-79.7	-3	177.7	-152.2	174.8	0	0	0	112.8	R246 C247 N248 C249 D253 L254 L255 L283 L291	R246-I251 WeakPolarHBondContact O-CD1 3.31Å; C247-I251 HydrophobicContact CB-CD1 4.15Å; C247-I251 WeakPolarHBondContact SG-CD1 3.43Å; N248-I251 WeakPolarHBondContact O-CG2 3.33Å; N248-I251 PolarHBondContact O-N 3.09Å; N248-I251 VanDerWaalsContact O-N 3.15Å; C249-I251 VanDerWaalsContact C-N 3.29Å; C249-I251 PolarHBondContact O-N 3.49Å; I251-D253 VanDerWaalsContact C-N 3.28Å; I251-D253 PolarHBondContact O-N 3.39Å; I251-L254 HydrophobicContact CD1-CD2 4.11Å; I251-L254 HydrophobicContact CG1-CB 4.03Å; I251-L254 HydrophobicContact CG1-CD2 3.83Å; I251-L254 HydrophobicContact CG1-CG 4.39Å; I251-L254 PolarHBondContact O-N 3.42Å; I251-L254 VanDerWaalsContact O-N 3.16Å; I251-L255 HydrophobicContact CG1-CG 4.44Å; I251-L255 HydrophobicContact CG2-CD1 3.74Å; I251-L255 HydrophobicContact CG2-CG 3.98Å; I251-L255 WeakPolarHBondContact O-CG 3.48Å; I251-L255 PolarHBondContact O-N 3.23Å; I251-L283 HydrophobicContact CD1-CD2 4.09Å; I251-L283 HydrophobicContact CD1-CG 4.22Å; I251-L291 HydrophobicContact CG2-CD1 3.89Å; I251-L291 HydrophobicContact CG2-CD2 3.67Å; I251-L291 HydrophobicContact CG2-CG 4.44Å
252	S	90.1	Very high	93.3	Very high	38 Å²	38	51.4 Å²	51.4	27%	0.266	29%	0.286	S	S	.	.	H	α-helix	trans	-52.6	-44.6	-173.9	53.7	0	0	0	0	113.2	F250 L255 A256	F250-S252 PolarHBondContact O-N 2.9Å; S252-L255 PolarHBondContact O-N 2.85Å; S252-A256 WeakPolarHBondContact O-CB 3.25Å; S252-A256 PolarHBondContact O-N 3.5Å
253	D	92.1	Very high	93.2	Very high	91 Å²	91	49.5 Å²	49.5	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-70.7	-39.4	-175.8	-60.5	-17.4	0	0	0	110.8	M227 I251 L255 A256 W257	M227-D253 HydrophobicContact CE-CB 3.67Å; I251-D253 VanDerWaalsContact C-N 3.28Å; I251-D253 PolarHBondContact O-N 3.39Å; D253-L255 PolarHBondContact O-N 3.42Å; D253-A256 PolarHBondContact O-N 2.94Å; D253-W257 WeakPolarHBondContact O-CB 3.22Å; D253-W257 PolarHBondContact O-N 3.12Å
254	L	94.2	Very high	93.1	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-44.3	173.6	179.4	66.4	0	0	0	111	L222 M227 W245 I251 A256 W257 L258 L283	L222-L254 HydrophobicContact CB-CD1 4.35Å; L222-L254 HydrophobicContact CD1-CD1 3.93Å; L222-L254 HydrophobicContact CG-CD1 4.37Å; M227-L254 VanDerWaalsContact SD-CA 3.56Å; M227-L254 HydrophobicContact SD-CB 4.12Å; M227-L254 HydrophobicContact SD-CD1 3.96Å; W245-L254 HydrophobicContact CD2-CD2 4.17Å; W245-L254 HydrophobicContact CE3-CD2 3.5Å; W245-L254 VanDerWaalsContact CE3-CD2 3.5Å; W245-L254 HydrophobicContact CZ3-CD2 3.7Å; I251-L254 HydrophobicContact CD1-CD2 4.11Å; I251-L254 HydrophobicContact CG1-CB 4.03Å; I251-L254 HydrophobicContact CG1-CD2 3.83Å; I251-L254 HydrophobicContact CG1-CG 4.39Å; I251-L254 PolarHBondContact O-N 3.42Å; I251-L254 VanDerWaalsContact O-N 3.16Å; L254-A256 PolarHBondContact O-N 2.99Å; L254-W257 HydrophobicContact CD1-CE3 3.83Å; L254-W257 HydrophobicContact CD1-CZ3 4.09Å; L254-W257 PolarHBondContact O-N 2.83Å; L254-L258 HydrophobicContact CD1-CD1 4.3Å; L254-L258 HydrophobicContact CD1-CG 4.27Å; L254-L258 HydrophobicContact CG-CD1 4.02Å; L254-L258 HydrophobicContact CG-CG 4.41Å; L254-L258 WeakPolarHBondContact O-CB 3.25Å; L254-L258 VanDerWaalsContact O-CG 3.22Å; L254-L258 WeakPolarHBondContact O-CG 3.48Å; L254-L258 PolarHBondContact O-N 3.01Å; L254-L283 HydrophobicContact CD2-CD2 4.05Å
255	L	93.9	Very high	93.1	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-39.2	176.9	-67.5	-179.1	0	0	0	112.4	I251 S252 D253 K259 L283 L291	I251-L255 HydrophobicContact CG1-CG 4.44Å; I251-L255 HydrophobicContact CG2-CD1 3.74Å; I251-L255 HydrophobicContact CG2-CG 3.98Å; I251-L255 WeakPolarHBondContact O-CG 3.48Å; I251-L255 PolarHBondContact O-N 3.23Å; S252-L255 PolarHBondContact O-N 2.85Å; D253-L255 PolarHBondContact O-N 3.42Å; L255-K259 VanDerWaalsContact O-CG 3.29Å; L255-K259 WeakPolarHBondContact O-CG 3.46Å; L255-K259 PolarHBondContact O-N 2.98Å; L255-K259 VanDerWaalsContact O-N 3.12Å; L255-L283 HydrophobicContact CD2-CB 3.91Å; L255-L283 HydrophobicContact CD2-CG 4.2Å; L255-L283 WeakPolarHBondContact CD2-O 3.27Å; L255-L291 HydrophobicContact CD1-CD1 3.92Å
256	A	92.4	Very high	93.1	Very high	48 Å²	48	52 Å²	52	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-44.8	175.9	0	0	0	0	0	111.1	S252 D253 L254 K259 N260	S252-A256 WeakPolarHBondContact O-CB 3.25Å; S252-A256 PolarHBondContact O-N 3.5Å; D253-A256 PolarHBondContact O-N 2.94Å; L254-A256 PolarHBondContact O-N 2.99Å; A256-K259 PolarHBondContact O-N 3.26Å; A256-N260 WeakPolarHBondContact O-CB 3.26Å; A256-N260 PolarHBondContact O-N 2.88Å; A256-N260 VanDerWaalsContact O-N 3.1Å
257	W	93.6	Very high	93.1	Very high	26 Å²	26	47.8 Å²	47.8	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-47	176.1	178.2	69.7	0	0	0	111.9	L222 M227 F230 L240 D253 L254 K259 N260 S261 V264	L222-W257 HydrophobicContact CD1-CH2 4.4Å; L222-W257 HydrophobicContact CD1-CZ3 3.92Å; M227-W257 HydrophobicContact CB-CD2 4.37Å; M227-W257 HydrophobicContact CB-CG 4.18Å; M227-W257 HydrophobicContact CG-CD2 4.09Å; M227-W257 HydrophobicContact CG-CE3 4.21Å; M227-W257 HydrophobicContact CG-CG 4.26Å; M227-W257 HydrophobicContact SD-CB 3.91Å; M227-W257 HydrophobicContact SD-CD2 4.28Å; M227-W257 HydrophobicContact SD-CE3 4.18Å; M227-W257 HydrophobicContact SD-CG 4.2Å; F230-W257 HydrophobicContact CB-CZ2 4.05Å; F230-W257 AromaticContact CD2-CH2 3.82Å; F230-W257 HydrophobicContact CD2-CH2 3.82Å; F230-W257 AromaticContact CD2-CZ2 3.7Å; F230-W257 HydrophobicContact CD2-CZ2 3.7Å; F230-W257 HydrophobicContact CE2-CH2 4.42Å; F230-W257 HydrophobicContact CG-CZ2 4.39Å; L240-W257 HydrophobicContact CD1-CH2 4.26Å; L240-W257 HydrophobicContact CD1-CZ3 3.88Å; D253-W257 WeakPolarHBondContact O-CB 3.22Å; D253-W257 PolarHBondContact O-N 3.12Å; L254-W257 HydrophobicContact CD1-CE3 3.83Å; L254-W257 HydrophobicContact CD1-CZ3 4.09Å; L254-W257 PolarHBondContact O-N 2.83Å; W257-K259 VanDerWaalsContact C-N 3.27Å; W257-K259 PolarHBondContact O-N 3.39Å; W257-N260 PolarHBondContact O-N 2.95Å; W257-S261 WeakPolarHBondContact O-CB 3.05Å; W257-S261 PolarHBondContact O-N 2.64Å; W257-V264 HydrophobicContact CE3-CG2 4.1Å; W257-V264 HydrophobicContact CH2-CG2 3.1Å; W257-V264 HydrophobicContact CZ2-CG2 3.8Å; W257-V264 HydrophobicContact CZ3-CG2 3.27Å
258	L	94.4	Very high	93	Very high	8 Å²	8	58.6 Å²	58.6	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-30.9	178	-72.8	172.7	0	0	0	113.6	L254 V264 A267 L270 L283 L284	L254-L258 HydrophobicContact CD1-CD1 4.3Å; L254-L258 HydrophobicContact CD1-CG 4.27Å; L254-L258 HydrophobicContact CG-CD1 4.02Å; L254-L258 HydrophobicContact CG-CG 4.41Å; L254-L258 WeakPolarHBondContact O-CB 3.25Å; L254-L258 VanDerWaalsContact O-CG 3.22Å; L254-L258 WeakPolarHBondContact O-CG 3.48Å; L254-L258 PolarHBondContact O-N 3.01Å; L258-V264 HydrophobicContact CD2-CB 3.93Å; L258-V264 HydrophobicContact CD2-CG1 3.95Å; L258-V264 HydrophobicContact CD2-CG2 3.73Å; L258-A267 HydrophobicContact CD2-CB 4.18Å; L258-L270 HydrophobicContact CD1-CD1 3.85Å; L258-L270 HydrophobicContact CD2-CD1 3.77Å; L258-L270 HydrophobicContact CG-CD1 4.5Å; L258-L283 HydrophobicContact CD1-CB 4.25Å; L258-L283 HydrophobicContact CD1-CD2 3.79Å; L258-L284 HydrophobicContact CB-CD2 3.85Å
259	K	92.4	Very high	93.3	Very high	126 Å²	126	64 Å²	64	55%	0.548	33%	0.33	S	S	.	.	H	α-helix	trans	-78.3	-31.8	177	-74.2	172.5	-177.1	176.1	0	112.8	L255 A256 W257 L284	L255-K259 VanDerWaalsContact O-CG 3.29Å; L255-K259 WeakPolarHBondContact O-CG 3.46Å; L255-K259 PolarHBondContact O-N 2.98Å; L255-K259 VanDerWaalsContact O-N 3.12Å; A256-K259 PolarHBondContact O-N 3.26Å; W257-K259 VanDerWaalsContact C-N 3.27Å; W257-K259 PolarHBondContact O-N 3.39Å; K259-L284 HydrophobicContact CG-CD2 4.06Å
260	N	91.5	Very high	93.6	Very high	146 Å²	146	62.2 Å²	62.2	78%	0.781	32%	0.318	S	S	*	.	H	α-helix	trans	-98.9	-13.7	-174	-68.2	-9.7	0	0	0	113.5	A256 W257	A256-N260 WeakPolarHBondContact O-CB 3.26Å; A256-N260 PolarHBondContact O-N 2.88Å; A256-N260 VanDerWaalsContact O-N 3.1Å; W257-N260 PolarHBondContact O-N 2.95Å
261	S	89.3	Confident	94	Very high	25 Å²	25	57.7 Å²	57.7	18%	0.175	30%	0.302	C	S	.	.			trans	-107.2	146.4	-177.4	-175.2	0	0	0	0	112.2	W257 Q263	W257-S261 WeakPolarHBondContact O-CB 3.05Å; W257-S261 PolarHBondContact O-N 2.64Å; S261-Q263 VanDerWaalsContact OG-CB 3.28Å; S261-Q263 WeakPolarHBondContact OG-CB 3.31Å; S261-Q263 WeakPolarHBondContact OG-CG 3.04Å; S261-Q263 PolarHBondContact OG-N 3.07Å; S261-Q263 VanDerWaalsContact OG-N 3.09Å; S261-Q263 PolarHBondContact OG-OE1 2.95Å
262	T	91.7	Very high	94.2	Very high	137 Å²	137	57.6 Å²	57.6	84%	0.84	30%	0.302	S	S	*	.	S	Bend	trans	-104.6	3.8	169.7	56.4	0	0	0	0	112.5
263	Q	94.6	Very high	94.5	Very high	14 Å²	14	57.1 Å²	57.1	7%	0.065	30%	0.301	C	S	.	.			trans	-72.4	-31.8	-175.3	-62.6	172.7	-66.2	0	0	112.2	F230 R233 L236 R237 V238 S261 V265	F230-Q263 PolarHBondContact O-NE2 2.89Å; R233-Q263 PolarHBondContact O-NE2 2.73Å; L236-Q263 WeakPolarHBondContact O-CA 3.12Å; L236-Q263 VanDerWaalsContact O-CB 3.22Å; L236-Q263 WeakPolarHBondContact O-CB 3.36Å; L236-Q263 WeakPolarHBondContact O-CG 3.34Å; R237-Q263 CarbonylContact C-O 3.55Å; R237-Q263 WeakPolarHBondContact CA-O 3.26Å; V238-Q263 PolarHBondContact N-O 3.4Å; S261-Q263 VanDerWaalsContact OG-CB 3.28Å; S261-Q263 WeakPolarHBondContact OG-CB 3.31Å; S261-Q263 WeakPolarHBondContact OG-CG 3.04Å; S261-Q263 PolarHBondContact OG-N 3.07Å; S261-Q263 VanDerWaalsContact OG-N 3.09Å; S261-Q263 PolarHBondContact OG-OE1 2.95Å; Q263-V265 PolarHBondContact O-N 2.93Å
264	V	96.5	Very high	94.5	Very high	9 Å²	9	55.9 Å²	55.9	6%	0.055	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-82.1	103.1	178.3	-173.4	0	0	0	0	109.4	V238 L240 W257 L258 D266 A267 L270	V238-V264 WeakPolarHBondContact O-CA 3.43Å; L240-V264 HydrophobicContact CB-CG1 4.35Å; L240-V264 HydrophobicContact CD1-CG1 3.95Å; L240-V264 HydrophobicContact CD1-CG2 4.01Å; L240-V264 HydrophobicContact CG-CG1 4.33Å; W257-V264 HydrophobicContact CE3-CG2 4.1Å; W257-V264 HydrophobicContact CH2-CG2 3.1Å; W257-V264 HydrophobicContact CZ2-CG2 3.8Å; W257-V264 HydrophobicContact CZ3-CG2 3.27Å; L258-V264 HydrophobicContact CD2-CB 3.93Å; L258-V264 HydrophobicContact CD2-CG1 3.95Å; L258-V264 HydrophobicContact CD2-CG2 3.73Å; V264-D266 VanDerWaalsContact C-N 3.3Å; V264-D266 WeakPolarHBondContact CG1-OD1 3.25Å; V264-D266 PolarHBondContact O-N 3.34Å; V264-A267 HydrophobicContact CB-CB 4.04Å; V264-A267 HydrophobicContact CG1-CB 3.92Å; V264-A267 WeakPolarHBondContact O-CB 3.45Å; V264-A267 PolarHBondContact O-N 3.11Å; V264-L270 HydrophobicContact CG1-CD1 4.28Å
265	V	96.7	Very high	94.4	Very high	84 Å²	84	57.7 Å²	57.7	51%	0.509	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-36	-172.2	-177.4	0	0	0	0	111.3	R237 V238 Q239 Q263	R237-V265 HydrophobicContact CB-CG2 3.87Å; R237-V265 HydrophobicContact CG-CG2 4.27Å; V238-V265 PolarHBondContact O-N 2.8Å; Q239-V265 HydrophobicContact CG-CB 4.49Å; Q263-V265 PolarHBondContact O-N 2.93Å
266	D	96.9	Very high	94.2	Very high	8 Å²	8	63.3 Å²	63.3	4%	0.043	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	24	-176.1	58.7	-3.4	0	0	0	113	Q239 L240 A241 V264 R268 E269	Q239-D266 WeakPolarHBondContact CA-OD1 3.14Å; Q239-D266 WeakPolarHBondContact CA-OD2 3.37Å; L240-D266 VanDerWaalsContact N-CG 3.31Å; L240-D266 PolarHBondContact N-OD1 3.04Å; L240-D266 PolarHBondContact N-OD2 3Å; A241-D266 HydrophobicContact CB-CB 4.3Å; A241-D266 WeakPolarHBondContact CB-OD2 3.45Å; A241-D266 PolarHBondContact N-OD2 2.79Å; V264-D266 VanDerWaalsContact C-N 3.3Å; V264-D266 WeakPolarHBondContact CG1-OD1 3.25Å; V264-D266 PolarHBondContact O-N 3.34Å; D266-R268 PolarHBondContact O-N 3.09Å; D266-E269 HydrophobicContact CB-CB 4.5Å; D266-E269 WeakPolarHBondContact O-CB 3.48Å; D266-E269 PolarHBondContact O-N 2.75Å
267	A	95.9	Very high	94.1	Very high	15 Å²	15	65.3 Å²	65.3	12%	0.124	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-29	-175.8	0	0	0	0	0	114.3	L258 V264 E269 L284	L258-A267 HydrophobicContact CD2-CB 4.18Å; V264-A267 HydrophobicContact CB-CB 4.04Å; V264-A267 HydrophobicContact CG1-CB 3.92Å; V264-A267 WeakPolarHBondContact O-CB 3.45Å; V264-A267 PolarHBondContact O-N 3.11Å; A267-E269 VanDerWaalsContact C-N 3.34Å; A267-L284 HydrophobicContact CB-CD1 4.4Å
268	R	94.4	Very high	94.1	Very high	228 Å²	228	64.3 Å²	64.3	86%	0.86	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-18.7	179.5	-64.8	-177.1	178.5	-177.6	-0.6	113.7	D266 L284	D266-R268 PolarHBondContact O-N 3.09Å; R268-L284 HydrophobicContact CG-CD1 4.33Å
269	E	95.9	Very high	94.1	Very high	137 Å²	137	68.8 Å²	68.8	64%	0.64	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.3	-179.5	-60.1	178.8	-162.8	0	0	111.9	A241 D266 A267 T271	A241-E269 HydrophobicContact CB-CB 4.31Å; D266-E269 HydrophobicContact CB-CB 4.5Å; D266-E269 WeakPolarHBondContact O-CB 3.48Å; D266-E269 PolarHBondContact O-N 2.75Å; A267-E269 VanDerWaalsContact C-N 3.34Å; E269-T271 PolarHBondContact O-N 3.46Å
270	L	97.2	Very high	94.2	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	37%	0.367	C	S	.	.			trans	-73.2	124.7	-178.4	-50	-174.7	0	0	0	110.9	L240 A241 L258 V264 P282 L283	L240-L270 VanDerWaalsContact C-CD2 3.41Å; L240-L270 HydrophobicContact CB-CD1 4.18Å; L240-L270 HydrophobicContact CB-CD2 3.73Å; L240-L270 HydrophobicContact CD1-CD1 4.47Å; A241-L270 HydrophobicContact CB-CD2 4.38Å; L258-L270 HydrophobicContact CD1-CD1 3.85Å; L258-L270 HydrophobicContact CD2-CD1 3.77Å; L258-L270 HydrophobicContact CG-CD1 4.5Å; V264-L270 HydrophobicContact CG1-CD1 4.28Å; L270-P282 CarbonylContact O-C 3.54Å; L270-P282 WeakPolarHBondContact O-CA 3.39Å; L270-L283 HydrophobicContact CB-CB 4.22Å; L270-L283 HydrophobicContact CB-CD1 4.18Å; L270-L283 HydrophobicContact CB-CD2 4.03Å; L270-L283 HydrophobicContact CB-CG 4.37Å; L270-L283 HydrophobicContact CD1-CD2 4.35Å; L270-L283 PolarHBondContact O-N 3.13Å
271	T	97	Very high	94.4	Very high	56 Å²	56	68.5 Å²	68.5	34%	0.344	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-125	150.3	177.7	61.1	0	0	0	0	112.4	E269 R281	E269-T271 PolarHBondContact O-N 3.46Å; T271-R281 CarbonylContact C-O 3.56Å; T271-R281 VanDerWaalsContact CA-O 3.28Å; T271-R281 WeakPolarHBondContact CA-O 3.32Å
272	C	96.8	Very high	94.7	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.7	174.3	-61.6	0	0	0	0	111.3	C247 V278 R279 H280 R281 L283	C247-C272 HydrophobicContact CB-CB 3.72Å; C247-C272 WeakPolarHBondContact CB-SG 3.32Å; C247-C272 VanDerWaalsContact SG-CA 3.51Å; C247-C272 WeakPolarHBondContact SG-CB 3.47Å; C247-C272 CovalentContact SG-SG 2.02Å; C247-C272 PolarHBondContact SG-SG 3.44Å; C272-V278 HydrophobicContact CB-CG2 4.21Å; C272-V278 VanDerWaalsContact CB-O 3.23Å; C272-V278 WeakPolarHBondContact CB-O 3.38Å; C272-R279 CarbonylContact O-C 3.49Å; C272-H280 PolarHBondContact O-N 3.34Å; C272-R281 PolarHBondContact N-O 3.27Å; C272-L283 VanDerWaalsContact N-CD1 3.31Å
273	A	96.8	Very high	94.8	Very high	29 Å²	29	62.6 Å²	62.6	24%	0.24	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-32.3	170.9	0	0	0	0	0	112.4	P244 W245 R279	P244-A273 HydrophobicContact CB-CB 3.77Å; W245-A273 PolarHBondContact O-N 3.03Å; A273-R279 PolarHBondContact O-NE 3.11Å
274	D	91.9	Very high	94.8	Very high	64 Å²	64	64.8 Å²	64.8	34%	0.342	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.6	-175.8	-179.1	-108.9	0	0	0	109.4	W245 R246 C247	W245-D274 PolarHBondContact O-N 2.89Å; R246-D274 CarbonylContact C-O 3.59Å; R246-D274 IonicContact NE-OD1 3.33Å; C247-D274 PolarHBondContact N-O 3.18Å
275	P	92.4	Very high	94.6	Very high	42 Å²	42	70.6 Å²	70.6	27%	0.273	35%	0.354	S	S	.	.	S	Bend	cis	-73.3	164.5	-8	31.1	-35.1	0	0	0	113.4	C247 A277 V278 R279	C247-P275 VanDerWaalsContact O-CD 3.31Å; C247-P275 WeakPolarHBondContact O-CD 3.3Å; P275-A277 PolarHBondContact O-N 3.46Å; P275-V278 HydrophobicContact CG-CG2 3.99Å; P275-V278 WeakPolarHBondContact O-CG2 3.38Å; P275-V278 PolarHBondContact O-N 3.04Å; P275-R279 PolarHBondContact O-N 3.06Å
276	E	89.8	Confident	94.4	Very high	125 Å²	125	66.9 Å²	66.9	58%	0.584	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-47.7	-37.5	-179.8	-71	-69.1	171.3	0	0	113.5	V278 R279	E276-V278 PolarHBondContact O-N 3.45Å; E276-V278 VanDerWaalsContact O-N 3.12Å; E276-R279 VanDerWaalsContact CD-NH2 3.28Å; E276-R279 PolarHBondContact O-N 2.88Å; E276-R279 IonicContact OE1-CZ 2.92Å; E276-R279 IonicContact OE1-NE 3.93Å; E276-R279 IonicContact OE1-NH1 3.43Å; E276-R279 PolarHBondContact OE1-NH1 2.91Å; E276-R279 IonicContact OE1-NH2 3.3Å; E276-R279 PolarHBondContact OE1-NH2 2.8Å; E276-R279 IonicContact OE2-CZ 3.11Å; E276-R279 IonicContact OE2-NE 3.48Å; E276-R279 PolarHBondContact OE2-NE 3.13Å; E276-R279 IonicContact OE2-NH1 2.89Å; E276-R279 PolarHBondContact OE2-NH1 3.03Å; E276-R279 IonicContact OE2-NH2 3.85Å
277	A	90.8	Very high	94	Very high	91 Å²	91	72.7 Å²	72.7	75%	0.752	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-60	-25.3	-178.5	0	0	0	0	0	114.4	P275	P275-A277 PolarHBondContact O-N 3.46Å
278	V	93.1	Very high	93.4	Very high	5 Å²	5	77.9 Å²	77.9	3%	0.03	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-121.4	11.5	-179.7	-64.5	0	0	0	0	112.3	C247 C272 P275 E276 R281 Q290	C247-V278 HydrophobicContact CB-CG2 3.8Å; C272-V278 HydrophobicContact CB-CG2 4.21Å; C272-V278 VanDerWaalsContact CB-O 3.23Å; C272-V278 WeakPolarHBondContact CB-O 3.38Å; P275-V278 HydrophobicContact CG-CG2 3.99Å; P275-V278 WeakPolarHBondContact O-CG2 3.38Å; P275-V278 PolarHBondContact O-N 3.04Å; E276-V278 PolarHBondContact O-N 3.45Å; E276-V278 VanDerWaalsContact O-N 3.12Å; V278-R281 VanDerWaalsContact O-CB 3.26Å; V278-R281 WeakPolarHBondContact O-CB 3.43Å; V278-R281 WeakPolarHBondContact O-CG 3.43Å; V278-R281 PolarHBondContact O-N 2.03Å; V278-R281 VanDerWaalsContact O-N 3.12Å; V278-Q290 HydrophobicContact CG1-CB 4.06Å
279	R	94.4	Very high	93	Very high	102 Å²	102	71.4 Å²	71.4	39%	0.385	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	141.5	-179.7	-175.5	179.9	-83.8	167.9	3.8	111.4	C272 A273 P275 E276 R281	C272-R279 CarbonylContact O-C 3.49Å; A273-R279 PolarHBondContact O-NE 3.11Å; P275-R279 PolarHBondContact O-N 3.06Å; E276-R279 VanDerWaalsContact CD-NH2 3.28Å; E276-R279 PolarHBondContact O-N 2.88Å; E276-R279 IonicContact OE1-CZ 2.92Å; E276-R279 IonicContact OE1-NE 3.93Å; E276-R279 IonicContact OE1-NH1 3.43Å; E276-R279 PolarHBondContact OE1-NH1 2.91Å; E276-R279 IonicContact OE1-NH2 3.3Å; E276-R279 PolarHBondContact OE1-NH2 2.8Å; E276-R279 IonicContact OE2-CZ 3.11Å; E276-R279 IonicContact OE2-NE 3.48Å; E276-R279 PolarHBondContact OE2-NE 3.13Å; E276-R279 IonicContact OE2-NH1 2.89Å; E276-R279 PolarHBondContact OE2-NH1 3.03Å; E276-R279 IonicContact OE2-NH2 3.85Å; R279-R281 PolarHBondContact O-N 3Å; R279-R281 VanDerWaalsContact O-N 3.08Å
280	H	95	Very high	92.5	Very high	142 Å²	142	67.8 Å²	67.8	66%	0.657	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	3.4	-176	-52.8	-57.5	0	0	0	115.4	C272	C272-H280 PolarHBondContact O-N 3.34Å
281	R	94.6	Very high	92	Very high	124 Å²	124	68.4 Å²	68.4	47%	0.468	36%	0.356	S	S	.	.			trans	-73.1	136.5	173	-66.7	-136.9	178.5	-144	0.4	110.6	T271 C272 V278 R279 L283 V286	T271-R281 CarbonylContact C-O 3.56Å; T271-R281 VanDerWaalsContact CA-O 3.28Å; T271-R281 WeakPolarHBondContact CA-O 3.32Å; C272-R281 PolarHBondContact N-O 3.27Å; V278-R281 VanDerWaalsContact O-CB 3.26Å; V278-R281 WeakPolarHBondContact O-CB 3.43Å; V278-R281 WeakPolarHBondContact O-CG 3.43Å; V278-R281 PolarHBondContact O-N 2.03Å; V278-R281 VanDerWaalsContact O-N 3.12Å; R279-R281 PolarHBondContact O-N 3Å; R279-R281 VanDerWaalsContact O-N 3.08Å; R281-L283 PolarHBondContact O-N 3.49Å; R281-V286 HydrophobicContact CB-CG2 4.39Å
282	P	95.8	Very high	91.5	Very high	38 Å²	38	73.5 Å²	73.5	25%	0.247	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-61.2	132.9	173.9	-22.8	33.7	0	0	0	111.3	L270 L284 Q285 V286	L270-P282 CarbonylContact O-C 3.54Å; L270-P282 WeakPolarHBondContact O-CA 3.39Å; P282-L284 VanDerWaalsContact C-N 3.28Å; P282-L284 PolarHBondContact O-N 3.47Å; P282-Q285 HydrophobicContact CB-CB 4.38Å; P282-Q285 HydrophobicContact CB-CG 4.12Å; P282-Q285 HydrophobicContact CG-CG 4.45Å; P282-Q285 PolarHBondContact O-N 2.81Å; P282-V286 PolarHBondContact O-N 3.38Å
283	L	95.1	Very high	90.8	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-54.1	-45.2	-176.2	-97.6	65.1	0	0	0	111.7	W245 I251 L254 L255 L258 L270 C272 R281 Q285 V286	W245-L283 HydrophobicContact CB-CD1 3.96Å; W245-L283 HydrophobicContact CB-CD2 4.12Å; W245-L283 HydrophobicContact CD2-CD2 4.29Å; W245-L283 HydrophobicContact CG-CD1 4.21Å; W245-L283 HydrophobicContact CG-CD2 3.87Å; I251-L283 HydrophobicContact CD1-CD2 4.09Å; I251-L283 HydrophobicContact CD1-CG 4.22Å; L254-L283 HydrophobicContact CD2-CD2 4.05Å; L255-L283 HydrophobicContact CD2-CB 3.91Å; L255-L283 HydrophobicContact CD2-CG 4.2Å; L255-L283 WeakPolarHBondContact CD2-O 3.27Å; L258-L283 HydrophobicContact CD1-CB 4.25Å; L258-L283 HydrophobicContact CD1-CD2 3.79Å; L270-L283 HydrophobicContact CB-CB 4.22Å; L270-L283 HydrophobicContact CB-CD1 4.18Å; L270-L283 HydrophobicContact CB-CD2 4.03Å; L270-L283 HydrophobicContact CB-CG 4.37Å; L270-L283 HydrophobicContact CD1-CD2 4.35Å; L270-L283 PolarHBondContact O-N 3.13Å; C272-L283 VanDerWaalsContact N-CD1 3.31Å; R281-L283 PolarHBondContact O-N 3.49Å; L283-Q285 PolarHBondContact O-N 3.44Å; L283-Q285 VanDerWaalsContact O-N 3.09Å; L283-V286 PolarHBondContact O-N 3.25Å; L283-V286 VanDerWaalsContact O-N 3.14Å
284	L	93.8	Very high	89.3	Confident	59 Å²	59	79 Å²	79	31%	0.309	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-62.4	-18.7	-179.4	-67.4	176.2	0	0	0	114.2	L258 K259 A267 R268 P282	L258-L284 HydrophobicContact CB-CD2 3.85Å; K259-L284 HydrophobicContact CG-CD2 4.06Å; A267-L284 HydrophobicContact CB-CD1 4.4Å; R268-L284 HydrophobicContact CG-CD1 4.33Å; P282-L284 VanDerWaalsContact C-N 3.28Å; P282-L284 PolarHBondContact O-N 3.47Å
285	Q	92.9	Very high	87.6	Confident	132 Å²	132	80.6 Å²	80.6	62%	0.617	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-98.4	-6.6	-179	-63.1	-179.1	7.9	0	0	113.5	P282 L283	P282-Q285 HydrophobicContact CB-CB 4.38Å; P282-Q285 HydrophobicContact CB-CG 4.12Å; P282-Q285 HydrophobicContact CG-CG 4.45Å; P282-Q285 PolarHBondContact O-N 2.81Å; L283-Q285 PolarHBondContact O-N 3.44Å; L283-Q285 VanDerWaalsContact O-N 3.09Å
286	V	91.9	Very high	85.5	Confident	6 Å²	6	84.4 Å²	84.4	4%	0.036	44%	0.443	C	S	.	.			trans	-72.4	132.3	-179.6	-176.6	0	0	0	0	110.3	R281 P282 L283 Q290 L291	R281-V286 HydrophobicContact CB-CG2 4.39Å; P282-V286 PolarHBondContact O-N 3.38Å; L283-V286 PolarHBondContact O-N 3.25Å; L283-V286 VanDerWaalsContact O-N 3.14Å; V286-Q290 HydrophobicContact CG1-CB 4.41Å; V286-L291 HydrophobicContact CG1-CD2 3.55Å; V286-L291 HydrophobicContact CG1-CG 4.1Å
287	Q	87.7	Confident	83.6	Confident	129 Å²	129	85 Å²	85	60%	0.603	45%	0.448	S	S	*	.			trans	-95.9	151.3	177.1	-62.3	-174.4	14	0	0	111.5	S289 Q290	Q287-S289 PolarHBondContact O-N 2.85Å; Q287-Q290 HydrophobicContact CB-CG 4.45Å; Q287-Q290 VanDerWaalsContact N-OE1 3.12Å; Q287-Q290 WeakPolarHBondContact O-CB 3.42Å; Q287-Q290 PolarHBondContact O-N 3.19Å
288	Q	84.7	Confident	81.8	Confident	124 Å²	124	87.8 Å²	87.8	58%	0.579	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-57.4	-34	-179.7	-160.9	70.1	17.8	0	0	113	Q290 L291	Q288-Q290 PolarHBondContact O-N 3.48Å; Q288-L291 WeakPolarHBondContact O-CB 3.33Å; Q288-L291 PolarHBondContact O-N 2.88Å; Q288-L291 VanDerWaalsContact O-N 3.12Å
289	S	84.7	Confident	79.9	Confident	92 Å²	92	89 Å²	89	64%	0.643	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.3	177.8	55.3	0	0	0	0	113.9	Q287	Q287-S289 PolarHBondContact O-N 2.85Å
290	Q	85.5	Confident	78.1	Confident	62 Å²	62	88.3 Å²	88.3	29%	0.29	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-89	-17.3	178.4	-58.4	175.5	-50.7	0	0	112	V278 V286 Q287 Q288 K292	V278-Q290 HydrophobicContact CG1-CB 4.06Å; V286-Q290 HydrophobicContact CG1-CB 4.41Å; Q287-Q290 HydrophobicContact CB-CG 4.45Å; Q287-Q290 VanDerWaalsContact N-OE1 3.12Å; Q287-Q290 WeakPolarHBondContact O-CB 3.42Å; Q287-Q290 PolarHBondContact O-N 3.19Å; Q288-Q290 PolarHBondContact O-N 3.48Å; Q290-K292 PolarHBondContact O-N 3.25Å; Q290-K292 VanDerWaalsContact O-N 3.16Å
291	L	88.3	Confident	76.3	Confident	14 Å²	14	85.6 Å²	85.6	7%	0.073	46%	0.456	C	S	.	.			trans	-82.7	90.6	-179.9	-59.4	179.6	0	0	0	109.8	C247 I251 L255 V286 Q288	C247-L291 HydrophobicContact CB-CD2 4.33Å; C247-L291 WeakPolarHBondContact O-CD2 3.34Å; I251-L291 HydrophobicContact CG2-CD1 3.89Å; I251-L291 HydrophobicContact CG2-CD2 3.67Å; I251-L291 HydrophobicContact CG2-CG 4.44Å; L255-L291 HydrophobicContact CD1-CD1 3.92Å; V286-L291 HydrophobicContact CG1-CD2 3.55Å; V286-L291 HydrophobicContact CG1-CG 4.1Å; Q288-L291 WeakPolarHBondContact O-CB 3.33Å; Q288-L291 PolarHBondContact O-N 2.88Å; Q288-L291 VanDerWaalsContact O-N 3.12Å
292	K	86.1	Confident	74.7	Confident	164 Å²	164	86.1 Å²	86.1	71%	0.713	46%	0.463	S	S	*	.			trans	-89.2	139	176.6	-62.5	-174.8	-179.9	-176.8	0	110.7	N248 Q290	N248-K292 WeakPolarHBondContact CB-O 3.34Å; Q290-K292 PolarHBondContact O-N 3.25Å; Q290-K292 VanDerWaalsContact O-N 3.16Å
293	C	81.2	Confident	73.2	Confident	58 Å²	58	88.9 Å²	88.9	39%	0.392	48%	0.48	S	S	.	.			trans	-120	98.2	160.4	-87.3	0	0	0	0	107.4	C249 S295	C249-C293 VanDerWaalsContact CA-SG 3.54Å; C249-C293 HydrophobicContact CB-CB 3.66Å; C249-C293 WeakPolarHBondContact CB-SG 3.4Å; C249-C293 PolarHBondContact N-SG 2.95Å; C249-C293 WeakPolarHBondContact SG-CB 3.31Å; C249-C293 CovalentContact SG-SG 1.98Å; C249-C293 PolarHBondContact SG-SG 3.26Å; C293-S295 PolarHBondContact O-N 3.49Å
294	S	65.8	Low	72.2	Confident	87 Å²	87	92.4 Å²	92.4	61%	0.608	50%	0.504	S	S	*	.			trans	-75.4	122.3	162.9	-155.8	0	0	0	0	106.3	D296	S294-D296 PolarHBondContact O-N 2.93Å; S294-D296 VanDerWaalsContact O-N 3.07Å
295	S	56.3	Low	71.6	Confident	97 Å²	97	96.7 Å²	96.7	68%	0.678	52%	0.517	S	S	*	.			trans	-61.2	109.5	157.5	52.1	0	0	0	0	105.5	C293 M297	C293-S295 PolarHBondContact O-N 3.49Å; S295-M297 PolarHBondContact O-N 3.45Å
296	D	48.8	Very low	71.2	Confident	121 Å²	121	95 Å²	95	65%	0.647	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	52.8	-171	-143.7	5.2	0	0	0	112.1	S294 V300	S294-D296 PolarHBondContact O-N 2.93Å; S294-D296 VanDerWaalsContact O-N 3.07Å; D296-V300 WeakPolarHBondContact O-CG2 3.18Å
297	M	49.9	Very low	70.8	Confident	139 Å²	139	101.7 Å²	101.7	69%	0.685	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-16.1	169.7	-80.7	-63.9	-145.2	0	0	111.9	S295	S295-M297 PolarHBondContact O-N 3.45Å
298	E	52.4	Low	70.9	Confident	149 Å²	149	99.8 Å²	99.8	70%	0.696	54%	0.538	S	S	*	.	H	α-helix	trans	-83.9	-38.5	-174.5	-145.2	138.9	-157	0	0	111.7	E302	E298-E302 WeakPolarHBondContact O-CG 3.43Å; E298-E302 PolarHBondContact O-N 3.17Å
299	G	53.8	Low	71.2	Confident	29 Å²	29	95.7 Å²	95.7	30%	0.299	53%	0.529	S	S	.	.	H	α-helix	trans	-76.5	-32	176.8	0	0	0	0	0	115	T303	G299-T303 WeakPolarHBondContact O-CG2 3.3Å; G299-T303 PolarHBondContact O-N 3.09Å; G299-T303 VanDerWaalsContact O-N 3.16Å; G299-T303 PolarHBondContact O-OG1 3.45Å
300	V	56.2	Low	71.6	Confident	89 Å²	89	96.9 Å²	96.9	54%	0.539	53%	0.528	S	S	.	.	H	α-helix	trans	-73.3	-35.3	-179.2	-178.3	0	0	0	0	111.6	D296 T303 S304	D296-V300 WeakPolarHBondContact O-CG2 3.18Å; V300-T303 PolarHBondContact O-OG1 2.86Å; V300-S304 WeakPolarHBondContact O-CB 3.42Å; V300-S304 PolarHBondContact O-N 3.33Å
301	L	57.3	Low	72.1	Confident	85 Å²	85	96.8 Å²	96.8	45%	0.445	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-46.8	172.9	-104	72.3	0	0	0	111.4	T303 S304 Y305	L301-T303 PolarHBondContact O-N 3.24Å; L301-S304 WeakPolarHBondContact O-CB 3.46Å; L301-S304 PolarHBondContact O-N 3.46Å; L301-S304 VanDerWaalsContact O-N 3.16Å; L301-Y305 HydrophobicContact CB-CD2 4.27Å; L301-Y305 HydrophobicContact CB-CE2 3.91Å; L301-Y305 HydrophobicContact CD2-CE2 3.9Å; L301-Y305 HydrophobicContact CG-CE2 3.85Å; L301-Y305 WeakPolarHBondContact O-CD2 3.28Å; L301-Y305 PolarHBondContact O-N 3.05Å
302	E	59.7	Low	72.4	Confident	134 Å²	134	101 Å²	101	63%	0.626	55%	0.554	S	S	*	*	H	α-helix	trans	-59.3	-46	-179	-76.8	-171.9	162.6	0	0	112.3	E298 S304 Y305 V306	E298-E302 WeakPolarHBondContact O-CG 3.43Å; E298-E302 PolarHBondContact O-N 3.17Å; E302-S304 VanDerWaalsContact C-N 3.32Å; E302-S304 PolarHBondContact O-N 2.83Å; E302-Y305 PolarHBondContact O-N 3.35Å; E302-V306 WeakPolarHBondContact O-CG2 3.35Å; E302-V306 PolarHBondContact O-N 3.43Å; E302-V306 VanDerWaalsContact O-N 3.08Å
303	T	65.4	Low	72.8	Confident	97 Å²	97	96 Å²	96	60%	0.595	54%	0.542	S	S	*	.	H	α-helix	trans	-64.9	-34.4	177	49.4	0	0	0	0	112.9	G299 V300 L301 F307	G299-T303 WeakPolarHBondContact O-CG2 3.3Å; G299-T303 PolarHBondContact O-N 3.09Å; G299-T303 VanDerWaalsContact O-N 3.16Å; G299-T303 PolarHBondContact O-OG1 3.45Å; V300-T303 PolarHBondContact O-OG1 2.86Å; L301-T303 PolarHBondContact O-N 3.24Å; T303-F307 PolarHBondContact O-N 2.89Å
304	S	72.9	Confident	73.6	Confident	73 Å²	73	98.5 Å²	98.5	51%	0.51	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-43.4	174.5	-174.6	0	0	0	0	112.6	V300 L301 E302 F307 L308	V300-S304 WeakPolarHBondContact O-CB 3.42Å; V300-S304 PolarHBondContact O-N 3.33Å; L301-S304 WeakPolarHBondContact O-CB 3.46Å; L301-S304 PolarHBondContact O-N 3.46Å; L301-S304 VanDerWaalsContact O-N 3.16Å; E302-S304 VanDerWaalsContact C-N 3.32Å; E302-S304 PolarHBondContact O-N 2.83Å; S304-F307 PolarHBondContact O-N 2.86Å; S304-L308 WeakPolarHBondContact O-CB 3.19Å; S304-L308 PolarHBondContact O-N 3.07Å
305	Y	82.8	Confident	75	Confident	149 Å²	149	98.9 Å²	98.9	58%	0.584	55%	0.546	S	S	*	.	H	α-helix	trans	-69.8	-36.3	179.8	-70.9	-61.5	0	0	0	113.1	L301 E302 L308 G309	L301-Y305 HydrophobicContact CB-CD2 4.27Å; L301-Y305 HydrophobicContact CB-CE2 3.91Å; L301-Y305 HydrophobicContact CD2-CE2 3.9Å; L301-Y305 HydrophobicContact CG-CE2 3.85Å; L301-Y305 WeakPolarHBondContact O-CD2 3.28Å; L301-Y305 PolarHBondContact O-N 3.05Å; E302-Y305 PolarHBondContact O-N 3.35Å; Y305-L308 PolarHBondContact O-N 3.01Å; Y305-G309 PolarHBondContact O-N 2.78Å
306	V	84.3	Confident	76.9	Confident	97 Å²	97	95.8 Å²	95.8	59%	0.588	53%	0.529	S	S	*	.	H	α-helix	trans	-63.6	-44.6	174.4	173	0	0	0	0	110.5	E302 G309 L310	E302-V306 WeakPolarHBondContact O-CG2 3.35Å; E302-V306 PolarHBondContact O-N 3.43Å; E302-V306 VanDerWaalsContact O-N 3.08Å; V306-G309 PolarHBondContact O-N 3.05Å; V306-L310 HydrophobicContact CG1-CD1 4.41Å; V306-L310 WeakPolarHBondContact O-CG 3.28Å; V306-L310 PolarHBondContact O-N 3.43Å
307	F	83.9	Confident	79.2	Confident	146 Å²	146	94.8 Å²	94.8	64%	0.64	53%	0.527	S	S	*	.	H	α-helix	trans	-62.1	-44.6	176.1	-172.2	-96.6	0	0	0	111.8	T303 S304 G309 L310 V311	T303-F307 PolarHBondContact O-N 2.89Å; S304-F307 PolarHBondContact O-N 2.86Å; F307-G309 VanDerWaalsContact C-N 3.33Å; F307-G309 PolarHBondContact O-N 3.21Å; F307-L310 PolarHBondContact O-N 2.87Å; F307-V311 HydrophobicContact CD1-CG2 4.16Å; F307-V311 HydrophobicContact CE1-CG2 3.86Å; F307-V311 HydrophobicContact CZ-CG2 4.23Å; F307-V311 WeakPolarHBondContact O-CG2 3.4Å; F307-V311 PolarHBondContact O-N 3.23Å
308	L	88.3	Confident	81.4	Confident	89 Å²	89	92.4 Å²	92.4	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-42.9	174.8	-176.3	66.5	0	0	0	111.9	S304 Y305 V311 L312	S304-L308 WeakPolarHBondContact O-CB 3.19Å; S304-L308 PolarHBondContact O-N 3.07Å; Y305-L308 PolarHBondContact O-N 3.01Å; L308-V311 PolarHBondContact O-N 3.22Å; L308-L312 HydrophobicContact CD1-CD1 4.48Å; L308-L312 HydrophobicContact CG-CD1 4.12Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 WeakPolarHBondContact O-CG 3.41Å; L308-L312 PolarHBondContact O-N 3.03Å
309	G	90.5	Very high	83.5	Confident	38 Å²	38	91.3 Å²	91.3	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-42.9	177.2	0	0	0	0	0	113	Y305 V306 F307 L312 A313	Y305-G309 PolarHBondContact O-N 2.78Å; V306-G309 PolarHBondContact O-N 3.05Å; F307-G309 VanDerWaalsContact C-N 3.33Å; F307-G309 PolarHBondContact O-N 3.21Å; G309-L312 PolarHBondContact O-N 3.18Å; G309-A313 WeakPolarHBondContact O-CB 3.47Å; G309-A313 PolarHBondContact O-N 2.79Å
310	L	93.9	Very high	85.4	Confident	118 Å²	118	95.4 Å²	95.4	62%	0.618	52%	0.524	S	S	*	.	H	α-helix	trans	-64.6	-42.2	176	-69.9	174.7	0	0	0	112	V306 F307 A313 L314	V306-L310 HydrophobicContact CG1-CD1 4.41Å; V306-L310 WeakPolarHBondContact O-CG 3.28Å; V306-L310 PolarHBondContact O-N 3.43Å; F307-L310 PolarHBondContact O-N 2.87Å; L310-A313 PolarHBondContact O-N 3.29Å; L310-L314 WeakPolarHBondContact O-CB 3.42Å; L310-L314 PolarHBondContact O-N 3.36Å
311	V	95.3	Very high	87.2	Confident	59 Å²	59	95.7 Å²	95.7	36%	0.358	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-45.7	177.2	172.3	0	0	0	0	111	F307 L308 A313 L314 I315	F307-V311 HydrophobicContact CD1-CG2 4.16Å; F307-V311 HydrophobicContact CE1-CG2 3.86Å; F307-V311 HydrophobicContact CZ-CG2 4.23Å; F307-V311 WeakPolarHBondContact O-CG2 3.4Å; F307-V311 PolarHBondContact O-N 3.23Å; L308-V311 PolarHBondContact O-N 3.22Å; V311-A313 PolarHBondContact O-N 3.38Å; V311-L314 PolarHBondContact O-N 3.2Å; V311-I315 HydrophobicContact CG1-CD1 3.89Å; V311-I315 VanDerWaalsContact O-CG1 3.31Å; V311-I315 WeakPolarHBondContact O-CG1 3.39Å; V311-I315 PolarHBondContact O-N 3.2Å
312	L	95.4	Very high	89	Confident	104 Å²	104	95 Å²	95	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-39.8	177.9	-71.8	173.9	0	0	0	112.2	L308 G309 I315 G316	L308-L312 HydrophobicContact CD1-CD1 4.48Å; L308-L312 HydrophobicContact CG-CD1 4.12Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 WeakPolarHBondContact O-CG 3.41Å; L308-L312 PolarHBondContact O-N 3.03Å; G309-L312 PolarHBondContact O-N 3.18Å; L312-I315 PolarHBondContact O-N 2.76Å; L312-G316 PolarHBondContact O-N 2.83Å
313	A	95.6	Very high	90.5	Very high	58 Å²	58	92 Å²	92	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-43.7	174.7	0	0	0	0	0	111.6	G309 L310 V311 G316 V317	G309-A313 WeakPolarHBondContact O-CB 3.47Å; G309-A313 PolarHBondContact O-N 2.79Å; L310-A313 PolarHBondContact O-N 3.29Å; V311-A313 PolarHBondContact O-N 3.38Å; A313-G316 PolarHBondContact O-N 3.14Å; A313-V317 WeakPolarHBondContact O-CG2 3.45Å; A313-V317 PolarHBondContact O-N 2.86Å
314	L	96.4	Very high	91.8	Very high	111 Å²	111	94 Å²	94	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-62.6	-45	177.5	-165.6	105	0	0	0	111.7	L310 V311 G316 V317 I318	L310-L314 WeakPolarHBondContact O-CB 3.42Å; L310-L314 PolarHBondContact O-N 3.36Å; V311-L314 PolarHBondContact O-N 3.2Å; L314-G316 VanDerWaalsContact C-N 3.3Å; L314-G316 PolarHBondContact O-N 3.31Å; L314-V317 PolarHBondContact O-N 3.01Å; L314-I318 HydrophobicContact CD2-CD1 3.85Å; L314-I318 HydrophobicContact CG-CD1 4.15Å; L314-I318 VanDerWaalsContact O-CG1 3.31Å; L314-I318 WeakPolarHBondContact O-CG1 3.31Å; L314-I318 PolarHBondContact O-N 2.75Å
315	I	96.3	Very high	92.8	Very high	95 Å²	95	96.3 Å²	96.3	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-58.9	-44.3	175	-68.2	166.8	0	0	0	110.2	V311 L312 V317 I318 F319	V311-I315 HydrophobicContact CG1-CD1 3.89Å; V311-I315 VanDerWaalsContact O-CG1 3.31Å; V311-I315 WeakPolarHBondContact O-CG1 3.39Å; V311-I315 PolarHBondContact O-N 3.2Å; L312-I315 PolarHBondContact O-N 2.76Å; I315-V317 PolarHBondContact O-N 3.21Å; I315-I318 PolarHBondContact O-N 2.96Å; I315-F319 WeakPolarHBondContact O-CB 3.32Å; I315-F319 PolarHBondContact O-N 3.4Å
316	G	96.4	Very high	93.2	Very high	32 Å²	32	93.3 Å²	93.3	33%	0.33	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-44.5	176.6	0	0	0	0	0	113	L312 A313 L314 F319 L320	L312-G316 PolarHBondContact O-N 2.83Å; A313-G316 PolarHBondContact O-N 3.14Å; L314-G316 VanDerWaalsContact C-N 3.3Å; L314-G316 PolarHBondContact O-N 3.31Å; G316-F319 PolarHBondContact O-N 3.23Å; G316-L320 WeakPolarHBondContact O-CB 3.33Å; G316-L320 WeakPolarHBondContact O-CG 3.2Å; G316-L320 PolarHBondContact O-N 3.5Å
317	V	96.7	Very high	93.5	Very high	99 Å²	99	94.3 Å²	94.3	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-63.7	-45	177	171.8	0	0	0	0	111.3	A313 L314 I315 F319 L320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.45Å; A313-V317 PolarHBondContact O-N 2.86Å; L314-V317 PolarHBondContact O-N 3.01Å; I315-V317 PolarHBondContact O-N 3.21Å; V317-F319 VanDerWaalsContact C-N 3.35Å; V317-F319 PolarHBondContact O-N 2.87Å; V317-L320 PolarHBondContact O-N 2.94Å; V317-L321 WeakPolarHBondContact O-CB 3.3Å; V317-L321 PolarHBondContact O-N 2.84Å
318	I	95.6	Very high	93.6	Very high	89 Å²	89	95.2 Å²	95.2	46%	0.456	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-45.1	177.4	-67.9	167	0	0	0	110.3	L314 I315 L320 L321 V322	L314-I318 HydrophobicContact CD2-CD1 3.85Å; L314-I318 HydrophobicContact CG-CD1 4.15Å; L314-I318 VanDerWaalsContact O-CG1 3.31Å; L314-I318 WeakPolarHBondContact O-CG1 3.31Å; L314-I318 PolarHBondContact O-N 2.75Å; I315-I318 PolarHBondContact O-N 2.96Å; I318-L320 PolarHBondContact O-N 3.11Å; I318-L321 WeakPolarHBondContact O-CB 3.48Å; I318-L321 PolarHBondContact O-N 2.96Å; I318-V322 HydrophobicContact CG2-CG2 4.43Å; I318-V322 WeakPolarHBondContact O-CG2 3.47Å; I318-V322 PolarHBondContact O-N 3.16Å
319	F	95.9	Very high	93.6	Very high	127 Å²	127	93.1 Å²	93.1	56%	0.557	50%	0.503	S	S	*	.	H	α-helix	trans	-60.9	-46.7	178.2	-178.8	-103.8	0	0	0	111.9	I315 G316 V317 L321 V322 L323	I315-F319 WeakPolarHBondContact O-CB 3.32Å; I315-F319 PolarHBondContact O-N 3.4Å; G316-F319 PolarHBondContact O-N 3.23Å; V317-F319 VanDerWaalsContact C-N 3.35Å; V317-F319 PolarHBondContact O-N 2.87Å; F319-L321 VanDerWaalsContact C-N 3.31Å; F319-L321 PolarHBondContact O-N 3.11Å; F319-V322 PolarHBondContact O-N 3.43Å; F319-L323 HydrophobicContact CD1-CD1 3.89Å; F319-L323 HydrophobicContact CD1-CG 4.42Å; F319-L323 HydrophobicContact CE1-CD1 3.37Å; F319-L323 HydrophobicContact CE1-CG 4.08Å; F319-L323 HydrophobicContact CZ-CD1 3.8Å; F319-L323 HydrophobicContact CZ-CD2 4.34Å; F319-L323 HydrophobicContact CZ-CG 4.16Å; F319-L323 WeakPolarHBondContact O-CG 3.43Å; F319-L323 PolarHBondContact O-N 2.97Å
320	L	94.6	Very high	93.5	Very high	115 Å²	115	94.5 Å²	94.5	60%	0.602	50%	0.501	S	S	*	.	H	α-helix	trans	-61.6	-39.2	175.4	-73.8	174.7	0	0	0	112.1	G316 V317 I318 L323 Y324	G316-L320 WeakPolarHBondContact O-CB 3.33Å; G316-L320 WeakPolarHBondContact O-CG 3.2Å; G316-L320 PolarHBondContact O-N 3.5Å; V317-L320 PolarHBondContact O-N 2.94Å; I318-L320 PolarHBondContact O-N 3.11Å; L320-L323 PolarHBondContact O-N 3.46Å; L320-Y324 VanDerWaalsContact O-CB 3.26Å; L320-Y324 WeakPolarHBondContact O-CB 3.42Å; L320-Y324 PolarHBondContact O-N 3.13Å
321	L	94.7	Very high	93.1	Very high	94 Å²	94	94.8 Å²	94.8	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-44.8	175.5	-176.8	69.3	0	0	0	111.4	V317 I318 F319 L323 Y324 L325	V317-L321 WeakPolarHBondContact O-CB 3.3Å; V317-L321 PolarHBondContact O-N 2.84Å; I318-L321 WeakPolarHBondContact O-CB 3.48Å; I318-L321 PolarHBondContact O-N 2.96Å; F319-L321 VanDerWaalsContact C-N 3.31Å; F319-L321 PolarHBondContact O-N 3.11Å; L321-L323 PolarHBondContact O-N 3.21Å; L321-Y324 WeakPolarHBondContact O-CB 3.4Å; L321-Y324 PolarHBondContact O-N 2.96Å; L321-L325 HydrophobicContact CD1-CD1 4.46Å; L321-L325 HydrophobicContact CD1-CG 4.41Å; L321-L325 HydrophobicContact CG-CD1 4.11Å; L321-L325 HydrophobicContact CG-CG 4.42Å; L321-L325 WeakPolarHBondContact O-CB 3.31Å; L321-L325 VanDerWaalsContact O-CG 3.32Å; L321-L325 WeakPolarHBondContact O-CG 3.25Å; L321-L325 PolarHBondContact O-N 2.63Å
322	V	94.4	Very high	92.7	Very high	72 Å²	72	100.8 Å²	100.8	44%	0.436	51%	0.513	S	S	.	.	H	α-helix	trans	-60.6	-45.3	176.5	170.3	0	0	0	0	110.8	I318 F319 Y324 N326	I318-V322 HydrophobicContact CG2-CG2 4.43Å; I318-V322 WeakPolarHBondContact O-CG2 3.47Å; I318-V322 PolarHBondContact O-N 3.16Å; F319-V322 PolarHBondContact O-N 3.43Å; V322-Y324 VanDerWaalsContact C-N 3.33Å; V322-Y324 PolarHBondContact O-N 3.46Å; V322-N326 WeakPolarHBondContact O-CB 3.21Å; V322-N326 PolarHBondContact O-N 3.42Å; V322-N326 PolarHBondContact O-ND2 3.27Å
323	L	91.4	Very high	92.3	Very high	70 Å²	70	103.6 Å²	103.6	37%	0.366	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-41.1	174.8	-71	-178.9	0	0	0	111.9	F319 L320 L321 N326 R327 I330	F319-L323 HydrophobicContact CD1-CD1 3.89Å; F319-L323 HydrophobicContact CD1-CG 4.42Å; F319-L323 HydrophobicContact CE1-CD1 3.37Å; F319-L323 HydrophobicContact CE1-CG 4.08Å; F319-L323 HydrophobicContact CZ-CD1 3.8Å; F319-L323 HydrophobicContact CZ-CD2 4.34Å; F319-L323 HydrophobicContact CZ-CG 4.16Å; F319-L323 WeakPolarHBondContact O-CG 3.43Å; F319-L323 PolarHBondContact O-N 2.97Å; L320-L323 PolarHBondContact O-N 3.46Å; L321-L323 PolarHBondContact O-N 3.21Å; L323-N326 CarbonylContact O-C 3.12Å; L323-N326 PolarHBondContact O-N 3.39Å; L323-R327 WeakPolarHBondContact O-CA 2.95Å; L323-R327 PolarHBondContact O-N 3.34Å; L323-I330 HydrophobicContact CD2-CD1 3.76Å
324	Y	93	Very high	91.9	Very high	139 Å²	139	105.9 Å²	105.9	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-47.4	179.2	178	-96.1	0	0	0	112.2	L320 L321 V322 N326 R327	L320-Y324 VanDerWaalsContact O-CB 3.26Å; L320-Y324 WeakPolarHBondContact O-CB 3.42Å; L320-Y324 PolarHBondContact O-N 3.13Å; L321-Y324 WeakPolarHBondContact O-CB 3.4Å; L321-Y324 PolarHBondContact O-N 2.96Å; V322-Y324 VanDerWaalsContact C-N 3.33Å; V322-Y324 PolarHBondContact O-N 3.46Å; Y324-N326 VanDerWaalsContact C-N 3.3Å; Y324-N326 PolarHBondContact O-N 3.39Å; Y324-R327 VanDerWaalsContact O-CB 3.32Å; Y324-R327 WeakPolarHBondContact O-CB 3.41Å; Y324-R327 WeakPolarHBondContact O-CD 3.48Å; Y324-R327 VanDerWaalsContact O-CG 3.26Å; Y324-R327 WeakPolarHBondContact O-CG 3.07Å; Y324-R327 PolarHBondContact O-N 3.06Å; Y324-R327 PolarHBondContact OH-NH1 3.27Å
325	L	92.4	Very high	91.4	Very high	121 Å²	121	105.7 Å²	105.7	63%	0.634	51%	0.511	S	S	*	.	H	α-helix	trans	-63.1	-39	177.7	-70	175.4	0	0	0	111.1	L321	L321-L325 HydrophobicContact CD1-CD1 4.46Å; L321-L325 HydrophobicContact CD1-CG 4.41Å; L321-L325 HydrophobicContact CG-CD1 4.11Å; L321-L325 HydrophobicContact CG-CG 4.42Å; L321-L325 WeakPolarHBondContact O-CB 3.31Å; L321-L325 VanDerWaalsContact O-CG 3.32Å; L321-L325 WeakPolarHBondContact O-CG 3.25Å; L321-L325 PolarHBondContact O-N 2.63Å
326	N	91.2	Very high	91	Very high	86 Å²	86	105.9 Å²	105.9	46%	0.46	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	5.2	179.7	-68.7	-67.5	0	0	0	114.1	V322 L323 Y324 K328 G329 I330	V322-N326 WeakPolarHBondContact O-CB 3.21Å; V322-N326 PolarHBondContact O-N 3.42Å; V322-N326 PolarHBondContact O-ND2 3.27Å; L323-N326 CarbonylContact O-C 3.12Å; L323-N326 PolarHBondContact O-N 3.39Å; Y324-N326 VanDerWaalsContact C-N 3.3Å; Y324-N326 PolarHBondContact O-N 3.39Å; N326-K328 PolarHBondContact O-N 3.16Å; N326-G329 WeakPolarHBondContact O-CA 3.47Å; N326-G329 PolarHBondContact O-N 3.14Å; N326-I330 HydrophobicContact CB-CD1 3.9Å; N326-I330 HydrophobicContact CB-CG1 4.14Å; N326-I330 WeakPolarHBondContact O-CG1 3.46Å; N326-I330 PolarHBondContact O-N 3.45Å
327	R	91.8	Very high	90.7	Very high	119 Å²	119	107.7 Å²	107.7	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-54.4	-35.9	-171.5	76.5	-174.3	-167.2	-151.2	2	114.2	L323 Y324 K331	L323-R327 WeakPolarHBondContact O-CA 2.95Å; L323-R327 PolarHBondContact O-N 3.34Å; Y324-R327 VanDerWaalsContact O-CB 3.32Å; Y324-R327 WeakPolarHBondContact O-CB 3.41Å; Y324-R327 WeakPolarHBondContact O-CD 3.48Å; Y324-R327 VanDerWaalsContact O-CG 3.26Å; Y324-R327 WeakPolarHBondContact O-CG 3.07Å; Y324-R327 PolarHBondContact O-N 3.06Å; Y324-R327 PolarHBondContact OH-NH1 3.27Å; R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 VanDerWaalsContact O-CG 3.3Å; R327-K331 WeakPolarHBondContact O-CG 3.39Å; R327-K331 PolarHBondContact O-N 3.05Å
328	K	85.6	Confident	90.4	Very high	165 Å²	165	109.9 Å²	109.9	72%	0.717	51%	0.512	S	S	*	.	H	α-helix	trans	-73.7	-41.1	178.7	-71.3	-173.4	179.2	-179.4	0	111.4	N326 R332	N326-K328 PolarHBondContact O-N 3.16Å; K328-R332 WeakPolarHBondContact O-CB 2.97Å; K328-R332 PolarHBondContact O-N 3.46Å
329	G	87.9	Confident	90	Very high	45 Å²	45	108.8 Å²	108.8	46%	0.464	51%	0.507	S	S	.	.	H	α-helix	trans	-65	-45.6	175.6	0	0	0	0	0	111.8	N326 R332 W333	N326-G329 WeakPolarHBondContact O-CA 3.47Å; N326-G329 PolarHBondContact O-N 3.14Å; G329-R332 PolarHBondContact O-N 3.37Å; G329-W333 WeakPolarHBondContact O-CB 3.42Å; G329-W333 PolarHBondContact O-N 2.96Å
330	I	88.3	Confident	89.6	Confident	66 Å²	66	105.5 Å²	105.5	34%	0.338	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-45.7	176.3	-65	166.1	0	0	0	110.7	L323 N326 R332 W333 M334	L323-I330 HydrophobicContact CD2-CD1 3.76Å; N326-I330 HydrophobicContact CB-CD1 3.9Å; N326-I330 HydrophobicContact CB-CG1 4.14Å; N326-I330 WeakPolarHBondContact O-CG1 3.46Å; N326-I330 PolarHBondContact O-N 3.45Å; I330-R332 PolarHBondContact O-N 3.42Å; I330-W333 PolarHBondContact O-N 2.84Å; I330-M334 VanDerWaalsContact O-CB 3.31Å; I330-M334 WeakPolarHBondContact O-CB 3.29Å; I330-M334 PolarHBondContact O-N 2.95Å
331	K	86.5	Confident	89.3	Confident	125 Å²	125	103.8 Å²	103.8	54%	0.543	50%	0.5	S	S	.	.	H	α-helix	trans	-58.4	-47.2	174.7	-81.2	-176	179.7	-169	0	111.7	R327 M334 Y335	R327-K331 WeakPolarHBondContact O-CB 3.46Å; R327-K331 VanDerWaalsContact O-CG 3.3Å; R327-K331 WeakPolarHBondContact O-CG 3.39Å; R327-K331 PolarHBondContact O-N 3.05Å; K331-M334 PolarHBondContact O-N 3.01Å; K331-Y335 HydrophobicContact CB-CE2 4.16Å; K331-Y335 WeakPolarHBondContact O-CD2 3.31Å; K331-Y335 PolarHBondContact O-N 2.93Å
332	R	85.6	Confident	88.9	Confident	184 Å²	184	106.8 Å²	106.8	69%	0.694	51%	0.505	S	S	*	.	H	α-helix	trans	-61	-45.1	177.9	-175.3	-179.9	-73.4	179.1	-5.2	111.8	K328 G329 I330 M334 Y335 N336	K328-R332 WeakPolarHBondContact O-CB 2.97Å; K328-R332 PolarHBondContact O-N 3.46Å; G329-R332 PolarHBondContact O-N 3.37Å; I330-R332 PolarHBondContact O-N 3.42Å; R332-M334 PolarHBondContact O-N 2.75Å; R332-Y335 PolarHBondContact O-N 3.42Å; R332-N336 WeakPolarHBondContact O-CB 3.5Å; R332-N336 PolarHBondContact O-N 3.21Å; R332-N336 PolarHBondContact O-OD1 3.01Å
333	W	87.4	Confident	88.5	Confident	163 Å²	163	108.5 Å²	108.5	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-43.4	176.2	177.8	79.9	0	0	0	112.1	G329 I330 N336 I337	G329-W333 WeakPolarHBondContact O-CB 3.42Å; G329-W333 PolarHBondContact O-N 2.96Å; I330-W333 PolarHBondContact O-N 2.84Å; W333-N336 PolarHBondContact O-N 3.36Å; W333-I337 HydrophobicContact CD2-CD1 3.84Å; W333-I337 HydrophobicContact CE3-CD1 4.17Å; W333-I337 HydrophobicContact CH2-CD1 3.53Å; W333-I337 HydrophobicContact CZ2-CD1 3.12Å; W333-I337 HydrophobicContact CZ2-CG1 4.43Å; W333-I337 HydrophobicContact CZ3-CD1 4.03Å; W333-I337 PolarHBondContact O-N 3.12Å
334	M	87.9	Confident	88.2	Confident	106 Å²	106	110.8 Å²	110.8	52%	0.522	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-38.6	178.8	-164	-177	70.4	0	0	112.3	I330 K331 R332 R338	I330-M334 VanDerWaalsContact O-CB 3.31Å; I330-M334 WeakPolarHBondContact O-CB 3.29Å; I330-M334 PolarHBondContact O-N 2.95Å; K331-M334 PolarHBondContact O-N 3.01Å; R332-M334 PolarHBondContact O-N 2.75Å; M334-R338 WeakPolarHBondContact O-CB 3.23Å; M334-R338 PolarHBondContact O-N 3.08Å
335	Y	86.3	Confident	87.7	Confident	108 Å²	108	110.5 Å²	110.5	42%	0.424	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-47.3	171.8	-69.1	-56	0	0	0	111.4	K331 R332 I337 R338 D339	K331-Y335 HydrophobicContact CB-CE2 4.16Å; K331-Y335 WeakPolarHBondContact O-CD2 3.31Å; K331-Y335 PolarHBondContact O-N 2.93Å; R332-Y335 PolarHBondContact O-N 3.42Å; Y335-I337 VanDerWaalsContact C-N 3.31Å; Y335-I337 PolarHBondContact O-N 3.32Å; Y335-R338 PolarHBondContact O-N 2.74Å; Y335-R338 VanDerWaalsContact O-N 3.16Å; Y335-D339 WeakPolarHBondContact O-CB 3.46Å; Y335-D339 PolarHBondContact O-N 2.69Å
336	N	87.8	Confident	87.2	Confident	98 Å²	98	108.3 Å²	108.3	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-39.8	178	-69.3	-0.8	0	0	0	112.6	R332 W333 A340	R332-N336 WeakPolarHBondContact O-CB 3.5Å; R332-N336 PolarHBondContact O-N 3.21Å; R332-N336 PolarHBondContact O-OD1 3.01Å; W333-N336 PolarHBondContact O-N 3.36Å; N336-A340 VanDerWaalsContact O-CB 3.31Å; N336-A340 WeakPolarHBondContact O-CB 3.09Å; N336-A340 PolarHBondContact O-N 3.29Å
337	I	89.4	Confident	86.5	Confident	70 Å²	70	106 Å²	106	36%	0.359	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-45.6	175.3	-80.1	-175.2	0	0	0	111.4	W333 Y335 D339 A340 C341	W333-I337 HydrophobicContact CD2-CD1 3.84Å; W333-I337 HydrophobicContact CE3-CD1 4.17Å; W333-I337 HydrophobicContact CH2-CD1 3.53Å; W333-I337 HydrophobicContact CZ2-CD1 3.12Å; W333-I337 HydrophobicContact CZ2-CG1 4.43Å; W333-I337 HydrophobicContact CZ3-CD1 4.03Å; W333-I337 PolarHBondContact O-N 3.12Å; Y335-I337 VanDerWaalsContact C-N 3.31Å; Y335-I337 PolarHBondContact O-N 3.32Å; I337-D339 PolarHBondContact O-N 2.87Å; I337-A340 PolarHBondContact O-N 3.16Å; I337-C341 WeakPolarHBondContact O-CB 3.39Å; I337-C341 PolarHBondContact O-N 2.83Å
338	R	90.8	Very high	85.6	Confident	146 Å²	146	106.8 Å²	106.8	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-58.8	-43.2	178.1	-177.9	-171.3	67.6	168.2	0.9	110.6	M334 Y335 C341 R342	M334-R338 WeakPolarHBondContact O-CB 3.23Å; M334-R338 PolarHBondContact O-N 3.08Å; Y335-R338 PolarHBondContact O-N 2.74Å; Y335-R338 VanDerWaalsContact O-N 3.16Å; R338-C341 PolarHBondContact O-N 3.23Å; R338-R342 VanDerWaalsContact O-CB 3.3Å; R338-R342 WeakPolarHBondContact O-CB 3.47Å; R338-R342 PolarHBondContact O-N 2.95Å
339	D	87.3	Confident	84.9	Confident	65 Å²	65	104.9 Å²	104.9	35%	0.348	51%	0.505	S	S	.	.	H	α-helix	trans	-69.3	-42	-179.1	-61.3	-10.2	0	0	0	109.9	Y335 I337 C341 R342 D343	Y335-D339 WeakPolarHBondContact O-CB 3.46Å; Y335-D339 PolarHBondContact O-N 2.69Å; I337-D339 PolarHBondContact O-N 2.87Å; D339-C341 PolarHBondContact O-N 3.37Å; D339-R342 WeakPolarHBondContact O-CB 3.35Å; D339-R342 PolarHBondContact O-N 3.49Å; D339-R342 VanDerWaalsContact O-N 3.14Å; D339-D343 VanDerWaalsContact O-CG 3.31Å; D339-D343 PolarHBondContact O-N 2.9Å
340	A	87.9	Confident	83.9	Confident	58 Å²	58	110.3 Å²	110.3	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-40.3	172.9	0	0	0	0	0	113.5	N336 I337 H344	N336-A340 VanDerWaalsContact O-CB 3.31Å; N336-A340 WeakPolarHBondContact O-CB 3.09Å; N336-A340 PolarHBondContact O-N 3.29Å; I337-A340 PolarHBondContact O-N 3.16Å; A340-H344 WeakPolarHBondContact O-CB 3.39Å; A340-H344 PolarHBondContact O-N 3.42Å
341	C	87	Confident	82.8	Confident	80 Å²	80	115.8 Å²	115.8	54%	0.541	53%	0.529	S	S	.	.	H	α-helix	trans	-66.2	-38.5	173.4	-85.3	0	0	0	0	111.8	I337 R338 D339 H344 M345	I337-C341 WeakPolarHBondContact O-CB 3.39Å; I337-C341 PolarHBondContact O-N 2.83Å; R338-C341 PolarHBondContact O-N 3.23Å; D339-C341 PolarHBondContact O-N 3.37Å; C341-H344 PolarHBondContact O-N 2.96Å; C341-M345 WeakPolarHBondContact O-CB 3.28Å; C341-M345 WeakPolarHBondContact O-CG 3.28Å; C341-M345 PolarHBondContact O-N 2.86Å
342	R	87.6	Confident	81.7	Confident	156 Å²	156	118.6 Å²	118.6	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-63.9	-48.1	176.9	-177.9	179.7	175.6	99.5	12.7	110.7	R338 D339 H344 M345 E346	R338-R342 VanDerWaalsContact O-CB 3.3Å; R338-R342 WeakPolarHBondContact O-CB 3.47Å; R338-R342 PolarHBondContact O-N 2.95Å; D339-R342 WeakPolarHBondContact O-CB 3.35Å; D339-R342 PolarHBondContact O-N 3.49Å; D339-R342 VanDerWaalsContact O-N 3.14Å; R342-H344 VanDerWaalsContact C-N 3.26Å; R342-H344 PolarHBondContact O-N 3.3Å; R342-M345 PolarHBondContact O-N 3.27Å; R342-E346 HydrophobicContact CG-CG 4.47Å; R342-E346 IonicContact CZ-OE1 2.69Å; R342-E346 IonicContact NE-OE1 3.86Å; R342-E346 PolarHBondContact NE-OE1 3.16Å; R342-E346 IonicContact NH2-OE1 3.96Å; R342-E346 PolarHBondContact NH2-OE1 3.34Å; R342-E346 WeakPolarHBondContact O-CG 3.46Å; R342-E346 PolarHBondContact O-N 2.88Å
343	D	85.3	Confident	80.7	Confident	108 Å²	108	115 Å²	115	58%	0.578	53%	0.529	S	S	*	.	H	α-helix	trans	-59.8	-39.7	176.7	-69.1	-10.4	0	0	0	111.3	D339 G347	D339-D343 VanDerWaalsContact O-CG 3.31Å; D339-D343 PolarHBondContact O-N 2.9Å; D343-G347 PolarHBondContact O-N 3.02Å
344	H	86	Confident	79.4	Confident	119 Å²	119	112 Å²	112	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-44.3	176.7	-162.1	61.2	0	0	0	112.3	A340 C341 R342 G347 Y348	A340-H344 WeakPolarHBondContact O-CB 3.39Å; A340-H344 PolarHBondContact O-N 3.42Å; C341-H344 PolarHBondContact O-N 2.96Å; R342-H344 VanDerWaalsContact C-N 3.26Å; R342-H344 PolarHBondContact O-N 3.3Å; H344-G347 PolarHBondContact O-N 2.72Å; H344-Y348 AromaticContact CD2-CE2 3.6Å; H344-Y348 AromaticContact CE1-CE2 3.86Å; H344-Y348 AromaticContact NE2-CE2 3.31Å; H344-Y348 VanDerWaalsContact NE2-CE2 3.31Å; H344-Y348 WeakPolarHBondContact NE2-CE2 3.24Å; H344-Y348 VanDerWaalsContact O-CD2 3.28Å; H344-Y348 WeakPolarHBondContact O-CD2 3.32Å; H344-Y348 PolarHBondContact O-N 2.9Å
345	M	81.5	Confident	77.9	Confident	133 Å²	133	113.6 Å²	113.6	66%	0.655	53%	0.534	S	S	*	.	H	α-helix	trans	-66.1	-41.2	176.6	-77	-70	-69.9	0	0	112.5	C341 R342 G347 Y348 H349	C341-M345 WeakPolarHBondContact O-CB 3.28Å; C341-M345 WeakPolarHBondContact O-CG 3.28Å; C341-M345 PolarHBondContact O-N 2.86Å; R342-M345 PolarHBondContact O-N 3.27Å; M345-G347 VanDerWaalsContact C-N 3.33Å; M345-Y348 WeakPolarHBondContact O-CB 3.17Å; M345-Y348 PolarHBondContact O-N 3.49Å; M345-H349 PolarHBondContact O-N 3.08Å
346	E	82.6	Confident	76.5	Confident	75 Å²	75	112 Å²	112	35%	0.35	54%	0.539	S	S	.	.	H	α-helix	trans	-63.6	-39.9	174.1	-73.3	-179.8	-174.8	0	0	110.7	R342 Y348 H349 Y350	R342-E346 HydrophobicContact CG-CG 4.47Å; R342-E346 IonicContact CZ-OE1 2.69Å; R342-E346 IonicContact NE-OE1 3.86Å; R342-E346 PolarHBondContact NE-OE1 3.16Å; R342-E346 IonicContact NH2-OE1 3.96Å; R342-E346 PolarHBondContact NH2-OE1 3.34Å; R342-E346 WeakPolarHBondContact O-CG 3.46Å; R342-E346 PolarHBondContact O-N 2.88Å; E346-Y348 VanDerWaalsContact C-N 3.34Å; E346-Y348 PolarHBondContact O-N 2.65Å; E346-H349 WeakPolarHBondContact O-CB 3.36Å; E346-H349 PolarHBondContact O-N 2.92Å; E346-H349 VanDerWaalsContact O-N 3.11Å; E346-Y350 WeakPolarHBondContact O-CD2 3.37Å; E346-Y350 PolarHBondContact O-N 3.24Å
347	G	76.1	Confident	75.1	Confident	36 Å²	36	110.8 Å²	110.8	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-60.8	-37.8	172.2	0	0	0	0	0	113.9	D343 H344 M345 R351	D343-G347 PolarHBondContact O-N 3.02Å; H344-G347 PolarHBondContact O-N 2.72Å; M345-G347 VanDerWaalsContact C-N 3.33Å; G347-R351 PolarHBondContact O-N 3.04Å; G347-R351 VanDerWaalsContact O-N 3.16Å
348	Y	72.6	Confident	73.6	Confident	137 Å²	137	112 Å²	112	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-41.6	170.7	-88.1	-72.4	0	0	0	112	H344 M345 E346 R351 Y352	H344-Y348 AromaticContact CD2-CE2 3.6Å; H344-Y348 AromaticContact CE1-CE2 3.86Å; H344-Y348 AromaticContact NE2-CE2 3.31Å; H344-Y348 VanDerWaalsContact NE2-CE2 3.31Å; H344-Y348 WeakPolarHBondContact NE2-CE2 3.24Å; H344-Y348 VanDerWaalsContact O-CD2 3.28Å; H344-Y348 WeakPolarHBondContact O-CD2 3.32Å; H344-Y348 PolarHBondContact O-N 2.9Å; M345-Y348 WeakPolarHBondContact O-CB 3.17Å; M345-Y348 PolarHBondContact O-N 3.49Å; E346-Y348 VanDerWaalsContact C-N 3.34Å; E346-Y348 PolarHBondContact O-N 2.65Å; Y348-R351 PolarHBondContact O-N 3.35Å; Y348-Y352 WeakPolarHBondContact O-CB 3.19Å; Y348-Y352 PolarHBondContact O-N 3.08Å
349	H	72	Confident	72.1	Confident	124 Å²	124	115 Å²	115	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-62.8	-46.4	179.1	-142	-78.1	0	0	0	111.8	M345 E346 R351 Y352 E353	M345-H349 PolarHBondContact O-N 3.08Å; E346-H349 WeakPolarHBondContact O-CB 3.36Å; E346-H349 PolarHBondContact O-N 2.92Å; E346-H349 VanDerWaalsContact O-N 3.11Å; H349-R351 PolarHBondContact O-N 3.01Å; H349-Y352 WeakPolarHBondContact O-CB 3.19Å; H349-Y352 PolarHBondContact O-N 2.93Å; H349-Y352 VanDerWaalsContact O-N 3.13Å; H349-E353 IonicContact CE1-OE1 3.46Å; H349-E353 PolarHBondContact CE1-OE1 3.18Å; H349-E353 IonicContact ND1-OE1 3.98Å; H349-E353 PolarHBondContact ND1-OE1 3.16Å; H349-E353 VanDerWaalsContact ND1-OE1 3.11Å; H349-E353 PolarHBondContact O-N 3.42Å
350	Y	66.7	Low	70.5	Confident	159 Å²	159	116.1 Å²	116.1	62%	0.624	56%	0.562	S	S	*	*	H	α-helix	trans	-61.4	-42.1	176.1	-89	-73.3	0	0	0	112.9	E346 Y352 E353 I354	E346-Y350 WeakPolarHBondContact O-CD2 3.37Å; E346-Y350 PolarHBondContact O-N 3.24Å; Y350-Y352 VanDerWaalsContact C-N 3.29Å; Y350-Y352 PolarHBondContact O-N 3.18Å; Y350-E353 PolarHBondContact O-N 2.99Å; Y350-I354 WeakPolarHBondContact O-CG1 3.5Å; Y350-I354 PolarHBondContact O-N 2.82Å; Y350-I354 VanDerWaalsContact O-N 3.1Å
351	R	64.6	Low	68.9	Low	182 Å²	182	116 Å²	116	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-65.2	-34	174.2	-84.5	-176.4	176.6	161.3	0	112.5	G347 Y348 H349 N355	G347-R351 PolarHBondContact O-N 3.04Å; G347-R351 VanDerWaalsContact O-N 3.16Å; Y348-R351 PolarHBondContact O-N 3.35Å; H349-R351 PolarHBondContact O-N 3.01Å; R351-N355 WeakPolarHBondContact O-CB 3.37Å; R351-N355 VanDerWaalsContact O-CG 3.3Å; R351-N355 PolarHBondContact O-N 3.1Å; R351-N355 PolarHBondContact O-ND2 3.13Å
352	Y	63.4	Low	67.2	Low	184 Å²	184	117.6 Å²	117.6	72%	0.722	57%	0.565	S	S	*	*	H	α-helix	trans	-69	-43.5	177.5	-146.2	-87.6	0	0	0	111.3	Y348 H349 Y350 N355 S356	Y348-Y352 WeakPolarHBondContact O-CB 3.19Å; Y348-Y352 PolarHBondContact O-N 3.08Å; H349-Y352 WeakPolarHBondContact O-CB 3.19Å; H349-Y352 PolarHBondContact O-N 2.93Å; H349-Y352 VanDerWaalsContact O-N 3.13Å; Y350-Y352 VanDerWaalsContact C-N 3.29Å; Y350-Y352 PolarHBondContact O-N 3.18Å; Y352-N355 PolarHBondContact O-N 3.22Å; Y352-S356 WeakPolarHBondContact O-CB 3.4Å; Y352-S356 PolarHBondContact O-N 3.05Å; Y352-S356 PolarHBondContact O-OG 3.47Å
353	E	64.6	Low	65.6	Low	108 Å²	108	116 Å²	116	51%	0.505	57%	0.567	S	S	.	*	H	α-helix	trans	-64.1	-42	177	-77	176.5	-164.6	0	0	112.8	H349 Y350 N355 S356 D357	H349-E353 IonicContact CE1-OE1 3.46Å; H349-E353 PolarHBondContact CE1-OE1 3.18Å; H349-E353 IonicContact ND1-OE1 3.98Å; H349-E353 PolarHBondContact ND1-OE1 3.16Å; H349-E353 VanDerWaalsContact ND1-OE1 3.11Å; H349-E353 PolarHBondContact O-N 3.42Å; Y350-E353 PolarHBondContact O-N 2.99Å; E353-N355 VanDerWaalsContact C-N 3.32Å; E353-N355 PolarHBondContact O-N 3.4Å; E353-S356 WeakPolarHBondContact CA-OG 3.32Å; E353-S356 PolarHBondContact O-N 2.84Å; E353-S356 VanDerWaalsContact O-N 3.16Å; E353-S356 PolarHBondContact O-OG 2.75Å; E353-D357 PolarHBondContact O-N 2.78Å; E353-D357 VanDerWaalsContact O-N 3.14Å
354	I	60.1	Low	64	Low	99 Å²	99	115.1 Å²	115.1	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-62.5	-39.6	175.5	-70.4	168	0	0	0	111.8	Y350 S356	Y350-I354 WeakPolarHBondContact O-CG1 3.5Å; Y350-I354 PolarHBondContact O-N 2.82Å; Y350-I354 VanDerWaalsContact O-N 3.1Å; I354-S356 VanDerWaalsContact C-N 3.27Å; I354-S356 PolarHBondContact O-N 3.41Å
355	N	55.5	Low	62.5	Low	140 Å²	140	115.3 Å²	115.3	75%	0.749	57%	0.573	S	S	*	*	H	α-helix	trans	-77.4	-12.3	178.6	-71.3	-24.2	0	0	0	113.4	R351 Y352 E353	R351-N355 WeakPolarHBondContact O-CB 3.37Å; R351-N355 VanDerWaalsContact O-CG 3.3Å; R351-N355 PolarHBondContact O-N 3.1Å; R351-N355 PolarHBondContact O-ND2 3.13Å; Y352-N355 PolarHBondContact O-N 3.22Å; E353-N355 VanDerWaalsContact C-N 3.32Å; E353-N355 PolarHBondContact O-N 3.4Å
356	S	58.1	Low	61	Low	74 Å²	74	115.8 Å²	115.8	52%	0.517	58%	0.578	S	S	.	*	H	α-helix	trans	-106.6	-0.7	179.8	46.9	0	0	0	0	113.9	Y352 E353 I354 P358	Y352-S356 WeakPolarHBondContact O-CB 3.4Å; Y352-S356 PolarHBondContact O-N 3.05Å; Y352-S356 PolarHBondContact O-OG 3.47Å; E353-S356 WeakPolarHBondContact CA-OG 3.32Å; E353-S356 PolarHBondContact O-N 2.84Å; E353-S356 VanDerWaalsContact O-N 3.16Å; E353-S356 PolarHBondContact O-OG 2.75Å; I354-S356 VanDerWaalsContact C-N 3.27Å; I354-S356 PolarHBondContact O-N 3.41Å; S356-P358 WeakPolarHBondContact O-CD 3.2Å
357	D	57.6	Low	59.5	Low	73 Å²	73	116.7 Å²	116.7	39%	0.39	59%	0.593	S	S	.	*			trans	-79.2	108.9	168.2	-167.2	-13.5	0	0	0	110.7	E353 R359 L360	E353-D357 PolarHBondContact O-N 2.78Å; E353-D357 VanDerWaalsContact O-N 3.14Å; D357-R359 PolarHBondContact O-N 3.41Å; D357-R359 PolarHBondContact OD1-N 3.27Å; D357-R359 VanDerWaalsContact OD1-N 3.13Å; D357-L360 PolarHBondContact O-N 3.5Å
358	P	58.1	Low	58.3	Low	97 Å²	97	122.5 Å²	122.5	63%	0.63	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-9.4	-178	26.9	-33.6	0	0	0	113.6	S356	S356-P358 WeakPolarHBondContact O-CD 3.2Å
359	R	58.8	Low	56.8	Low	207 Å²	207	126.1 Å²	126.1	78%	0.781	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-27.6	176.1	-61.1	-175.8	102.4	128.9	1.3	113.2	D357	D357-R359 PolarHBondContact O-N 3.41Å; D357-R359 PolarHBondContact OD1-N 3.27Å; D357-R359 VanDerWaalsContact OD1-N 3.13Å
360	L	54.5	Low	56	Low	89 Å²	89	126.2 Å²	126.2	47%	0.466	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	-25	177.8	-88.7	155.9	0	0	0	113.2	D357 N362 L363	D357-L360 PolarHBondContact O-N 3.5Å; L360-N362 PolarHBondContact O-N 2.81Å; L360-L363 HydrophobicContact CD2-CD1 4.11Å; L360-L363 PolarHBondContact O-N 2.89Å; L360-L363 VanDerWaalsContact O-N 3.08Å
361	A	53.8	Low	55.5	Low	56 Å²	56	124.5 Å²	124.5	46%	0.463	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	-23.5	170.5	0	0	0	0	0	112.9
362	N	52.4	Low	55	Low	114 Å²	114	121.3 Å²	121.3	61%	0.61	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-2.2	176.9	-83.7	-12.5	0	0	0	114.8	L360	L360-N362 PolarHBondContact O-N 2.81Å
363	L	53.4	Low	54.5	Low	122 Å²	122	117.6 Å²	117.6	64%	0.639	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-20.3	173.3	-90	153.3	0	0	0	112.9	L360	L360-L363 HydrophobicContact CD2-CD1 4.11Å; L360-L363 PolarHBondContact O-N 2.89Å; L360-L363 VanDerWaalsContact O-N 3.08Å
364	S	51.3	Low	53.8	Low	90 Å²	90	118.2 Å²	118.2	63%	0.629	66%	0.66	S	S	*	*	S	Bend	trans	-91.4	-2.8	175.7	68.8	0	0	0	0	114.5
365	I	54.4	Low	53.4	Low	122 Å²	122	119.5 Å²	119.5	63%	0.626	67%	0.671	S	S	*	*	S	Bend	trans	-98	-11.6	178.4	-65.4	177	0	0	0	112
366	N	51.2	Low	53.3	Low	143 Å²	143	118 Å²	118	77%	0.765	67%	0.665	S	S	*	*	S	Bend	trans	-121.3	23.7	-175.8	-77.3	-14.7	0	0	0	114.9
367	S	49.5	Very low	52.9	Low	95 Å²	95	121.4 Å²	121.4	66%	0.664	68%	0.676	S	S	*	*			trans	-121.2	24.8	167.6	70	0	0	0	0	113.8
368	D	52.1	Low	52.5	Low	157 Å²	157	125.4 Å²	125.4	84%	0.84	70%	0.7	S	S	*	*			trans	-102.1	80.9	154.6	-85.4	-25.2	0	0	0	108
369	V	40.5	Very low	52	Low	213 Å²	213	128 Å²	128	100%	1.291	71%	0.707	S	S	*	*			trans	-162.1	0	137.5	172.8	0	0	0	0	107.7

Retrieved 369 of 369 residues in 813.3 ms (Link to these results)

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