A0A060VYN5_ONCMY Loading...

AAA+ ATPase domain-containing protein

AlphaFold DB (B5X5I0), UniProt , Accession A0A060VYN5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	48.6	Very low	244 Å²	244	131.9 Å²	131.9	100%	1.202	69%	0.69	S	S	*	*				0	97.3	0	-74.3	-179.1	-163.7	0	0	106.9	S3	M1-S3 PolarHBondContact O-N 3.17Å
2	A	38.9	Very low	48.8	Very low	80 Å²	80	136 Å²	136	66%	0.661	70%	0.703	S	S	*	*			trans	-67.8	120.5	166.2	0	0	0	0	0	106.6
3	S	42.9	Very low	49	Very low	80 Å²	80	132.4 Å²	132.4	56%	0.559	69%	0.69	S	S	*	*			trans	-64.9	147.3	174.6	54.5	0	0	0	0	109.4	M1 N5 D6	M1-S3 PolarHBondContact O-N 3.17Å; S3-N5 PolarHBondContact O-N 3.07Å; S3-D6 PolarHBondContact O-N 3.3Å; S3-D6 VanDerWaalsContact O-N 3.12Å
4	L	50	Low	49.2	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.3	0	175.1	-93.7	107.7	0	0	0	116.2
5	N	50.7	Low	49.5	Very low	144 Å²	144	135.3 Å²	135.3	77%	0.77	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	5.8	177.5	-75	-14.5	0	0	0	114.3	S3 R7	S3-N5 PolarHBondContact O-N 3.07Å; N5-R7 PolarHBondContact O-N 3.03Å; N5-R7 VanDerWaalsContact O-N 3.09Å
6	D	45.9	Very low	49.7	Very low	79 Å²	79	130.1 Å²	130.1	42%	0.422	69%	0.692	S	S	.	*			trans	-74.3	99.7	173.9	-120.9	-20	0	0	0	109.9	S3 S8 V9	S3-D6 PolarHBondContact O-N 3.3Å; S3-D6 VanDerWaalsContact O-N 3.12Å; D6-S8 PolarHBondContact O-N 3.03Å; D6-V9 HydrophobicContact CB-CG2 4.47Å; D6-V9 PolarHBondContact O-N 3.4Å
7	R	52.5	Low	50.1	Low	212 Å²	212	128.1 Å²	128.1	80%	0.8	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-58.3	-25.7	-179.6	-93.8	-179.7	169.4	171.5	-4.5	113.3	N5 V9 W10	N5-R7 PolarHBondContact O-N 3.03Å; N5-R7 VanDerWaalsContact O-N 3.09Å; R7-V9 PolarHBondContact O-N 3.08Å; R7-W10 PolarHBondContact O-N 3.12Å
8	S	56	Low	50.6	Low	71 Å²	71	123.3 Å²	123.3	50%	0.497	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-67.5	-19	-176.9	58.7	0	0	0	0	114.6	D6 W10	D6-S8 PolarHBondContact O-N 3.03Å; S8-W10 VanDerWaalsContact C-N 3.32Å
9	V	54.2	Low	51.1	Low	95 Å²	95	123.7 Å²	123.7	58%	0.576	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-78	-22.2	177.8	-179.6	0	0	0	0	111.7	D6 R7	D6-V9 HydrophobicContact CB-CG2 4.47Å; D6-V9 PolarHBondContact O-N 3.4Å; R7-V9 PolarHBondContact O-N 3.08Å
10	W	54	Low	51.6	Low	171 Å²	171	123.7 Å²	123.7	65%	0.648	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-31	-178.4	-60	90.6	0	0	0	112.3	R7 S8 E12 V13	R7-W10 PolarHBondContact O-N 3.12Å; S8-W10 VanDerWaalsContact C-N 3.32Å; W10-E12 VanDerWaalsContact C-N 3.32Å; W10-E12 PolarHBondContact O-N 3.26Å; W10-V13 PolarHBondContact O-N 3.44Å
11	D	52.3	Low	52.1	Low	112 Å²	112	120.9 Å²	120.9	60%	0.599	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-21.8	-176.4	-71.6	-19.6	0	0	0	113.5
12	E	50.6	Low	53.4	Low	181 Å²	181	116.4 Å²	116.4	85%	0.846	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-7.4	179.7	-71.4	-172	167.5	0	0	114.1	W10	W10-E12 VanDerWaalsContact C-N 3.32Å; W10-E12 PolarHBondContact O-N 3.26Å
13	V	51.2	Low	54.8	Low	89 Å²	89	119.7 Å²	119.7	54%	0.539	63%	0.626	S	S	.	*	S	Bend	trans	-108.8	-6.6	-174.1	-164.9	0	0	0	0	112.6	W10 D15 I17	W10-V13 PolarHBondContact O-N 3.44Å; V13-D15 VanDerWaalsContact C-N 3.3Å; V13-D15 PolarHBondContact O-N 3.22Å; V13-I17 HydrophobicContact CG1-CD1 4.22Å; V13-I17 WeakPolarHBondContact O-CG1 3.45Å
14	E	52.7	Low	56	Low	135 Å²	135	118 Å²	118	63%	0.631	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-22	-172.8	-72.9	-165.4	151.4	0	0	114.8	G16	E14-G16 VanDerWaalsContact C-N 3.31Å; E14-G16 PolarHBondContact O-N 3.46Å
15	D	52.8	Low	57.4	Low	174 Å²	174	113.4 Å²	113.4	93%	0.93	59%	0.591	S	S	*	*	H	α-helix	trans	-74.7	-12.6	-173.6	-78.7	-23.9	0	0	0	114.9	V13	V13-D15 VanDerWaalsContact C-N 3.3Å; V13-D15 PolarHBondContact O-N 3.22Å
16	G	52.9	Low	58.6	Low	52 Å²	52	112.2 Å²	112.2	54%	0.536	59%	0.59	S	S	.	*	H	α-helix	trans	-107.3	-18.8	-178.1	0	0	0	0	0	116.1	E14	E14-G16 VanDerWaalsContact C-N 3.31Å; E14-G16 PolarHBondContact O-N 3.46Å
17	I	56.7	Low	60.2	Low	96 Å²	96	115.3 Å²	115.3	49%	0.492	60%	0.601	S	S	.	*	H	α-helix	trans	-82.8	-33	-167.8	-49.3	172.1	0	0	0	111.1	V13 E19 V21	V13-I17 HydrophobicContact CG1-CD1 4.22Å; V13-I17 WeakPolarHBondContact O-CG1 3.45Å; I17-E19 PolarHBondContact O-N 3.48Å; I17-V21 HydrophobicContact CG2-CG2 3.92Å; I17-V21 WeakPolarHBondContact O-CB 3.27Å; I17-V21 WeakPolarHBondContact O-CG2 3.47Å; I17-V21 PolarHBondContact O-N 3.15Å
18	G	58.6	Low	61.5	Low	42 Å²	42	109.3 Å²	109.3	43%	0.433	58%	0.582	S	S	.	*	H	α-helix	trans	-63.9	-41.3	-174.4	0	0	0	0	0	114.3	L22	G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 VanDerWaalsContact O-CD1 3.27Å; G18-L22 WeakPolarHBondContact O-CD1 3.42Å; G18-L22 VanDerWaalsContact O-CG 3.26Å; G18-L22 WeakPolarHBondContact O-CG 3.29Å; G18-L22 PolarHBondContact O-N 3.24Å; G18-L22 VanDerWaalsContact O-N 3.15Å
19	E	60	Low	62.6	Low	130 Å²	130	108.5 Å²	108.5	61%	0.607	57%	0.572	S	S	*	*	H	α-helix	trans	-78.2	-32.6	-172.9	-128.5	-152.6	135.2	0	0	113.6	I17 K23	I17-E19 PolarHBondContact O-N 3.48Å; E19-K23 WeakPolarHBondContact O-CD 3.36Å; E19-K23 VanDerWaalsContact O-CG 3.29Å; E19-K23 WeakPolarHBondContact O-CG 3.14Å; E19-K23 WeakPolarHBondContact OE1-CE 3.31Å; E19-K23 IonicContact OE1-NZ 2.66Å; E19-K23 PolarHBondContact OE1-NZ 3.32Å; E19-K23 IonicContact OE2-NZ 2.73Å
20	E	61.1	Low	64	Low	124 Å²	124	107.1 Å²	107.1	58%	0.579	56%	0.564	S	S	*	*	H	α-helix	trans	-74.5	-38.4	174.5	-74.5	-156.8	156.7	0	0	112	K23 M24	E20-K23 PolarHBondContact O-N 3.35Å; E20-M24 HydrophobicContact CB-CE 4.21Å; E20-M24 WeakPolarHBondContact O-CG 3.27Å; E20-M24 PolarHBondContact O-N 3.32Å
21	V	62.5	Low	65.4	Low	64 Å²	64	104.7 Å²	104.7	39%	0.388	56%	0.56	S	S	.	*	H	α-helix	trans	-69.4	-33.3	178.9	174.3	0	0	0	0	111.7	I17 K23 M24 I29	I17-V21 HydrophobicContact CG2-CG2 3.92Å; I17-V21 WeakPolarHBondContact O-CB 3.27Å; I17-V21 WeakPolarHBondContact O-CG2 3.47Å; I17-V21 PolarHBondContact O-N 3.15Å; V21-K23 VanDerWaalsContact C-N 3.29Å; V21-K23 PolarHBondContact O-N 2.96Å; V21-M24 PolarHBondContact O-N 2.96Å; V21-I29 HydrophobicContact CG1-CD1 3.8Å; V21-I29 HydrophobicContact CG1-CG1 4.44Å
22	L	64.6	Low	66.9	Low	151 Å²	151	105.5 Å²	105.5	79%	0.791	55%	0.554	S	S	*	*	H	α-helix	trans	-68.1	-24.7	173.2	-80	161.9	0	0	0	113.5	G18	G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 VanDerWaalsContact O-CD1 3.27Å; G18-L22 WeakPolarHBondContact O-CD1 3.42Å; G18-L22 VanDerWaalsContact O-CG 3.26Å; G18-L22 WeakPolarHBondContact O-CG 3.29Å; G18-L22 PolarHBondContact O-N 3.24Å; G18-L22 VanDerWaalsContact O-N 3.15Å
23	K	69.3	Low	68.5	Low	148 Å²	148	100.2 Å²	100.2	64%	0.643	53%	0.534	S	S	*	.	H	α-helix	trans	-88.1	-15.9	180	-70.9	168.8	-170.1	164.9	0	113.1	E19 E20 V21	E19-K23 WeakPolarHBondContact O-CD 3.36Å; E19-K23 VanDerWaalsContact O-CG 3.29Å; E19-K23 WeakPolarHBondContact O-CG 3.14Å; E19-K23 WeakPolarHBondContact OE1-CE 3.31Å; E19-K23 IonicContact OE1-NZ 2.66Å; E19-K23 PolarHBondContact OE1-NZ 3.32Å; E19-K23 IonicContact OE2-NZ 2.73Å; E20-K23 PolarHBondContact O-N 3.35Å; V21-K23 VanDerWaalsContact C-N 3.29Å; V21-K23 PolarHBondContact O-N 2.96Å
24	M	68.5	Low	70.1	Confident	44 Å²	44	104.5 Å²	104.5	22%	0.217	54%	0.541	C	S	.	.	S	Bend	trans	-88.7	150.2	-179	-72	176.1	-161.5	0	0	112	E20 V21 I29 R32	E20-M24 HydrophobicContact CB-CE 4.21Å; E20-M24 WeakPolarHBondContact O-CG 3.27Å; E20-M24 PolarHBondContact O-N 3.32Å; V21-M24 PolarHBondContact O-N 2.96Å; M24-I29 HydrophobicContact CB-CD1 4.42Å; M24-I29 HydrophobicContact CB-CG1 4.02Å; M24-R32 PolarHBondContact SD-NH1 2.91Å
25	S	77.7	Confident	71.8	Confident	67 Å²	67	103.4 Å²	103.4	47%	0.469	54%	0.538	S	S	.	.			trans	-70.1	149.7	171.9	71.1	0	0	0	0	110.6	E27 E28 I29	S25-E27 PolarHBondContact O-N 3.28Å; S25-E28 WeakPolarHBondContact O-CB 3.41Å; S25-E28 PolarHBondContact O-N 3.49Å; S25-E28 WeakPolarHBondContact OG-CB 3.4Å; S25-E28 PolarHBondContact OG-N 2.98Å; S25-I29 PolarHBondContact O-N 3.33Å
26	T	76.5	Confident	73.4	Confident	120 Å²	120	99.5 Å²	99.5	74%	0.736	52%	0.517	S	S	*	.	H	α-helix	trans	-54.7	-29.2	176.3	40.2	0	0	0	0	112.9	V30	T26-V30 VanDerWaalsContact O-CG2 3.27Å; T26-V30 WeakPolarHBondContact O-CG2 3.41Å; T26-V30 PolarHBondContact O-N 3.32Å
27	E	78.9	Confident	75.1	Confident	144 Å²	144	101.7 Å²	101.7	67%	0.673	52%	0.517	S	S	*	.	H	α-helix	trans	-75.7	-35.4	179.4	-163.4	145.7	-163	0	0	112.5	S25 V30 Q31	S25-E27 PolarHBondContact O-N 3.28Å; E27-V30 PolarHBondContact O-N 3.49Å; E27-Q31 PolarHBondContact O-N 3.09Å
28	E	79.9	Confident	76.7	Confident	86 Å²	86	99.8 Å²	99.8	40%	0.402	51%	0.512	S	S	.	.	H	α-helix	trans	-69.4	-38.3	176.3	-165.5	174.7	-169.7	0	0	111.8	S25 Q31 R32	S25-E28 WeakPolarHBondContact O-CB 3.41Å; S25-E28 PolarHBondContact O-N 3.49Å; S25-E28 WeakPolarHBondContact OG-CB 3.4Å; S25-E28 PolarHBondContact OG-N 2.98Å; E28-Q31 PolarHBondContact O-N 2.86Å; E28-R32 PolarHBondContact O-N 3.4Å
29	I	80.6	Confident	78.3	Confident	53 Å²	53	102.5 Å²	102.5	27%	0.272	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.8	-61.5	165.6	0	0	0	110.4	V21 M24 S25 Q31 R32 T33	V21-I29 HydrophobicContact CG1-CD1 3.8Å; V21-I29 HydrophobicContact CG1-CG1 4.44Å; M24-I29 HydrophobicContact CB-CD1 4.42Å; M24-I29 HydrophobicContact CB-CG1 4.02Å; S25-I29 PolarHBondContact O-N 3.33Å; I29-Q31 VanDerWaalsContact C-N 3.35Å; I29-Q31 PolarHBondContact O-N 3.5Å; I29-R32 PolarHBondContact O-N 3.21Å; I29-T33 WeakPolarHBondContact O-CG2 3.46Å; I29-T33 PolarHBondContact O-N 3.26Å; I29-T33 PolarHBondContact O-OG1 3.19Å; I29-T33 VanDerWaalsContact O-OG1 3.12Å
30	V	82.6	Confident	79.8	Confident	67 Å²	67	101 Å²	101	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-67.2	-34.2	178.9	172	0	0	0	0	112.1	T26 E27 T33 R34	T26-V30 VanDerWaalsContact O-CG2 3.27Å; T26-V30 WeakPolarHBondContact O-CG2 3.41Å; T26-V30 PolarHBondContact O-N 3.32Å; E27-V30 PolarHBondContact O-N 3.49Å; V30-T33 WeakPolarHBondContact CA-OG1 3.35Å; V30-T33 PolarHBondContact O-OG1 3.2Å; V30-T33 VanDerWaalsContact O-OG1 3.08Å; V30-R34 VanDerWaalsContact O-CG 3.31Å; V30-R34 WeakPolarHBondContact O-CG 3.33Å; V30-R34 PolarHBondContact O-N 3.41Å
31	Q	84.4	Confident	81.2	Confident	120 Å²	120	102.7 Å²	102.7	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-68.7	-44.4	172.8	-76.7	-175.1	-4.9	0	0	111.8	E27 E28 I29 R34 L35	E27-Q31 PolarHBondContact O-N 3.09Å; E28-Q31 PolarHBondContact O-N 2.86Å; I29-Q31 VanDerWaalsContact C-N 3.35Å; I29-Q31 PolarHBondContact O-N 3.5Å; Q31-R34 PolarHBondContact O-N 3.48Å; Q31-L35 WeakPolarHBondContact O-CG 3.49Å; Q31-L35 PolarHBondContact O-N 3.03Å
32	R	82.6	Confident	82.6	Confident	128 Å²	128	104.6 Å²	104.6	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-42.9	178.5	-115.5	174.8	173.9	138.6	-6.4	112.7	M24 E28 I29 R34 L35 L36	M24-R32 PolarHBondContact SD-NH1 2.91Å; E28-R32 PolarHBondContact O-N 3.4Å; I29-R32 PolarHBondContact O-N 3.21Å; R32-R34 PolarHBondContact O-N 2.78Å; R32-L35 PolarHBondContact O-N 3.27Å; R32-L36 WeakPolarHBondContact O-CB 3.35Å; R32-L36 WeakPolarHBondContact O-CG 3.37Å; R32-L36 PolarHBondContact O-N 3.25Å
33	T	83.6	Confident	83.9	Confident	70 Å²	70	102.1 Å²	102.1	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-40.1	176.6	51.9	0	0	0	0	111.9	I29 V30 L35 L36 D37	I29-T33 WeakPolarHBondContact O-CG2 3.46Å; I29-T33 PolarHBondContact O-N 3.26Å; I29-T33 PolarHBondContact O-OG1 3.19Å; I29-T33 VanDerWaalsContact O-OG1 3.12Å; V30-T33 WeakPolarHBondContact CA-OG1 3.35Å; V30-T33 PolarHBondContact O-OG1 3.2Å; V30-T33 VanDerWaalsContact O-OG1 3.08Å; T33-L35 PolarHBondContact O-N 3.42Å; T33-L36 PolarHBondContact O-N 3.38Å; T33-D37 WeakPolarHBondContact O-CB 3.42Å; T33-D37 PolarHBondContact O-N 3.12Å
34	R	85.8	Confident	85	Confident	180 Å²	180	102.1 Å²	102.1	68%	0.679	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-39.4	174.1	-76	177.5	179.6	174.1	2.9	113	V30 Q31 R32 S38	V30-R34 VanDerWaalsContact O-CG 3.31Å; V30-R34 WeakPolarHBondContact O-CG 3.33Å; V30-R34 PolarHBondContact O-N 3.41Å; Q31-R34 PolarHBondContact O-N 3.48Å; R32-R34 PolarHBondContact O-N 2.78Å; R34-S38 WeakPolarHBondContact O-CB 3.47Å; R34-S38 PolarHBondContact O-N 3.25Å; R34-S38 PolarHBondContact O-OG 3.38Å
35	L	88.1	Confident	86.2	Confident	111 Å²	111	103.6 Å²	103.6	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-64.3	-50	175.5	-71.7	169.9	0	0	0	110.5	Q31 R32 T33 D37 S38 E39	Q31-L35 WeakPolarHBondContact O-CG 3.49Å; Q31-L35 PolarHBondContact O-N 3.03Å; R32-L35 PolarHBondContact O-N 3.27Å; T33-L35 PolarHBondContact O-N 3.42Å; L35-D37 VanDerWaalsContact C-N 3.35Å; L35-D37 PolarHBondContact O-N 2.72Å; L35-S38 WeakPolarHBondContact O-CB 3.35Å; L35-S38 PolarHBondContact O-N 2.81Å; L35-S38 VanDerWaalsContact O-N 3.1Å; L35-S38 PolarHBondContact O-OG 3.23Å; L35-E39 WeakPolarHBondContact O-CB 3.21Å; L35-E39 PolarHBondContact O-N 3.45Å
36	L	87.4	Confident	87.1	Confident	92 Å²	92	104.6 Å²	104.6	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-40.5	177.2	-70.2	169.9	0	0	0	112.5	R32 T33 S38 E39 I40	R32-L36 WeakPolarHBondContact O-CB 3.35Å; R32-L36 WeakPolarHBondContact O-CG 3.37Å; R32-L36 PolarHBondContact O-N 3.25Å; T33-L36 PolarHBondContact O-N 3.38Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 2.87Å; L36-E39 PolarHBondContact O-N 2.65Å; L36-I40 WeakPolarHBondContact O-CB 3.48Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 3.1Å
37	D	87.7	Confident	87.9	Confident	98 Å²	98	103.3 Å²	103.3	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-37.9	175	-85.9	-23.1	0	0	0	112.3	T33 L35 K41	T33-D37 WeakPolarHBondContact O-CB 3.42Å; T33-D37 PolarHBondContact O-N 3.12Å; L35-D37 VanDerWaalsContact C-N 3.35Å; L35-D37 PolarHBondContact O-N 2.72Å; D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 3.35Å
38	S	89.8	Confident	88.7	Confident	56 Å²	56	101.9 Å²	101.9	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-68.3	-38.7	174.7	75.3	0	0	0	0	111.5	R34 L35 L36 K41 I42	R34-S38 WeakPolarHBondContact O-CB 3.47Å; R34-S38 PolarHBondContact O-N 3.25Å; R34-S38 PolarHBondContact O-OG 3.38Å; L35-S38 WeakPolarHBondContact O-CB 3.35Å; L35-S38 PolarHBondContact O-N 2.81Å; L35-S38 VanDerWaalsContact O-N 3.1Å; L35-S38 PolarHBondContact O-OG 3.23Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 2.87Å; S38-K41 PolarHBondContact O-N 3.12Å; S38-I42 WeakPolarHBondContact O-CG1 3.5Å; S38-I42 PolarHBondContact O-N 3.38Å; S38-I42 VanDerWaalsContact O-N 3.12Å
39	E	92.3	Very high	89.4	Confident	99 Å²	99	103.9 Å²	103.9	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-68.8	-44.1	179.1	-146.8	179.5	175.6	0	0	111.4	L35 L36 K41 I42 M43	L35-E39 WeakPolarHBondContact O-CB 3.21Å; L35-E39 PolarHBondContact O-N 3.45Å; L36-E39 PolarHBondContact O-N 2.65Å; E39-K41 VanDerWaalsContact C-N 3.29Å; E39-K41 PolarHBondContact O-N 3.09Å; E39-I42 PolarHBondContact O-N 2.86Å; E39-I42 VanDerWaalsContact O-N 3.14Å; E39-M43 HydrophobicContact CB-CE 4.16Å; E39-M43 HydrophobicContact CG-CE 3.59Å; E39-M43 WeakPolarHBondContact O-CB 3.35Å; E39-M43 WeakPolarHBondContact O-CG 3.48Å; E39-M43 PolarHBondContact O-N 2.79Å
40	I	92.1	Very high	90.1	Very high	99 Å²	99	105 Å²	105	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-39.3	174.9	-72.7	168	0	0	0	110.9	L36 K44	L36-I40 WeakPolarHBondContact O-CB 3.48Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 3.1Å; I40-K44 WeakPolarHBondContact O-CB 3.35Å; I40-K44 PolarHBondContact O-N 3.14Å
41	K	89.9	Confident	90.7	Very high	159 Å²	159	105.8 Å²	105.8	69%	0.691	53%	0.525	S	S	*	.	H	α-helix	trans	-64	-42.2	175.9	-77.8	175	-176.1	174.2	0	112	D37 S38 E39 S45	D37-K41 WeakPolarHBondContact O-CG 3.44Å; D37-K41 PolarHBondContact O-N 3.35Å; S38-K41 PolarHBondContact O-N 3.12Å; E39-K41 VanDerWaalsContact C-N 3.29Å; E39-K41 PolarHBondContact O-N 3.09Å; K41-S45 PolarHBondContact O-N 3.32Å; K41-S45 VanDerWaalsContact O-N 3.09Å
42	I	92.9	Very high	91.3	Very high	105 Å²	105	107 Å²	107	54%	0.538	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-50.4	176.6	-66.1	163.6	0	0	0	109.8	S38 E39 K44 S45 E46	S38-I42 WeakPolarHBondContact O-CG1 3.5Å; S38-I42 PolarHBondContact O-N 3.38Å; S38-I42 VanDerWaalsContact O-N 3.12Å; E39-I42 PolarHBondContact O-N 2.86Å; E39-I42 VanDerWaalsContact O-N 3.14Å; I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 PolarHBondContact O-N 3.42Å; I42-S45 WeakPolarHBondContact O-CA 3.3Å; I42-S45 WeakPolarHBondContact O-CB 3.24Å; I42-S45 PolarHBondContact O-N 3.17Å; I42-E46 HydrophobicContact CG2-CG 4.41Å; I42-E46 WeakPolarHBondContact O-CG 3.49Å; I42-E46 PolarHBondContact O-N 2.86Å
43	M	92.1	Very high	91.9	Very high	98 Å²	98	105.4 Å²	105.4	48%	0.483	53%	0.528	S	S	.	.	H	α-helix	trans	-57.1	-43.5	177.9	-71.6	-170.2	-136.4	0	0	111.8	E39 S45 E46 V47	E39-M43 HydrophobicContact CB-CE 4.16Å; E39-M43 HydrophobicContact CG-CE 3.59Å; E39-M43 WeakPolarHBondContact O-CB 3.35Å; E39-M43 WeakPolarHBondContact O-CG 3.48Å; E39-M43 PolarHBondContact O-N 2.79Å; M43-S45 VanDerWaalsContact C-N 3.32Å; M43-S45 PolarHBondContact O-N 3.36Å; M43-E46 PolarHBondContact O-N 3.26Å; M43-V47 WeakPolarHBondContact O-CB 3.37Å; M43-V47 VanDerWaalsContact O-CG2 3.24Å; M43-V47 WeakPolarHBondContact O-CG2 3.48Å; M43-V47 PolarHBondContact O-N 3.36Å
44	K	92.6	Very high	92.5	Very high	148 Å²	148	106.3 Å²	106.3	64%	0.643	53%	0.53	S	S	*	.	H	α-helix	trans	-63.4	-38.5	177.2	-170.7	175.3	-178.3	177.4	0	111.9	I40 I42 L48	I40-K44 WeakPolarHBondContact O-CB 3.35Å; I40-K44 PolarHBondContact O-N 3.14Å; I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 PolarHBondContact O-N 3.42Å; K44-L48 VanDerWaalsContact O-CG 3.3Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 3.05Å
45	S	93.8	Very high	93	Very high	75 Å²	75	102 Å²	102	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-43.3	174.3	178.1	0	0	0	0	111.9	K41 I42 M43 L48 R49	K41-S45 PolarHBondContact O-N 3.32Å; K41-S45 VanDerWaalsContact O-N 3.09Å; I42-S45 WeakPolarHBondContact O-CA 3.3Å; I42-S45 WeakPolarHBondContact O-CB 3.24Å; I42-S45 PolarHBondContact O-N 3.17Å; M43-S45 VanDerWaalsContact C-N 3.32Å; M43-S45 PolarHBondContact O-N 3.36Å; S45-L48 PolarHBondContact O-N 2.95Å; S45-R49 PolarHBondContact O-N 2.87Å
46	E	94.8	Very high	93.4	Very high	89 Å²	89	98.8 Å²	98.8	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-42.7	177.7	-68.8	-142.1	124.9	0	0	112.5	I42 M43 L48 R49 V50	I42-E46 HydrophobicContact CG2-CG 4.41Å; I42-E46 WeakPolarHBondContact O-CG 3.49Å; I42-E46 PolarHBondContact O-N 2.86Å; M43-E46 PolarHBondContact O-N 3.26Å; E46-L48 VanDerWaalsContact C-N 3.27Å; E46-L48 PolarHBondContact O-N 3.15Å; E46-R49 PolarHBondContact O-N 3.01Å; E46-R49 VanDerWaalsContact O-N 3.15Å; E46-R49 IonicContact OE1-CZ 3.79Å; E46-R49 IonicContact OE1-NH1 3.34Å; E46-R49 IonicContact OE1-NH2 3.71Å; E46-R49 PolarHBondContact OE1-NH2 2.64Å; E46-V50 WeakPolarHBondContact O-CG2 3.45Å; E46-V50 PolarHBondContact O-N 2.87Å
47	V	94.8	Very high	93.7	Very high	92 Å²	92	100.3 Å²	100.3	56%	0.558	51%	0.513	S	S	*	.	H	α-helix	trans	-58.2	-43.1	175.6	169.2	0	0	0	0	110.4	M43 T51	M43-V47 WeakPolarHBondContact O-CB 3.37Å; M43-V47 VanDerWaalsContact O-CG2 3.24Å; M43-V47 WeakPolarHBondContact O-CG2 3.48Å; M43-V47 PolarHBondContact O-N 3.36Å; V47-T51 VanDerWaalsContact O-CB 3.29Å; V47-T51 WeakPolarHBondContact O-CB 3.37Å; V47-T51 PolarHBondContact O-N 3.35Å; V47-T51 PolarHBondContact O-OG1 3.39Å
48	L	94.1	Very high	94.1	Very high	115 Å²	115	100.8 Å²	100.8	60%	0.602	51%	0.51	S	S	*	.	H	α-helix	trans	-65.5	-42.1	176.5	-72.2	167.5	0	0	0	112.1	K44 S45 E46 T51 H52	K44-L48 VanDerWaalsContact O-CG 3.3Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 3.05Å; S45-L48 PolarHBondContact O-N 2.95Å; E46-L48 VanDerWaalsContact C-N 3.27Å; E46-L48 PolarHBondContact O-N 3.15Å; L48-T51 PolarHBondContact O-N 2.75Å; L48-H52 WeakPolarHBondContact O-CB 3.18Å; L48-H52 PolarHBondContact O-N 2.97Å
49	R	95.3	Very high	94.4	Very high	128 Å²	128	101.5 Å²	101.5	48%	0.483	51%	0.509	S	S	.	.	H	α-helix	trans	-59.7	-53.1	176.2	-174.8	-179.2	73.2	-142.7	-6.4	111.2	S45 E46 T51 H52 E53	S45-R49 PolarHBondContact O-N 2.87Å; E46-R49 PolarHBondContact O-N 3.01Å; E46-R49 VanDerWaalsContact O-N 3.15Å; E46-R49 IonicContact OE1-CZ 3.79Å; E46-R49 IonicContact OE1-NH1 3.34Å; E46-R49 IonicContact OE1-NH2 3.71Å; E46-R49 PolarHBondContact OE1-NH2 2.64Å; R49-T51 VanDerWaalsContact C-N 3.3Å; R49-T51 PolarHBondContact O-N 3.42Å; R49-H52 PolarHBondContact O-N 3.45Å; R49-E53 WeakPolarHBondContact O-CG 3.47Å; R49-E53 PolarHBondContact O-N 3.49Å
50	V	95.8	Very high	94.5	Very high	76 Å²	76	103.4 Å²	103.4	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-39.4	-180	174.3	0	0	0	0	111	E46 H52 E53 L54	E46-V50 WeakPolarHBondContact O-CG2 3.45Å; E46-V50 PolarHBondContact O-N 2.87Å; V50-H52 VanDerWaalsContact C-N 3.35Å; V50-H52 PolarHBondContact O-N 3.3Å; V50-E53 PolarHBondContact O-N 2.86Å; V50-L54 WeakPolarHBondContact O-CB 3.44Å; V50-L54 PolarHBondContact O-N 2.92Å
51	T	95.9	Very high	94.7	Very high	84 Å²	84	103.7 Å²	103.7	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177.7	-55.8	0	0	0	0	111.3	V47 L48 R49 Q55	V47-T51 VanDerWaalsContact O-CB 3.29Å; V47-T51 WeakPolarHBondContact O-CB 3.37Å; V47-T51 PolarHBondContact O-N 3.35Å; V47-T51 PolarHBondContact O-OG1 3.39Å; L48-T51 PolarHBondContact O-N 2.75Å; R49-T51 VanDerWaalsContact C-N 3.3Å; R49-T51 PolarHBondContact O-N 3.42Å; T51-Q55 WeakPolarHBondContact O-CB 3.49Å; T51-Q55 PolarHBondContact O-N 3.03Å
52	H	95.8	Very high	95	Very high	144 Å²	144	102 Å²	102	67%	0.667	51%	0.51	S	S	*	.	H	α-helix	trans	-67.5	-43.4	176.9	-174.3	-85.2	0	0	0	112.2	L48 R49 V50 L54 Q55 A56	L48-H52 WeakPolarHBondContact O-CB 3.18Å; L48-H52 PolarHBondContact O-N 2.97Å; R49-H52 PolarHBondContact O-N 3.45Å; V50-H52 VanDerWaalsContact C-N 3.35Å; V50-H52 PolarHBondContact O-N 3.3Å; H52-L54 PolarHBondContact O-N 3.47Å; H52-Q55 PolarHBondContact O-N 3.25Å; H52-A56 WeakPolarHBondContact O-CB 3.46Å; H52-A56 PolarHBondContact O-N 3.01Å
53	E	96.1	Very high	95.1	Very high	95 Å²	95	101.8 Å²	101.8	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-61	-43.6	175.2	-74.6	174.7	-176	0	0	111.9	R49 V50 Q55 A56 M57	R49-E53 WeakPolarHBondContact O-CG 3.47Å; R49-E53 PolarHBondContact O-N 3.49Å; V50-E53 PolarHBondContact O-N 2.86Å; E53-Q55 VanDerWaalsContact C-N 3.32Å; E53-Q55 PolarHBondContact O-N 3.02Å; E53-A56 PolarHBondContact O-N 3.41Å; E53-M57 WeakPolarHBondContact O-CG 3.45Å; E53-M57 PolarHBondContact O-N 2.92Å
54	L	95.8	Very high	95.1	Very high	89 Å²	89	101.2 Å²	101.2	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-39.1	177.6	-174.2	136.1	0	0	0	111.7	V50 H52 K58	V50-L54 WeakPolarHBondContact O-CB 3.44Å; V50-L54 PolarHBondContact O-N 2.92Å; H52-L54 PolarHBondContact O-N 3.47Å; L54-K58 HydrophobicContact CD2-CD 4Å; L54-K58 WeakPolarHBondContact O-CB 3.34Å; L54-K58 WeakPolarHBondContact O-CG 3.43Å; L54-K58 PolarHBondContact O-N 3.2Å
55	Q	95.6	Very high	95	Very high	91 Å²	91	97.8 Å²	97.8	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-46.8	174.7	-174.4	57.3	34.2	0	0	111.4	T51 H52 E53 M57 K58 D59	T51-Q55 WeakPolarHBondContact O-CB 3.49Å; T51-Q55 PolarHBondContact O-N 3.03Å; H52-Q55 PolarHBondContact O-N 3.25Å; E53-Q55 VanDerWaalsContact C-N 3.32Å; E53-Q55 PolarHBondContact O-N 3.02Å; Q55-M57 VanDerWaalsContact C-N 3.33Å; Q55-M57 PolarHBondContact O-N 3.15Å; Q55-K58 WeakPolarHBondContact O-CB 3.49Å; Q55-K58 PolarHBondContact O-N 3.39Å; Q55-K58 VanDerWaalsContact O-N 3.15Å; Q55-D59 PolarHBondContact NE2-OD1 3.29Å; Q55-D59 PolarHBondContact NE2-OD2 3.47Å; Q55-D59 PolarHBondContact O-N 3.03Å
56	A	96.2	Very high	94.9	Very high	42 Å²	42	100.7 Å²	100.7	35%	0.347	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-40.2	177.7	0	0	0	0	0	112.4	H52 E53 D59 K60	H52-A56 WeakPolarHBondContact O-CB 3.46Å; H52-A56 PolarHBondContact O-N 3.01Å; E53-A56 PolarHBondContact O-N 3.41Å; A56-D59 PolarHBondContact O-N 3.33Å; A56-K60 WeakPolarHBondContact O-CG 3.41Å; A56-K60 PolarHBondContact O-N 2.88Å; A56-K60 VanDerWaalsContact O-N 3.11Å
57	M	95.4	Very high	94.6	Very high	125 Å²	125	101.6 Å²	101.6	62%	0.616	51%	0.505	S	S	*	.	H	α-helix	trans	-65.5	-40.6	174.5	-73.1	-164.8	-168.6	0	0	112	E53 Q55 D59 K60 I61	E53-M57 WeakPolarHBondContact O-CG 3.45Å; E53-M57 PolarHBondContact O-N 2.92Å; Q55-M57 VanDerWaalsContact C-N 3.33Å; Q55-M57 PolarHBondContact O-N 3.15Å; M57-D59 VanDerWaalsContact C-N 3.33Å; M57-D59 PolarHBondContact O-N 2.93Å; M57-K60 PolarHBondContact O-N 3.3Å; M57-I61 VanDerWaalsContact O-CG1 3.27Å; M57-I61 WeakPolarHBondContact O-CG1 3.45Å; M57-I61 PolarHBondContact O-N 3.44Å
58	K	95.8	Very high	94.2	Very high	107 Å²	107	100.9 Å²	100.9	47%	0.465	50%	0.497	S	S	.	.	H	α-helix	trans	-60.3	-42.4	176.1	-81.5	177	176.6	176.8	0	112.3	L54 Q55 I61 K62	L54-K58 HydrophobicContact CD2-CD 4Å; L54-K58 WeakPolarHBondContact O-CB 3.34Å; L54-K58 WeakPolarHBondContact O-CG 3.43Å; L54-K58 PolarHBondContact O-N 3.2Å; Q55-K58 WeakPolarHBondContact O-CB 3.49Å; Q55-K58 PolarHBondContact O-N 3.39Å; Q55-K58 VanDerWaalsContact O-N 3.15Å; K58-I61 PolarHBondContact O-N 3.46Å; K58-K62 WeakPolarHBondContact O-CG 3.27Å; K58-K62 PolarHBondContact O-N 3.01Å
59	D	95.1	Very high	93.9	Very high	71 Å²	71	103.2 Å²	103.2	38%	0.38	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-38.8	-179.2	-65.4	-29.6	0	0	0	111.2	Q55 A56 M57 I61 K62 E63	Q55-D59 PolarHBondContact NE2-OD1 3.29Å; Q55-D59 PolarHBondContact NE2-OD2 3.47Å; Q55-D59 PolarHBondContact O-N 3.03Å; A56-D59 PolarHBondContact O-N 3.33Å; M57-D59 VanDerWaalsContact C-N 3.33Å; M57-D59 PolarHBondContact O-N 2.93Å; D59-I61 PolarHBondContact O-N 3.36Å; D59-K62 PolarHBondContact O-N 3.11Å; D59-E63 PolarHBondContact O-N 2.99Å
60	K	95.8	Very high	93.5	Very high	139 Å²	139	102 Å²	102	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-61.2	-41.4	170.6	-73.6	-178.8	-179.9	-177.5	0	113	A56 M57 K62 E63 N64	A56-K60 WeakPolarHBondContact O-CG 3.41Å; A56-K60 PolarHBondContact O-N 2.88Å; A56-K60 VanDerWaalsContact O-N 3.11Å; M57-K60 PolarHBondContact O-N 3.3Å; K60-K62 VanDerWaalsContact C-N 3.35Å; K60-E63 PolarHBondContact O-N 3.17Å; K60-N64 WeakPolarHBondContact O-CB 3.37Å; K60-N64 VanDerWaalsContact O-CG 3.24Å; K60-N64 PolarHBondContact O-N 3.31Å; K60-N64 PolarHBondContact O-ND2 2.66Å
61	I	95.1	Very high	92.8	Very high	105 Å²	105	103.3 Å²	103.3	54%	0.538	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-46	176.8	-70.6	164.9	0	0	0	109.8	M57 K58 D59 E63 N64 T65	M57-I61 VanDerWaalsContact O-CG1 3.27Å; M57-I61 WeakPolarHBondContact O-CG1 3.45Å; M57-I61 PolarHBondContact O-N 3.44Å; K58-I61 PolarHBondContact O-N 3.46Å; D59-I61 PolarHBondContact O-N 3.36Å; I61-E63 PolarHBondContact O-N 3.36Å; I61-N64 PolarHBondContact O-N 2.95Å; I61-T65 HydrophobicContact CG2-CG2 4.31Å; I61-T65 WeakPolarHBondContact O-CG2 3.29Å; I61-T65 PolarHBondContact O-N 3.5Å; I61-T65 PolarHBondContact O-OG1 3.39Å
62	K	95.4	Very high	92.2	Very high	125 Å²	125	103 Å²	103	54%	0.543	51%	0.505	S	S	.	.	H	α-helix	trans	-58.1	-50.6	177.1	-74.2	176.3	-179	173.6	0	111.7	K58 D59 K60 N64 T65 E66	K58-K62 WeakPolarHBondContact O-CG 3.27Å; K58-K62 PolarHBondContact O-N 3.01Å; D59-K62 PolarHBondContact O-N 3.11Å; K60-K62 VanDerWaalsContact C-N 3.35Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 2.71Å; K62-T65 WeakPolarHBondContact CA-OG1 3.34Å; K62-T65 PolarHBondContact O-N 3.16Å; K62-T65 PolarHBondContact O-OG1 3.45Å; K62-E66 PolarHBondContact O-N 3.02Å
63	E	94.9	Very high	91.6	Very high	100 Å²	100	100.4 Å²	100.4	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-58	-44.3	178.6	-168.7	-169.3	157.9	0	0	111.7	D59 K60 I61 E66 K67	D59-E63 PolarHBondContact O-N 2.99Å; K60-E63 PolarHBondContact O-N 3.17Å; I61-E63 PolarHBondContact O-N 3.36Å; E63-E66 PolarHBondContact O-N 3.37Å; E63-K67 WeakPolarHBondContact O-CG 3.45Å; E63-K67 PolarHBondContact O-N 3.28Å; E63-K67 VanDerWaalsContact O-N 3.09Å; E63-K67 VanDerWaalsContact OE1-CE 3.29Å; E63-K67 WeakPolarHBondContact OE1-CE 3.39Å; E63-K67 IonicContact OE1-NZ 2.65Å; E63-K67 PolarHBondContact OE1-NZ 2.87Å
64	N	92.1	Very high	91	Very high	85 Å²	85	102.2 Å²	102.2	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-40.1	177.7	-72.9	-18.2	0	0	0	112.3	K60 I61 K62 E66 K67 I68	K60-N64 WeakPolarHBondContact O-CB 3.37Å; K60-N64 VanDerWaalsContact O-CG 3.24Å; K60-N64 PolarHBondContact O-N 3.31Å; K60-N64 PolarHBondContact O-ND2 2.66Å; I61-N64 PolarHBondContact O-N 2.95Å; K62-N64 VanDerWaalsContact C-N 3.31Å; K62-N64 PolarHBondContact O-N 2.71Å; N64-E66 VanDerWaalsContact C-N 3.32Å; N64-E66 PolarHBondContact O-N 3.09Å; N64-K67 PolarHBondContact O-N 3.14Å; N64-I68 VanDerWaalsContact O-CG1 3.3Å; N64-I68 WeakPolarHBondContact O-CG1 3.37Å; N64-I68 PolarHBondContact O-N 3.01Å
65	T	92.2	Very high	90.6	Very high	76 Å²	76	101.9 Å²	101.9	47%	0.466	52%	0.515	S	S	.	.	H	α-helix	trans	-64.9	-35.6	177.1	53	0	0	0	0	112.5	I61 K62 I68 K69	I61-T65 HydrophobicContact CG2-CG2 4.31Å; I61-T65 WeakPolarHBondContact O-CG2 3.29Å; I61-T65 PolarHBondContact O-N 3.5Å; I61-T65 PolarHBondContact O-OG1 3.39Å; K62-T65 WeakPolarHBondContact CA-OG1 3.34Å; K62-T65 PolarHBondContact O-N 3.16Å; K62-T65 PolarHBondContact O-OG1 3.45Å; T65-I68 PolarHBondContact O-N 3.45Å; T65-K69 WeakPolarHBondContact O-CB 3.44Å; T65-K69 PolarHBondContact O-N 3.18Å
66	E	91.3	Very high	90.3	Very high	136 Å²	136	99.6 Å²	99.6	64%	0.636	50%	0.503	S	S	*	.	H	α-helix	trans	-66.1	-44.7	173.9	-72.8	-175.5	165.8	0	0	111.5	K62 E63 N64 I68 K69 V70	K62-E66 PolarHBondContact O-N 3.02Å; E63-E66 PolarHBondContact O-N 3.37Å; N64-E66 VanDerWaalsContact C-N 3.32Å; N64-E66 PolarHBondContact O-N 3.09Å; E66-I68 VanDerWaalsContact C-N 3.34Å; E66-I68 PolarHBondContact O-N 3.3Å; E66-K69 WeakPolarHBondContact O-CB 3.3Å; E66-K69 PolarHBondContact O-N 3.38Å; E66-K69 VanDerWaalsContact O-N 3.14Å; E66-V70 WeakPolarHBondContact O-CG2 3.43Å; E66-V70 PolarHBondContact O-N 3.48Å
67	K	87.6	Confident	90.1	Very high	109 Å²	109	99.2 Å²	99.2	47%	0.474	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-43.8	174.7	-70.5	174.2	-175	168.7	0	112.2	E63 N64 K69 V70 N71	E63-K67 WeakPolarHBondContact O-CG 3.45Å; E63-K67 PolarHBondContact O-N 3.28Å; E63-K67 VanDerWaalsContact O-N 3.09Å; E63-K67 VanDerWaalsContact OE1-CE 3.29Å; E63-K67 WeakPolarHBondContact OE1-CE 3.39Å; E63-K67 IonicContact OE1-NZ 2.65Å; E63-K67 PolarHBondContact OE1-NZ 2.87Å; N64-K67 PolarHBondContact O-N 3.14Å; K67-K69 VanDerWaalsContact C-N 3.32Å; K67-K69 PolarHBondContact O-N 3.1Å; K67-V70 PolarHBondContact O-N 2.95Å; K67-N71 PolarHBondContact O-N 3.47Å
68	I	87.8	Confident	90	Very high	76 Å²	76	95.8 Å²	95.8	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-41.8	175.9	-68.1	166.7	0	0	0	110.4	N64 T65 E66 V70 N71 K72 L127	N64-I68 VanDerWaalsContact O-CG1 3.3Å; N64-I68 WeakPolarHBondContact O-CG1 3.37Å; N64-I68 PolarHBondContact O-N 3.01Å; T65-I68 PolarHBondContact O-N 3.45Å; E66-I68 VanDerWaalsContact C-N 3.34Å; E66-I68 PolarHBondContact O-N 3.3Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.43Å; I68-N71 CarbonylContact O-C 3.58Å; I68-N71 PolarHBondContact O-N 3.47Å; I68-K72 VanDerWaalsContact O-CB 3.27Å; I68-K72 WeakPolarHBondContact O-CB 3.22Å; I68-K72 PolarHBondContact O-N 2.93Å; I68-L127 HydrophobicContact CG2-CD1 4.21Å; I68-L127 HydrophobicContact CG2-CD2 4.24Å
69	K	88	Confident	89.8	Confident	165 Å²	165	90.7 Å²	90.7	72%	0.717	46%	0.459	S	S	*	.	H	α-helix	trans	-63.2	-38.7	179.7	-170.3	-179.9	-179.6	-176.7	0	112.5	T65 E66 K67 N71 K72 T73	T65-K69 WeakPolarHBondContact O-CB 3.44Å; T65-K69 PolarHBondContact O-N 3.18Å; E66-K69 WeakPolarHBondContact O-CB 3.3Å; E66-K69 PolarHBondContact O-N 3.38Å; E66-K69 VanDerWaalsContact O-N 3.14Å; K67-K69 VanDerWaalsContact C-N 3.32Å; K67-K69 PolarHBondContact O-N 3.1Å; K69-N71 VanDerWaalsContact C-N 3.35Å; K69-K72 CarbonylContact O-C 3.45Å; K69-K72 PolarHBondContact O-N 3.44Å; K69-T73 PolarHBondContact O-N 2.54Å
70	V	85	Confident	89.8	Confident	101 Å²	101	90.9 Å²	90.9	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-64.3	-40.3	174.7	174.8	0	0	0	0	111	E66 K67 I68 K72 T73	E66-V70 WeakPolarHBondContact O-CG2 3.43Å; E66-V70 PolarHBondContact O-N 3.48Å; K67-V70 PolarHBondContact O-N 2.95Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.43Å; V70-K72 VanDerWaalsContact C-N 3.33Å; V70-T73 WeakPolarHBondContact O-CG2 3.32Å; V70-T73 PolarHBondContact O-N 2.81Å; V70-T73 PolarHBondContact O-OG1 3.19Å; V70-T73 VanDerWaalsContact O-OG1 3.1Å
71	N	81.1	Confident	89.7	Confident	105 Å²	105	84.3 Å²	84.3	56%	0.561	43%	0.431	S	S	*	.	H	α-helix	trans	-74.5	-24.7	175.8	-72.9	-21.1	0	0	0	113.2	K67 I68 K69 T73	K67-N71 PolarHBondContact O-N 3.47Å; I68-N71 CarbonylContact O-C 3.58Å; I68-N71 PolarHBondContact O-N 3.47Å; K69-N71 VanDerWaalsContact C-N 3.35Å; N71-T73 PolarHBondContact O-N 2.71Å
72	K	83.8	Confident	89.5	Confident	76 Å²	76	82.8 Å²	82.8	33%	0.33	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	24.9	174.8	-167.8	165.8	-179.1	177.7	0	111.5	I68 K69 V70 Y76 E150	I68-K72 VanDerWaalsContact O-CB 3.27Å; I68-K72 WeakPolarHBondContact O-CB 3.22Å; I68-K72 PolarHBondContact O-N 2.93Å; K69-K72 CarbonylContact O-C 3.45Å; K69-K72 PolarHBondContact O-N 3.44Å; V70-K72 VanDerWaalsContact C-N 3.33Å; K72-Y76 HydrophobicContact CG-CE1 4.36Å; K72-Y76 WeakPolarHBondContact CG-OH 3.18Å; K72-Y76 PolarHBondContact O-OH 3.44Å; K72-E150 WeakPolarHBondContact CE-OE2 3.01Å; K72-E150 IonicContact NZ-OE2 2.78Å; K72-E150 PolarHBondContact NZ-OE2 3.36Å
73	T	82.8	Confident	89.4	Confident	90 Å²	90	81.8 Å²	81.8	55%	0.552	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-73.5	134.6	173.5	50.2	0	0	0	0	111.4	K69 V70 N71 Y76	K69-T73 PolarHBondContact O-N 2.54Å; V70-T73 WeakPolarHBondContact O-CG2 3.32Å; V70-T73 PolarHBondContact O-N 2.81Å; V70-T73 PolarHBondContact O-OG1 3.19Å; V70-T73 VanDerWaalsContact O-OG1 3.1Å; N71-T73 PolarHBondContact O-N 2.71Å; T73-Y76 VanDerWaalsContact O-CE1 3.32Å; T73-Y76 WeakPolarHBondContact O-CE1 3.27Å
74	L	84.1	Confident	89.1	Confident	133 Å²	133	79 Å²	79	70%	0.696	41%	0.409	S	S	*	.	S	Bend	trans	-60.9	145.6	165.8	-70.2	166	0	0	0	109.2	Y76	L74-Y76 HydrophobicContact CD2-CD2 3.74Å; L74-Y76 HydrophobicContact CD2-CE2 3.53Å; L74-Y76 HydrophobicContact CD2-CG 4.35Å; L74-Y76 HydrophobicContact CG-CE2 4.35Å
75	P	88.2	Confident	88.9	Confident	83 Å²	83	77.8 Å²	77.8	54%	0.539	40%	0.402	S	S	.	.	P	Polyproline II helix	cis	-96.4	139.2	11.9	33.4	-34.7	0	0	0	115.7	K143	P75-K143 HydrophobicContact CG-CD 4.42Å; P75-K143 VanDerWaalsContact O-CE 3.31Å; P75-K143 WeakPolarHBondContact O-CE 3.46Å
76	Y	88.9	Confident	88.4	Confident	43 Å²	43	79.4 Å²	79.4	17%	0.169	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-90.6	158.9	169.9	-43.7	-47.9	0	0	0	112.3	K72 T73 L74 L149	K72-Y76 HydrophobicContact CG-CE1 4.36Å; K72-Y76 WeakPolarHBondContact CG-OH 3.18Å; K72-Y76 PolarHBondContact O-OH 3.44Å; T73-Y76 VanDerWaalsContact O-CE1 3.32Å; T73-Y76 WeakPolarHBondContact O-CE1 3.27Å; L74-Y76 HydrophobicContact CD2-CD2 3.74Å; L74-Y76 HydrophobicContact CD2-CE2 3.53Å; L74-Y76 HydrophobicContact CD2-CG 4.35Å; L74-Y76 HydrophobicContact CG-CE2 4.35Å; Y76-L149 HydrophobicContact CD1-CD1 3.37Å; Y76-L149 HydrophobicContact CE1-CD1 3.44Å; Y76-L149 VanDerWaalsContact CE1-CD1 3.44Å; Y76-L149 HydrophobicContact CG-CD1 4.25Å
77	L	91.2	Very high	87.6	Confident	34 Å²	34	76 Å²	76	18%	0.178	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.6	167.4	-177.8	61.9	0	0	0	109.3	T114 V141 K143 Y146	L77-T114 HydrophobicContact CD2-CG2 3.71Å; L77-V141 PolarHBondContact N-O 3.14Å; L77-V141 WeakPolarHBondContact O-CA 3.37Å; L77-V141 WeakPolarHBondContact O-CB 3.47Å; L77-V141 PolarHBondContact O-N 3.24Å; L77-K143 HydrophobicContact CB-CG 4.18Å; L77-Y146 HydrophobicContact CD2-CE1 4.22Å
78	V	92.9	Very high	86.7	Confident	53 Å²	53	76.7 Å²	76.7	32%	0.321	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	133.8	176.4	-176.8	0	0	0	0	109.7	S115 L138 L152	V78-S115 WeakPolarHBondContact O-CB 3.41Å; V78-S115 PolarHBondContact O-N 3.09Å; V78-S115 PolarHBondContact O-OG 3.42Å; V78-L138 HydrophobicContact CG1-CD2 3.54Å; V78-L152 HydrophobicContact CB-CD1 4.46Å; V78-L152 HydrophobicContact CG1-CD1 4.02Å; V78-L152 HydrophobicContact CG2-CD1 3.89Å
79	S	93.4	Very high	85.7	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.6	179	-54.2	0	0	0	0	110.9	K113 T114 V139	S79-K113 CarbonylContact C-O 3.59Å; S79-K113 VanDerWaalsContact CA-O 3.3Å; S79-K113 WeakPolarHBondContact CA-O 3.37Å; S79-K113 WeakPolarHBondContact CB-O 3.44Å; S79-T114 WeakPolarHBondContact OG-CA 3.48Å; S79-V139 PolarHBondContact N-O 2.72Å; S79-V139 WeakPolarHBondContact O-CG2 3.46Å; S79-V139 PolarHBondContact O-N 3.02Å
80	N	93.7	Very high	84.3	Confident	75 Å²	75	74 Å²	74	40%	0.401	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	136.6	173.1	-68	-2.1	0	0	0	109.9	I82 I112 K113 D137 L138	N80-I82 PolarHBondContact O-N 3.42Å; N80-I112 CarbonylContact O-C 3.59Å; N80-I112 WeakPolarHBondContact O-CA 3.46Å; N80-K113 PolarHBondContact N-O 2.77Å; N80-K113 PolarHBondContact O-N 2.99Å; N80-D137 WeakPolarHBondContact CA-O 3.41Å; N80-L138 WeakPolarHBondContact OD1-CD2 3.4Å
81	V	93.4	Very high	82.8	Confident	1 Å²	1	77.1 Å²	77.1	1%	0.006	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120.1	169.9	-176.7	0	0	0	0	108.2	L84 I112 L133 G136 D137 V139	V81-L84 HydrophobicContact CG1-CD2 4.37Å; V81-L84 HydrophobicContact CG1-CG 4.38Å; V81-I112 HydrophobicContact CG2-CG2 4.45Å; V81-L133 HydrophobicContact CG2-CD2 4.4Å; V81-G136 PolarHBondContact O-N 2.85Å; V81-D137 PolarHBondContact N-O 3.02Å; V81-V139 HydrophobicContact CG2-CG1 3.89Å; V81-V139 HydrophobicContact CG2-CG2 3.92Å
82	I	92.7	Very high	81.4	Confident	73 Å²	73	81 Å²	81	37%	0.374	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-52.2	177.4	-59.4	167.1	0	0	0	109.4	N80 V111 K113 T119 P135	N80-I82 PolarHBondContact O-N 3.42Å; I82-V111 HydrophobicContact CB-CB 4.47Å; I82-V111 HydrophobicContact CB-CG1 4.37Å; I82-V111 HydrophobicContact CD1-CG1 3.87Å; I82-V111 PolarHBondContact N-O 3.39Å; I82-K113 HydrophobicContact CD1-CB 3.62Å; I82-K113 HydrophobicContact CD1-CD 4.39Å; I82-K113 HydrophobicContact CD1-CG 4.47Å; I82-K113 HydrophobicContact CG1-CB 3.85Å; I82-T119 HydrophobicContact CD1-CG2 3.85Å; I82-P135 WeakPolarHBondContact O-CB 3.27Å
83	E	91.4	Very high	80.1	Confident	103 Å²	103	83 Å²	83	48%	0.481	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	148.7	-171.4	-168.8	169.8	-168.5	0	0	110.1	L85 V111	E83-L85 HydrophobicContact CG-CD2 4.2Å; E83-L85 HydrophobicContact CG-CG 4.4Å; E83-V111 PolarHBondContact O-N 2.85Å
84	L	89.4	Confident	78.5	Confident	43 Å²	43	87.6 Å²	87.6	23%	0.225	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.2	170.3	-67.5	166	0	0	0	107	V81 C109 A110 I125 L133	V81-L84 HydrophobicContact CG1-CD2 4.37Å; V81-L84 HydrophobicContact CG1-CG 4.38Å; L84-C109 WeakPolarHBondContact CA-O 3.44Å; L84-A110 HydrophobicContact CD2-CB 3.95Å; L84-I125 HydrophobicContact CD2-CD1 4.45Å; L84-L133 HydrophobicContact CD1-CB 4.12Å; L84-L133 VanDerWaalsContact CD1-O 3.27Å; L84-L133 WeakPolarHBondContact CD1-O 3.27Å; L84-L133 HydrophobicContact CD2-CB 4.45Å
85	L	87.1	Confident	77	Confident	58 Å²	58	88.7 Å²	88.7	30%	0.304	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.3	-176.5	-66.5	166	0	0	0	108.5	E83 K108 C109 V111 F121	E83-L85 HydrophobicContact CG-CD2 4.2Å; E83-L85 HydrophobicContact CG-CG 4.4Å; L85-K108 CarbonylContact O-C 3.53Å; L85-C109 HydrophobicContact CB-CB 4.4Å; L85-C109 PolarHBondContact N-O 3.12Å; L85-C109 PolarHBondContact O-N 3.19Å; L85-V111 HydrophobicContact CD1-CG2 3.65Å; L85-V111 HydrophobicContact CG-CG2 4.5Å; L85-F121 HydrophobicContact CD1-CD2 4.45Å; L85-F121 HydrophobicContact CD1-CE2 4.1Å
86	D	82.8	Confident	75.3	Confident	111 Å²	111	88.5 Å²	88.5	59%	0.594	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	109.8	167.4	-63.8	-31.4	0	0	0	106.6	K108	D86-K108 VanDerWaalsContact OD1-CG 3.27Å; D86-K108 WeakPolarHBondContact OD1-CG 3.26Å
87	V	73.3	Confident	73.9	Confident	63 Å²	63	90.3 Å²	90.3	38%	0.382	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.2	177.8	-178.6	0	0	0	0	108.1	C109 F121	V87-C109 HydrophobicContact CG2-CB 4.21Å; V87-F121 HydrophobicContact CG2-CZ 4.34Å
88	D	69.4	Low	72.3	Confident	125 Å²	125	96.8 Å²	96.8	67%	0.668	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-86.1	134.4	167.1	-73.5	-43.1	0	0	0	109.3	N90	D88-N90 PolarHBondContact O-N 2.86Å
89	P	66.3	Low	70.4	Confident	35 Å²	35	97.7 Å²	97.7	23%	0.227	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-56.8	136.9	175.7	-22.8	31.8	0	0	0	111	D91 K106	P89-D91 PolarHBondContact O-N 2.81Å; P89-K106 HydrophobicContact CG-CG 3.86Å
90	N	58.5	Low	68.6	Low	149 Å²	149	103.9 Å²	103.9	80%	0.797	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-71.9	125.9	169	-107.4	-10.6	0	0	0	109.2	D88 Q92	D88-N90 PolarHBondContact O-N 2.86Å; N90-Q92 PolarHBondContact O-N 3.25Å
91	D	54.1	Low	66.9	Low	166 Å²	166	106.6 Å²	106.6	89%	0.888	58%	0.582	S	S	*	*	S	Bend	trans	-68.3	14.8	-179.7	-71.3	-38.2	0	0	0	115.1	P89	P89-D91 PolarHBondContact O-N 2.81Å
92	Q	52.7	Low	65	Low	186 Å²	186	110 Å²	110	87%	0.869	60%	0.6	S	S	*	*			trans	-112.1	77.4	-178.5	-66.8	-173.9	0.9	0	0	110.4	N90	N90-Q92 PolarHBondContact O-N 3.25Å
93	E	55.3	Low	63.2	Low	119 Å²	119	109.9 Å²	109.9	56%	0.556	61%	0.606	S	S	*	*			trans	-84	110.1	172.3	-63.4	-172.1	150.5	0	0	109.5	Q104	E93-Q104 PolarHBondContact OE1-NE2 3.46Å
94	E	49.9	Very low	61.5	Low	187 Å²	187	109.3 Å²	109.3	87%	0.874	60%	0.603	S	S	*	*			trans	-86.4	110.5	162.7	-85.5	-168.2	161.1	0	0	109.2	G96	E94-G96 PolarHBondContact O-N 2.83Å
95	D	52.8	Low	60.1	Low	156 Å²	156	113.3 Å²	113.3	83%	0.834	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	91.5	170.6	-84.3	-36.4	0	0	0	110.6
96	G	52.9	Low	59	Low	78 Å²	78	118.6 Å²	118.6	80%	0.804	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.9	-21	178.5	0	0	0	0	0	118.6	E94	E94-G96 PolarHBondContact O-N 2.83Å
97	A	58.3	Low	58.4	Low	82 Å²	82	115 Å²	115	68%	0.678	63%	0.625	S	S	*	*	S	Bend	trans	-146	142.9	174.5	0	0	0	0	0	108.7	I99	A97-I99 PolarHBondContact O-N 3.02Å
98	N	57.4	Low	58.8	Low	169 Å²	169	116.6 Å²	116.6	90%	0.904	63%	0.627	S	S	*	*			trans	-31.2	108.6	179	-93.2	-12.1	0	0	0	111.7	D100	N98-D100 PolarHBondContact O-N 3.19Å
99	I	53.5	Low	59.6	Low	73 Å²	73	111 Å²	111	37%	0.374	60%	0.598	S	S	.	*			trans	-68.7	116.6	179.4	-55.5	168.7	0	0	0	106.3	A97 L101 Q104	A97-I99 PolarHBondContact O-N 3.02Å; I99-L101 PolarHBondContact O-N 3.16Å; I99-L101 VanDerWaalsContact O-N 3.16Å; I99-Q104 HydrophobicContact CG2-CG 4.42Å
100	D	56.2	Low	60.7	Low	130 Å²	130	109.3 Å²	109.3	70%	0.695	59%	0.587	S	S	*	*			trans	-59.5	118.7	171.4	-82.5	-35.4	0	0	0	108	N98 D102 S103	N98-D100 PolarHBondContact O-N 3.19Å; D100-D102 PolarHBondContact O-N 3.22Å; D100-S103 PolarHBondContact O-N 2.95Å; D100-S103 PolarHBondContact O-OG 2.97Å
101	L	57.5	Low	62.3	Low	132 Å²	132	103.6 Å²	103.6	69%	0.691	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-10.3	176.9	-77.1	152.9	0	0	0	113.7	I99 R105	I99-L101 PolarHBondContact O-N 3.16Å; I99-L101 VanDerWaalsContact O-N 3.16Å; L101-R105 WeakPolarHBondContact O-CG 3.41Å
102	D	54.6	Low	64.2	Low	72 Å²	72	95.7 Å²	95.7	39%	0.385	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.4	174.5	-88.3	8.7	0	0	0	113.7	D100 Q104 R105 P123	D100-D102 PolarHBondContact O-N 3.22Å; D102-Q104 VanDerWaalsContact C-N 3.33Å; D102-R105 IonicContact OD1-CZ 3.54Å; D102-R105 VanDerWaalsContact OD1-CZ 3.24Å; D102-R105 IonicContact OD1-NE 3.51Å; D102-R105 PolarHBondContact OD1-NE 3.21Å; D102-R105 IonicContact OD1-NH2 2.75Å; D102-R105 PolarHBondContact OD1-NH2 3.18Å; D102-P123 WeakPolarHBondContact OD2-CG 3.31Å
103	S	54.9	Low	66.3	Low	70 Å²	70	91.6 Å²	91.6	49%	0.49	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-17.1	177.6	56.4	0	0	0	0	113.7	D100	D100-S103 PolarHBondContact O-N 2.95Å; D100-S103 PolarHBondContact O-OG 2.97Å
104	Q	53.8	Low	68.1	Low	91 Å²	91	86.1 Å²	86.1	43%	0.425	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.8	178.5	-68.3	-175	-13.4	0	0	113.8	E93 I99 D102 K106	E93-Q104 PolarHBondContact OE1-NE2 3.46Å; I99-Q104 HydrophobicContact CG2-CG 4.42Å; D102-Q104 VanDerWaalsContact C-N 3.33Å; Q104-K106 PolarHBondContact O-N 2.89Å
105	R	60.9	Low	70	Confident	127 Å²	127	81 Å²	81	48%	0.479	45%	0.454	S	S	.	.			trans	-78.6	108.4	-177.6	-70.8	-175	-154.2	-164.4	19.2	111	L101 D102 G107	L101-R105 WeakPolarHBondContact O-CG 3.41Å; D102-R105 IonicContact OD1-CZ 3.54Å; D102-R105 VanDerWaalsContact OD1-CZ 3.24Å; D102-R105 IonicContact OD1-NE 3.51Å; D102-R105 PolarHBondContact OD1-NE 3.21Å; D102-R105 IonicContact OD1-NH2 2.75Å; D102-R105 PolarHBondContact OD1-NH2 3.18Å; R105-G107 PolarHBondContact O-N 3.22Å
106	K	63.3	Low	71.8	Confident	169 Å²	169	77.3 Å²	77.3	74%	0.735	44%	0.437	S	S	*	.			trans	-68.1	108	156.4	-68.2	-176.5	178.9	-172.4	0	108	P89 Q104	P89-K106 HydrophobicContact CG-CG 3.86Å; Q104-K106 PolarHBondContact O-N 2.89Å
107	G	70.4	Confident	73.7	Confident	36 Å²	36	83.8 Å²	83.8	37%	0.371	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	161	-177.1	0	0	0	0	0	113.3	R105 C109	R105-G107 PolarHBondContact O-N 3.22Å; G107-C109 PolarHBondContact O-N 2.8Å
108	K	81.4	Confident	75.3	Confident	96 Å²	96	84.4 Å²	84.4	42%	0.417	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	121.6	171.9	-54.7	-152.1	164.3	174.3	0	108.9	L85 D86 I125 A130	L85-K108 CarbonylContact O-C 3.53Å; D86-K108 VanDerWaalsContact OD1-CG 3.27Å; D86-K108 WeakPolarHBondContact OD1-CG 3.26Å; K108-I125 HydrophobicContact CB-CD1 3.9Å; K108-I125 VanDerWaalsContact O-CD1 3.26Å; K108-I125 WeakPolarHBondContact O-CD1 3.22Å; K108-I125 WeakPolarHBondContact O-CG1 3.19Å; K108-A130 HydrophobicContact CB-CB 3.89Å; K108-A130 HydrophobicContact CD-CB 3.76Å; K108-A130 HydrophobicContact CG-CB 4.13Å
109	C	86.6	Confident	77.1	Confident	8 Å²	8	80.8 Å²	80.8	5%	0.054	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	158.5	170.7	-58	0	0	0	0	109.7	L84 L85 V87 G107 F121 L122	L84-C109 WeakPolarHBondContact CA-O 3.44Å; L85-C109 HydrophobicContact CB-CB 4.4Å; L85-C109 PolarHBondContact N-O 3.12Å; L85-C109 PolarHBondContact O-N 3.19Å; V87-C109 HydrophobicContact CG2-CB 4.21Å; G107-C109 PolarHBondContact O-N 2.8Å; C109-F121 HydrophobicContact CB-CE2 3.72Å; C109-F121 HydrophobicContact CB-CZ 3.75Å; C109-L122 WeakPolarHBondContact CA-O 3.45Å; C109-L122 WeakPolarHBondContact CB-O 3.49Å
110	A	89.9	Confident	78.9	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.9	177.7	0	0	0	0	0	111	L84 L122 I125	L84-A110 HydrophobicContact CD2-CB 3.95Å; A110-L122 PolarHBondContact N-O 2.73Å; A110-L122 WeakPolarHBondContact O-CB 3.38Å; A110-L122 PolarHBondContact O-N 3.41Å; A110-I125 HydrophobicContact CB-CG1 4.11Å
111	V	92.8	Very high	80.6	Confident	29 Å²	29	79.2 Å²	79.2	18%	0.176	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.7	166.7	-176.5	0	0	0	0	107.7	I82 E83 L85 F121	I82-V111 HydrophobicContact CB-CB 4.47Å; I82-V111 HydrophobicContact CB-CG1 4.37Å; I82-V111 HydrophobicContact CD1-CG1 3.87Å; I82-V111 PolarHBondContact N-O 3.39Å; E83-V111 PolarHBondContact O-N 2.85Å; L85-V111 HydrophobicContact CD1-CG2 3.65Å; L85-V111 HydrophobicContact CG-CG2 4.5Å; V111-F121 HydrophobicContact CG2-CD2 4.1Å
112	I	94.1	Very high	82	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	146.2	177.8	61.6	161.6	0	0	0	110.9	N80 V81 T119 Y120 L122 V141 I148	N80-I112 CarbonylContact O-C 3.59Å; N80-I112 WeakPolarHBondContact O-CA 3.46Å; V81-I112 HydrophobicContact CG2-CG2 4.45Å; I112-T119 CarbonylContact O-C 3.55Å; I112-T119 VanDerWaalsContact O-CA 3.3Å; I112-T119 WeakPolarHBondContact O-CA 3.19Å; I112-Y120 PolarHBondContact N-O 3.05Å; I112-Y120 PolarHBondContact O-N 2.89Å; I112-L122 HydrophobicContact CB-CD1 4.39Å; I112-L122 HydrophobicContact CD1-CD1 3.61Å; I112-L122 HydrophobicContact CD1-CG 4.49Å; I112-L122 HydrophobicContact CG1-CD1 3.67Å; I112-L122 HydrophobicContact CG1-CG 4.4Å; I112-L122 HydrophobicContact CG2-CD1 3.85Å; I112-V141 HydrophobicContact CD1-CG1 3.93Å; I112-V141 HydrophobicContact CD1-CG2 3.88Å; I112-I148 HydrophobicContact CG2-CD1 4.02Å; I112-I148 HydrophobicContact CG2-CG1 4.44Å
113	K	94.9	Very high	83.3	Confident	99 Å²	99	72.3 Å²	72.3	43%	0.43	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.2	168.6	-167.4	170.2	-176.1	172.6	0	109.4	S79 N80 I82 Q118 T119	S79-K113 CarbonylContact C-O 3.59Å; S79-K113 VanDerWaalsContact CA-O 3.3Å; S79-K113 WeakPolarHBondContact CA-O 3.37Å; S79-K113 WeakPolarHBondContact CB-O 3.44Å; N80-K113 PolarHBondContact N-O 2.77Å; N80-K113 PolarHBondContact O-N 2.99Å; I82-K113 HydrophobicContact CD1-CB 3.62Å; I82-K113 HydrophobicContact CD1-CD 4.39Å; I82-K113 HydrophobicContact CD1-CG 4.47Å; I82-K113 HydrophobicContact CG1-CB 3.85Å; K113-Q118 CarbonylContact C-O 3.59Å; K113-Q118 WeakPolarHBondContact CA-O 3.39Å; K113-T119 HydrophobicContact CB-CG2 4.3Å; K113-T119 HydrophobicContact CD-CG2 4.33Å; K113-T119 HydrophobicContact CG-CG2 4.05Å
114	T	93.2	Very high	84.7	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	160.3	177.7	60.3	0	0	0	0	111.4	L77 S79 T116 R117 Q118 Y120 Y146	L77-T114 HydrophobicContact CD2-CG2 3.71Å; S79-T114 WeakPolarHBondContact OG-CA 3.48Å; T114-T116 PolarHBondContact O-N 2.93Å; T114-T116 VanDerWaalsContact O-N 3.15Å; T114-T116 PolarHBondContact OG1-OG1 2.79Å; T114-R117 WeakPolarHBondContact O-CA 3.47Å; T114-R117 PolarHBondContact O-N 2.79Å; T114-Q118 PolarHBondContact N-O 2.87Å; T114-Q118 PolarHBondContact OG1-N 2.84Å; T114-Q118 PolarHBondContact OG1-O 2.99Å; T114-Q118 VanDerWaalsContact OG1-O 3.14Å; T114-Y120 HydrophobicContact CG2-CD2 3.7Å; T114-Y120 HydrophobicContact CG2-CE2 3.71Å; T114-Y146 HydrophobicContact CG2-CD1 4.18Å; T114-Y146 HydrophobicContact CG2-CE1 4.22Å
115	S	89.5	Confident	86	Confident	79 Å²	79	68 Å²	68	55%	0.552	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.7	169.7	-64.2	0	0	0	0	113.3	V78 R117	V78-S115 WeakPolarHBondContact O-CB 3.41Å; V78-S115 PolarHBondContact O-N 3.09Å; V78-S115 PolarHBondContact O-OG 3.42Å; S115-R117 PolarHBondContact O-N 2.98Å
116	T	91.6	Very high	87.2	Confident	79 Å²	79	63.8 Å²	63.8	49%	0.485	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	7.1	172.6	57.5	0	0	0	0	113.6	T114 Q118	T114-T116 PolarHBondContact O-N 2.93Å; T114-T116 VanDerWaalsContact O-N 3.15Å; T114-T116 PolarHBondContact OG1-OG1 2.79Å; T116-Q118 PolarHBondContact O-N 2.98Å; T116-Q118 PolarHBondContact OG1-OE1 3.27Å
117	R	91.8	Very high	88.3	Confident	214 Å²	214	60.1 Å²	60.1	81%	0.808	32%	0.32	S	S	*	.	S	Bend	trans	65.1	18.5	-179.8	-51.8	177.6	-179.5	176.9	-0.1	114.5	T114 S115	T114-R117 WeakPolarHBondContact O-CA 3.47Å; T114-R117 PolarHBondContact O-N 2.79Å; S115-R117 PolarHBondContact O-N 2.98Å
118	Q	93.1	Very high	89.2	Confident	95 Å²	95	59.4 Å²	59.4	44%	0.444	31%	0.308	S	S	.	.			trans	-92.9	145.5	173.7	-68.4	166.1	-40.7	0	0	109.6	K113 T114 T116 Y120	K113-Q118 CarbonylContact C-O 3.59Å; K113-Q118 WeakPolarHBondContact CA-O 3.39Å; T114-Q118 PolarHBondContact N-O 2.87Å; T114-Q118 PolarHBondContact OG1-N 2.84Å; T114-Q118 PolarHBondContact OG1-O 2.99Å; T114-Q118 VanDerWaalsContact OG1-O 3.14Å; T116-Q118 PolarHBondContact O-N 2.98Å; T116-Q118 PolarHBondContact OG1-OE1 3.27Å; Q118-Y120 HydrophobicContact CB-CD2 4.34Å; Q118-Y120 HydrophobicContact CB-CE2 3.59Å; Q118-Y120 PolarHBondContact OE1-OH 3.45Å
119	T	94.1	Very high	89.5	Confident	92 Å²	92	59.1 Å²	59.1	56%	0.564	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	127	178.1	49.1	0	0	0	0	109.3	I82 I112 K113	I82-T119 HydrophobicContact CD1-CG2 3.85Å; I112-T119 CarbonylContact O-C 3.55Å; I112-T119 VanDerWaalsContact O-CA 3.3Å; I112-T119 WeakPolarHBondContact O-CA 3.19Å; K113-T119 HydrophobicContact CB-CG2 4.3Å; K113-T119 HydrophobicContact CD-CG2 4.33Å; K113-T119 HydrophobicContact CG-CG2 4.05Å
120	Y	92.6	Very high	89.5	Confident	59 Å²	59	59.8 Å²	59.8	23%	0.231	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.5	177.5	-66.7	-90.9	0	0	0	109.6	I112 T114 Q118 Y146	I112-Y120 PolarHBondContact N-O 3.05Å; I112-Y120 PolarHBondContact O-N 2.89Å; T114-Y120 HydrophobicContact CG2-CD2 3.7Å; T114-Y120 HydrophobicContact CG2-CE2 3.71Å; Q118-Y120 HydrophobicContact CB-CD2 4.34Å; Q118-Y120 HydrophobicContact CB-CE2 3.59Å; Q118-Y120 PolarHBondContact OE1-OH 3.45Å; Y120-Y146 HydrophobicContact CD1-CD1 4.46Å; Y120-Y146 HydrophobicContact CD1-CD2 4Å; Y120-Y146 HydrophobicContact CD1-CE2 4.26Å; Y120-Y146 HydrophobicContact CD1-CG 4.1Å; Y120-Y146 AromaticContact CD2-CD1 3.96Å; Y120-Y146 HydrophobicContact CD2-CD1 3.96Å; Y120-Y146 HydrophobicContact CD2-CE1 4.16Å; Y120-Y146 HydrophobicContact CD2-CG 4.33Å; Y120-Y146 HydrophobicContact CE1-CD1 4.37Å; Y120-Y146 AromaticContact CE1-CD2 3.82Å; Y120-Y146 HydrophobicContact CE1-CD2 3.82Å; Y120-Y146 HydrophobicContact CE1-CE1 4.18Å; Y120-Y146 AromaticContact CE1-CE2 3.6Å; Y120-Y146 HydrophobicContact CE1-CE2 3.6Å; Y120-Y146 HydrophobicContact CE1-CG 4.19Å; Y120-Y146 AromaticContact CE1-CZ 3.79Å; Y120-Y146 AromaticContact CE2-CD1 3.85Å; Y120-Y146 HydrophobicContact CE2-CD1 3.85Å; Y120-Y146 AromaticContact CE2-CE1 3.56Å; Y120-Y146 HydrophobicContact CE2-CE1 3.56Å; Y120-Y146 HydrophobicContact CE2-CE2 4.48Å; Y120-Y146 HydrophobicContact CE2-CG 4.42Å; Y120-Y146 AromaticContact CE2-CZ 3.91Å; Y120-Y146 HydrophobicContact CG-CD1 4.27Å; Y120-Y146 HydrophobicContact CG-CG 4.17Å; Y120-Y146 AromaticContact CZ-CE1 3.57Å; Y120-Y146 AromaticContact CZ-CE2 3.73Å; Y120-Y146 AromaticContact CZ-CZ 3.38Å; Y120-Y146 VanDerWaalsContact OH-CZ 3.25Å; Y120-Y146 PolarHBondContact OH-OH 2.98Å
121	F	90.8	Very high	89.4	Confident	111 Å²	111	68 Å²	68	49%	0.487	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125.9	169.1	174.8	-100	0	0	0	108.5	L85 V87 C109 V111 P123	L85-F121 HydrophobicContact CD1-CD2 4.45Å; L85-F121 HydrophobicContact CD1-CE2 4.1Å; V87-F121 HydrophobicContact CG2-CZ 4.34Å; C109-F121 HydrophobicContact CB-CE2 3.72Å; C109-F121 HydrophobicContact CB-CZ 3.75Å; V111-F121 HydrophobicContact CG2-CD2 4.1Å; F121-P123 HydrophobicContact CE1-CB 4.19Å
122	L	87.1	Confident	89.2	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.058	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	109.7	179.4	-69	160.4	0	0	0	108.8	C109 A110 I112 V124 Y146 I148	C109-L122 WeakPolarHBondContact CA-O 3.45Å; C109-L122 WeakPolarHBondContact CB-O 3.49Å; A110-L122 PolarHBondContact N-O 2.73Å; A110-L122 WeakPolarHBondContact O-CB 3.38Å; A110-L122 PolarHBondContact O-N 3.41Å; I112-L122 HydrophobicContact CB-CD1 4.39Å; I112-L122 HydrophobicContact CD1-CD1 3.61Å; I112-L122 HydrophobicContact CD1-CG 4.49Å; I112-L122 HydrophobicContact CG1-CD1 3.67Å; I112-L122 HydrophobicContact CG1-CG 4.4Å; I112-L122 HydrophobicContact CG2-CD1 3.85Å; L122-V124 PolarHBondContact O-N 3.45Å; L122-Y146 WeakPolarHBondContact CD1-O 3.38Å; L122-Y146 WeakPolarHBondContact CD2-O 3.42Å; L122-I148 HydrophobicContact CD1-CD1 4.4Å; L122-I148 HydrophobicContact CD1-CG1 4.13Å
123	P	83.1	Confident	89	Confident	48 Å²	48	73.5 Å²	73.5	31%	0.312	38%	0.378	S	S	.	.	S	Bend	trans	-67.7	-25.5	172	27.2	-32.3	0	0	0	111.3	D102 F121	D102-P123 WeakPolarHBondContact OD2-CG 3.31Å; F121-P123 HydrophobicContact CE1-CB 4.19Å
124	V	83.4	Confident	88.8	Confident	56 Å²	56	75.4 Å²	75.4	34%	0.339	39%	0.386	S	S	.	.	S	Bend	trans	-122.1	119.5	176.8	-176.2	0	0	0	0	109.5	L122	L122-V124 PolarHBondContact O-N 3.45Å
125	I	81.9	Confident	88.7	Confident	15 Å²	15	79.4 Å²	79.4	8%	0.077	41%	0.412	C	S	.	.			trans	-61.9	-46.9	-176.1	-65.8	171.5	0	0	0	111.3	L84 K108 A110 A130 L133 I148	L84-I125 HydrophobicContact CD2-CD1 4.45Å; K108-I125 HydrophobicContact CB-CD1 3.9Å; K108-I125 VanDerWaalsContact O-CD1 3.26Å; K108-I125 WeakPolarHBondContact O-CD1 3.22Å; K108-I125 WeakPolarHBondContact O-CG1 3.19Å; A110-I125 HydrophobicContact CB-CG1 4.11Å; I125-A130 HydrophobicContact CD1-CB 3.31Å; I125-L133 HydrophobicContact CG2-CD1 3.61Å; I125-I148 HydrophobicContact CG2-CD1 4.06Å; I125-I148 WeakPolarHBondContact O-CB 3.06Å; I125-I148 WeakPolarHBondContact O-CG1 3.36Å; I125-I148 PolarHBondContact O-N 3.4Å; I125-I148 VanDerWaalsContact O-N 3.12Å
126	G	85	Confident	88.6	Confident	39 Å²	39	78 Å²	78	40%	0.402	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	124	-132.7	177.2	0	0	0	0	0	112.8
127	L	87.1	Confident	88.6	Confident	91 Å²	91	76.3 Å²	76.3	48%	0.476	40%	0.398	S	S	.	.	S	Bend	trans	-85	-8.1	-174.5	-72.6	167.2	0	0	0	114.1	I68 I148 L149	I68-L127 HydrophobicContact CG2-CD1 4.21Å; I68-L127 HydrophobicContact CG2-CD2 4.24Å; L127-I148 PolarHBondContact N-O 3.49Å; L127-L149 HydrophobicContact CD1-CD2 3.77Å
128	V	89.1	Confident	88.6	Confident	21 Å²	21	67.7 Å²	67.7	13%	0.127	37%	0.368	C	S	.	.	S	Bend	trans	-105.1	141.3	-176.1	-178.5	0	0	0	0	110.4	L133 I148 T151	V128-L133 HydrophobicContact CG1-CD1 4.37Å; V128-L133 HydrophobicContact CG1-CD2 4.05Å; V128-L133 HydrophobicContact CG1-CG 4.06Å; V128-I148 HydrophobicContact CB-CG2 4.28Å; V128-I148 HydrophobicContact CG2-CG2 3.85Å; V128-T151 HydrophobicContact CG1-CG2 3.67Å; V128-T151 HydrophobicContact CG2-CG2 4.35Å
129	D	88.4	Confident	88.6	Confident	90 Å²	90	63.1 Å²	63.1	48%	0.481	35%	0.347	S	S	.	.			trans	-65.9	131	175.2	-53.4	-45.6	0	0	0	111.7	E131 K132	D129-E131 PolarHBondContact O-N 2.92Å; D129-K132 HydrophobicContact CB-CD 4.22Å; D129-K132 HydrophobicContact CB-CG 4.38Å; D129-K132 PolarHBondContact O-N 2.84Å; D129-K132 WeakPolarHBondContact OD2-CE 3.28Å; D129-K132 IonicContact OD2-NZ 3.87Å; D129-K132 PolarHBondContact OD2-NZ 2.93Å
130	A	86.4	Confident	88.6	Confident	23 Å²	23	58.8 Å²	58.8	19%	0.19	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.5	179	0	0	0	0	0	113.7	K108 I125 K132	K108-A130 HydrophobicContact CB-CB 3.89Å; K108-A130 HydrophobicContact CD-CB 3.76Å; K108-A130 HydrophobicContact CG-CB 4.13Å; I125-A130 HydrophobicContact CD1-CB 3.31Å; A130-K132 VanDerWaalsContact C-N 3.33Å
131	E	87.8	Confident	88.6	Confident	172 Å²	172	56 Å²	56	80%	0.804	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-25.7	-177.5	-60.7	-179.2	172.1	0	0	113.3	D129	D129-E131 PolarHBondContact O-N 2.92Å
132	K	88.9	Confident	88.5	Confident	139 Å²	139	52.5 Å²	52.5	60%	0.604	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-24	179.5	-69.6	173.6	-177.9	154.8	0	112	D129 A130	D129-K132 HydrophobicContact CB-CD 4.22Å; D129-K132 HydrophobicContact CB-CG 4.38Å; D129-K132 PolarHBondContact O-N 2.84Å; D129-K132 WeakPolarHBondContact OD2-CE 3.28Å; D129-K132 IonicContact OD2-NZ 3.87Å; D129-K132 PolarHBondContact OD2-NZ 2.93Å; A130-K132 VanDerWaalsContact C-N 3.33Å
133	L	89.4	Confident	88.6	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	31%	0.313	C	S	.	.			trans	-78.1	138.2	-178.7	-66.6	175.7	0	0	0	110.7	V81 L84 I125 V128 V139 I148 T151	V81-L133 HydrophobicContact CG2-CD2 4.4Å; L84-L133 HydrophobicContact CD1-CB 4.12Å; L84-L133 VanDerWaalsContact CD1-O 3.27Å; L84-L133 WeakPolarHBondContact CD1-O 3.27Å; L84-L133 HydrophobicContact CD2-CB 4.45Å; I125-L133 HydrophobicContact CG2-CD1 3.61Å; V128-L133 HydrophobicContact CG1-CD1 4.37Å; V128-L133 HydrophobicContact CG1-CD2 4.05Å; V128-L133 HydrophobicContact CG1-CG 4.06Å; L133-V139 HydrophobicContact CD2-CG1 3.75Å; L133-I148 HydrophobicContact CD1-CD1 4.1Å; L133-T151 HydrophobicContact CD2-CG2 3.66Å
134	K	90.9	Very high	88.8	Confident	138 Å²	138	61 Å²	61	60%	0.6	34%	0.335	S	S	*	.			trans	-126.2	151.3	172.2	-61.6	178.3	-174.2	176	0	110	G136 D137	K134-G136 PolarHBondContact O-N 2.93Å; K134-D137 PolarHBondContact N-OD2 2.87Å; K134-D137 WeakPolarHBondContact O-CB 3.38Å; K134-D137 PolarHBondContact O-N 2.67Å; K134-D137 VanDerWaalsContact O-N 3.1Å
135	P	90.8	Very high	88.9	Confident	89 Å²	89	61 Å²	61	58%	0.578	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	124.5	167.4	-28.8	37.7	0	0	0	111.1	I82	I82-P135 WeakPolarHBondContact O-CB 3.27Å
136	G	87.9	Confident	89.3	Confident	51 Å²	51	63 Å²	63	53%	0.526	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	-7.4	-178.1	0	0	0	0	0	115.5	V81 K134	V81-G136 PolarHBondContact O-N 2.85Å; K134-G136 PolarHBondContact O-N 2.93Å
137	D	91.5	Very high	89.5	Confident	42 Å²	42	64.2 Å²	64.2	23%	0.225	34%	0.341	C	S	.	.			trans	-69.4	143.1	179.8	-72.6	-13.8	0	0	0	112.3	N80 V81 K134	N80-D137 WeakPolarHBondContact CA-O 3.41Å; V81-D137 PolarHBondContact N-O 3.02Å; K134-D137 PolarHBondContact N-OD2 2.87Å; K134-D137 WeakPolarHBondContact O-CB 3.38Å; K134-D137 PolarHBondContact O-N 2.67Å; K134-D137 VanDerWaalsContact O-N 3.1Å
138	L	92	Very high	89.8	Confident	33 Å²	33	59.9 Å²	59.9	17%	0.173	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.1	173.5	-82.6	149.4	0	0	0	109.7	V78 N80 L152 E155	V78-L138 HydrophobicContact CG1-CD2 3.54Å; N80-L138 WeakPolarHBondContact OD1-CD2 3.4Å; L138-L152 HydrophobicContact CB-CB 4.22Å; L138-L152 PolarHBondContact O-N 2.6Å; L138-E155 HydrophobicContact CD1-CB 4.1Å
139	V	93.3	Very high	89.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	144	-178.1	-67.5	0	0	0	0	111.8	S79 V81 L133 V141 I148 E150 T151	S79-V139 PolarHBondContact N-O 2.72Å; S79-V139 WeakPolarHBondContact O-CG2 3.46Å; S79-V139 PolarHBondContact O-N 3.02Å; V81-V139 HydrophobicContact CG2-CG1 3.89Å; V81-V139 HydrophobicContact CG2-CG2 3.92Å; L133-V139 HydrophobicContact CD2-CG1 3.75Å; V139-V141 HydrophobicContact CG2-CG2 3.96Å; V139-I148 HydrophobicContact CB-CG2 3.87Å; V139-I148 HydrophobicContact CG1-CG2 4.05Å; V139-I148 HydrophobicContact CG2-CD1 4.35Å; V139-I148 HydrophobicContact CG2-CG1 4.35Å; V139-I148 HydrophobicContact CG2-CG2 4.38Å; V139-E150 CarbonylContact C-O 3.59Å; V139-E150 WeakPolarHBondContact CA-O 3.19Å; V139-T151 HydrophobicContact CG1-CG2 4.33Å
140	G	93	Very high	89.9	Confident	1 Å²	1	58 Å²	58	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.8	171.6	0	0	0	0	0	110	L149 E150	G140-L149 PolarHBondContact O-N 2.99Å; G140-E150 PolarHBondContact N-O 3.25Å; G140-E150 PolarHBondContact O-N 3.25Å
141	V	92.3	Very high	90.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.7	-174.1	173.8	0	0	0	0	110.2	L77 I112 V139 Y146 L147 I148	L77-V141 PolarHBondContact N-O 3.14Å; L77-V141 WeakPolarHBondContact O-CA 3.37Å; L77-V141 WeakPolarHBondContact O-CB 3.47Å; L77-V141 PolarHBondContact O-N 3.24Å; I112-V141 HydrophobicContact CD1-CG1 3.93Å; I112-V141 HydrophobicContact CD1-CG2 3.88Å; V139-V141 HydrophobicContact CG2-CG2 3.96Å; V141-Y146 HydrophobicContact CG1-CD1 4.31Å; V141-Y146 WeakPolarHBondContact CG1-O 3.49Å; V141-L147 WeakPolarHBondContact CA-O 3.42Å; V141-I148 HydrophobicContact CG2-CG1 4.24Å
142	N	90.1	Very high	90.3	Very high	38 Å²	38	54.5 Å²	54.5	20%	0.203	29%	0.292	C	S	.	.			trans	-67.9	139.9	173.4	-167.2	-16.6	0	0	0	110.7	D144 S145 Y146 L147 L149	N142-D144 VanDerWaalsContact C-N 3.34Å; N142-D144 PolarHBondContact O-N 2.96Å; N142-D144 PolarHBondContact OD1-N 3.03Å; N142-S145 WeakPolarHBondContact CB-OG 3.41Å; N142-S145 PolarHBondContact ND2-OG 3.41Å; N142-Y146 VanDerWaalsContact O-CA 3.28Å; N142-Y146 WeakPolarHBondContact O-CA 3.3Å; N142-Y146 PolarHBondContact O-N 3.22Å; N142-Y146 VanDerWaalsContact O-N 3.09Å; N142-L147 PolarHBondContact N-O 3.23Å; N142-L149 HydrophobicContact CB-CD1 4.03Å; N142-L149 HydrophobicContact CB-CG 4.37Å
143	K	87.4	Confident	90.2	Very high	95 Å²	95	53.3 Å²	53.3	41%	0.413	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-34.4	-176.5	-67.4	-177.4	176.1	-171.2	0	113.6	P75 L77	P75-K143 HydrophobicContact CG-CD 4.42Å; P75-K143 VanDerWaalsContact O-CE 3.31Å; P75-K143 WeakPolarHBondContact O-CE 3.46Å; L77-K143 HydrophobicContact CB-CG 4.18Å
144	D	87.4	Confident	90	Very high	143 Å²	143	56.4 Å²	56.4	77%	0.765	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-44.9	-172.5	-56.6	-39.9	0	0	0	112.2	N142	N142-D144 VanDerWaalsContact C-N 3.34Å; N142-D144 PolarHBondContact O-N 2.96Å; N142-D144 PolarHBondContact OD1-N 3.03Å
145	S	87.1	Confident	89.7	Confident	56 Å²	56	56.7 Å²	56.7	39%	0.392	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-10	-176	54.8	0	0	0	0	114.3	N142 L147	N142-S145 WeakPolarHBondContact CB-OG 3.41Å; N142-S145 PolarHBondContact ND2-OG 3.41Å; S145-L147 PolarHBondContact O-N 3.4Å
146	Y	89.6	Confident	89.5	Confident	57 Å²	57	54 Å²	54	22%	0.224	30%	0.299	C	S	.	.			trans	55.1	15.6	-176.8	-57.1	-78.9	0	0	0	115.8	L77 T114 Y120 L122 V141 N142	L77-Y146 HydrophobicContact CD2-CE1 4.22Å; T114-Y146 HydrophobicContact CG2-CD1 4.18Å; T114-Y146 HydrophobicContact CG2-CE1 4.22Å; Y120-Y146 HydrophobicContact CD1-CD1 4.46Å; Y120-Y146 HydrophobicContact CD1-CD2 4Å; Y120-Y146 HydrophobicContact CD1-CE2 4.26Å; Y120-Y146 HydrophobicContact CD1-CG 4.1Å; Y120-Y146 AromaticContact CD2-CD1 3.96Å; Y120-Y146 HydrophobicContact CD2-CD1 3.96Å; Y120-Y146 HydrophobicContact CD2-CE1 4.16Å; Y120-Y146 HydrophobicContact CD2-CG 4.33Å; Y120-Y146 HydrophobicContact CE1-CD1 4.37Å; Y120-Y146 AromaticContact CE1-CD2 3.82Å; Y120-Y146 HydrophobicContact CE1-CD2 3.82Å; Y120-Y146 HydrophobicContact CE1-CE1 4.18Å; Y120-Y146 AromaticContact CE1-CE2 3.6Å; Y120-Y146 HydrophobicContact CE1-CE2 3.6Å; Y120-Y146 HydrophobicContact CE1-CG 4.19Å; Y120-Y146 AromaticContact CE1-CZ 3.79Å; Y120-Y146 AromaticContact CE2-CD1 3.85Å; Y120-Y146 HydrophobicContact CE2-CD1 3.85Å; Y120-Y146 AromaticContact CE2-CE1 3.56Å; Y120-Y146 HydrophobicContact CE2-CE1 3.56Å; Y120-Y146 HydrophobicContact CE2-CE2 4.48Å; Y120-Y146 HydrophobicContact CE2-CG 4.42Å; Y120-Y146 AromaticContact CE2-CZ 3.91Å; Y120-Y146 HydrophobicContact CG-CD1 4.27Å; Y120-Y146 HydrophobicContact CG-CG 4.17Å; Y120-Y146 AromaticContact CZ-CE1 3.57Å; Y120-Y146 AromaticContact CZ-CE2 3.73Å; Y120-Y146 AromaticContact CZ-CZ 3.38Å; Y120-Y146 VanDerWaalsContact OH-CZ 3.25Å; Y120-Y146 PolarHBondContact OH-OH 2.98Å; L122-Y146 WeakPolarHBondContact CD1-O 3.38Å; L122-Y146 WeakPolarHBondContact CD2-O 3.42Å; V141-Y146 HydrophobicContact CG1-CD1 4.31Å; V141-Y146 WeakPolarHBondContact CG1-O 3.49Å; N142-Y146 VanDerWaalsContact O-CA 3.28Å; N142-Y146 WeakPolarHBondContact O-CA 3.3Å; N142-Y146 PolarHBondContact O-N 3.22Å; N142-Y146 VanDerWaalsContact O-N 3.09Å
147	L	89.8	Confident	89.5	Confident	64 Å²	64	53 Å²	53	34%	0.335	28%	0.282	S	S	.	.			trans	-71.3	141.5	175	-71.6	172.8	0	0	0	111.8	V141 N142 S145 L149	V141-L147 WeakPolarHBondContact CA-O 3.42Å; N142-L147 PolarHBondContact N-O 3.23Å; S145-L147 PolarHBondContact O-N 3.4Å; L147-L149 PolarHBondContact O-N 3.07Å
148	I	91.7	Very high	89.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	120.2	175	-55.6	176	0	0	0	109	I112 L122 I125 L127 V128 L133 V139 V141	I112-I148 HydrophobicContact CG2-CD1 4.02Å; I112-I148 HydrophobicContact CG2-CG1 4.44Å; L122-I148 HydrophobicContact CD1-CD1 4.4Å; L122-I148 HydrophobicContact CD1-CG1 4.13Å; I125-I148 HydrophobicContact CG2-CD1 4.06Å; I125-I148 WeakPolarHBondContact O-CB 3.06Å; I125-I148 WeakPolarHBondContact O-CG1 3.36Å; I125-I148 PolarHBondContact O-N 3.4Å; I125-I148 VanDerWaalsContact O-N 3.12Å; L127-I148 PolarHBondContact N-O 3.49Å; V128-I148 HydrophobicContact CB-CG2 4.28Å; V128-I148 HydrophobicContact CG2-CG2 3.85Å; L133-I148 HydrophobicContact CD1-CD1 4.1Å; V139-I148 HydrophobicContact CB-CG2 3.87Å; V139-I148 HydrophobicContact CG1-CG2 4.05Å; V139-I148 HydrophobicContact CG2-CD1 4.35Å; V139-I148 HydrophobicContact CG2-CG1 4.35Å; V139-I148 HydrophobicContact CG2-CG2 4.38Å; V141-I148 HydrophobicContact CG2-CG1 4.24Å
149	L	90.3	Very high	89.2	Confident	15 Å²	15	57.5 Å²	57.5	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-43.1	-177.9	-61.3	177.6	0	0	0	111.9	Y76 L127 G140 N142 L147	Y76-L149 HydrophobicContact CD1-CD1 3.37Å; Y76-L149 HydrophobicContact CE1-CD1 3.44Å; Y76-L149 VanDerWaalsContact CE1-CD1 3.44Å; Y76-L149 HydrophobicContact CG-CD1 4.25Å; L127-L149 HydrophobicContact CD1-CD2 3.77Å; G140-L149 PolarHBondContact O-N 2.99Å; N142-L149 HydrophobicContact CB-CD1 4.03Å; N142-L149 HydrophobicContact CB-CG 4.37Å; L147-L149 PolarHBondContact O-N 3.07Å
150	E	90.1	Very high	89	Confident	56 Å²	56	57.5 Å²	57.5	26%	0.262	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	156.3	179.4	72.5	-175	-169	0	0	112.6	K72 V139 G140 L152	K72-E150 WeakPolarHBondContact CE-OE2 3.01Å; K72-E150 IonicContact NZ-OE2 2.78Å; K72-E150 PolarHBondContact NZ-OE2 3.36Å; V139-E150 CarbonylContact C-O 3.59Å; V139-E150 WeakPolarHBondContact CA-O 3.19Å; G140-E150 PolarHBondContact N-O 3.25Å; G140-E150 PolarHBondContact O-N 3.25Å; E150-L152 HydrophobicContact CG-CD2 4.14Å; E150-L152 WeakPolarHBondContact OE1-CD2 3.44Å
151	T	91.6	Very high	88.7	Confident	73 Å²	73	62.2 Å²	62.2	45%	0.448	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.9	167.9	48.3	0	0	0	0	109.3	V128 L133 V139	V128-T151 HydrophobicContact CG1-CG2 3.67Å; V128-T151 HydrophobicContact CG2-CG2 4.35Å; L133-T151 HydrophobicContact CD2-CG2 3.66Å; V139-T151 HydrophobicContact CG1-CG2 4.33Å
152	L	90.8	Very high	88.4	Confident	49 Å²	49	66.3 Å²	66.3	26%	0.257	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-90.7	147.2	175.8	-64.1	172.2	0	0	0	109.4	V78 L138 E150	V78-L152 HydrophobicContact CB-CD1 4.46Å; V78-L152 HydrophobicContact CG1-CD1 4.02Å; V78-L152 HydrophobicContact CG2-CD1 3.89Å; L138-L152 HydrophobicContact CB-CB 4.22Å; L138-L152 PolarHBondContact O-N 2.6Å; E150-L152 HydrophobicContact CG-CD2 4.14Å; E150-L152 WeakPolarHBondContact OE1-CD2 3.44Å
153	P	88.1	Confident	88.2	Confident	114 Å²	114	65.1 Å²	65.1	74%	0.74	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-60.8	147.8	171	26.9	-33.3	0	0	0	109.9	E155	P153-E155 PolarHBondContact O-N 2.61Å
154	T	84.9	Confident	88	Confident	71 Å²	71	62.7 Å²	62.7	44%	0.436	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-59.2	126	177.6	45.3	0	0	0	0	110.4
155	E	83.9	Confident	87.4	Confident	143 Å²	143	58.2 Å²	58.2	67%	0.668	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-94.2	123.7	178.7	-172.9	172.1	-156	0	0	110.7	L138 P153	L138-E155 HydrophobicContact CD1-CB 4.1Å; P153-E155 PolarHBondContact O-N 2.61Å
156	Y	86.6	Confident	86.3	Confident	33 Å²	33	62.2 Å²	62.2	13%	0.129	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-92.1	156.3	168.4	-55.7	-73.9	0	0	0	111.1	S158 D258 A261 L262 E265	Y156-S158 PolarHBondContact O-N 3.05Å; Y156-D258 HydrophobicContact CD1-CB 4.21Å; Y156-A261 HydrophobicContact CE1-CB 3.7Å; Y156-L262 HydrophobicContact CD2-CB 4.38Å; Y156-L262 HydrophobicContact CD2-CD1 3.81Å; Y156-L262 HydrophobicContact CE2-CB 4.39Å; Y156-L262 HydrophobicContact CE2-CD1 3.82Å; Y156-L262 HydrophobicContact CG-CB 4.46Å; Y156-E265 WeakPolarHBondContact CE2-OE2 3.28Å; Y156-E265 PolarHBondContact OH-OE2 3.04Å
157	D	88.1	Confident	85.2	Confident	29 Å²	29	67.6 Å²	67.6	16%	0.155	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-52	135.5	174.1	-164.5	-64.7	0	0	0	111.3	R159 V160 K161	D157-R159 PolarHBondContact O-N 3.38Å; D157-R159 VanDerWaalsContact O-N 3.09Å; D157-R159 VanDerWaalsContact OD1-CB 3.28Å; D157-R159 WeakPolarHBondContact OD1-CB 3.09Å; D157-R159 WeakPolarHBondContact OD1-CG 3.45Å; D157-R159 IonicContact OD1-CZ 2.75Å; D157-R159 PolarHBondContact OD1-N 3.1Å; D157-R159 IonicContact OD1-NE 3.36Å; D157-R159 PolarHBondContact OD1-NE 3.26Å; D157-R159 IonicContact OD1-NH2 3.38Å; D157-R159 IonicContact OD2-CZ 3.26Å; D157-R159 IonicContact OD2-NE 3.73Å; D157-R159 PolarHBondContact OD2-NE 3.37Å; D157-R159 IonicContact OD2-NH2 3.64Å; D157-R159 PolarHBondContact OD2-NH2 3.41Å; D157-V160 HydrophobicContact CB-CG2 4.21Å; D157-V160 WeakPolarHBondContact O-CB 3.35Å; D157-V160 PolarHBondContact O-N 3.21Å; D157-K161 PolarHBondContact O-N 2.78Å
158	S	88.8	Confident	84.1	Confident	92 Å²	92	73.9 Å²	73.9	64%	0.643	39%	0.386	S	S	*	.	H	α-helix	trans	-51.8	-32.7	177.3	59.3	0	0	0	0	113.3	Y156 V160 K161 A162	Y156-S158 PolarHBondContact O-N 3.05Å; S158-V160 VanDerWaalsContact C-N 3.32Å; S158-V160 PolarHBondContact O-N 3.28Å; S158-K161 PolarHBondContact O-N 2.91Å; S158-A162 PolarHBondContact O-N 2.85Å
159	R	88.8	Confident	82.9	Confident	78 Å²	78	75.3 Å²	75.3	29%	0.294	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-36.1	176.5	-65.7	172.5	-74	-172.5	-2.6	112	D157 A162 M163 L255	D157-R159 PolarHBondContact O-N 3.38Å; D157-R159 VanDerWaalsContact O-N 3.09Å; D157-R159 VanDerWaalsContact OD1-CB 3.28Å; D157-R159 WeakPolarHBondContact OD1-CB 3.09Å; D157-R159 WeakPolarHBondContact OD1-CG 3.45Å; D157-R159 IonicContact OD1-CZ 2.75Å; D157-R159 PolarHBondContact OD1-N 3.1Å; D157-R159 IonicContact OD1-NE 3.36Å; D157-R159 PolarHBondContact OD1-NE 3.26Å; D157-R159 IonicContact OD1-NH2 3.38Å; D157-R159 IonicContact OD2-CZ 3.26Å; D157-R159 IonicContact OD2-NE 3.73Å; D157-R159 PolarHBondContact OD2-NE 3.37Å; D157-R159 IonicContact OD2-NH2 3.64Å; D157-R159 PolarHBondContact OD2-NH2 3.41Å; R159-A162 PolarHBondContact O-N 3.42Å; R159-M163 WeakPolarHBondContact O-CG 3.03Å; R159-M163 PolarHBondContact O-N 2.83Å; R159-L255 HydrophobicContact CB-CD1 4.01Å
160	V	88.5	Confident	82.3	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-73.5	-38.9	178.2	177.9	0	0	0	0	110.5	D157 S158 A162 M163 L255 D258 A259 L262	D157-V160 HydrophobicContact CB-CG2 4.21Å; D157-V160 WeakPolarHBondContact O-CB 3.35Å; D157-V160 PolarHBondContact O-N 3.21Å; S158-V160 VanDerWaalsContact C-N 3.32Å; S158-V160 PolarHBondContact O-N 3.28Å; V160-A162 PolarHBondContact O-N 2.83Å; V160-M163 WeakPolarHBondContact O-CB 3.3Å; V160-M163 PolarHBondContact O-N 2.88Å; V160-L255 HydrophobicContact CG2-CD2 4.16Å; V160-L255 HydrophobicContact CG2-CG 3.88Å; V160-D258 HydrophobicContact CG2-CB 3.91Å; V160-A259 HydrophobicContact CG1-CB 4.13Å; V160-A259 HydrophobicContact CG2-CB 4.47Å; V160-L262 HydrophobicContact CG1-CB 4.2Å; V160-L262 HydrophobicContact CG1-CD2 3.68Å
161	K	86.9	Confident	81.9	Confident	100 Å²	100	80.6 Å²	80.6	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-36.4	172.3	-66	-177.3	-179.3	173.2	0	111.7	D157 S158 M163 E164	D157-K161 PolarHBondContact O-N 2.78Å; S158-K161 PolarHBondContact O-N 2.91Å; K161-M163 VanDerWaalsContact C-N 3.26Å; K161-M163 PolarHBondContact O-N 3.47Å; K161-E164 WeakPolarHBondContact O-CB 3.44Å; K161-E164 PolarHBondContact O-N 3.41Å
162	A	87	Confident	81.7	Confident	86 Å²	86	82.2 Å²	82.2	71%	0.711	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.8	174.7	0	0	0	0	0	114.4	S158 R159 V160 E164	S158-A162 PolarHBondContact O-N 2.85Å; R159-A162 PolarHBondContact O-N 3.42Å; V160-A162 PolarHBondContact O-N 2.83Å; A162-E164 VanDerWaalsContact C-N 3.33Å
163	M	84	Confident	81.6	Confident	14 Å²	14	82.4 Å²	82.4	7%	0.069	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-16	174.2	-69.9	173.8	-173.4	0	0	112.6	R159 V160 K161 V165 K238 L239 Q243 L255	R159-M163 WeakPolarHBondContact O-CG 3.03Å; R159-M163 PolarHBondContact O-N 2.83Å; V160-M163 WeakPolarHBondContact O-CB 3.3Å; V160-M163 PolarHBondContact O-N 2.88Å; K161-M163 VanDerWaalsContact C-N 3.26Å; K161-M163 PolarHBondContact O-N 3.47Å; M163-V165 PolarHBondContact O-N 2.85Å; M163-K238 WeakPolarHBondContact CB-O 3.47Å; M163-K238 WeakPolarHBondContact CG-O 3.47Å; M163-K238 PolarHBondContact O-N 3.15Å; M163-L239 HydrophobicContact SD-CD1 4.36Å; M163-L239 HydrophobicContact SD-CG 4.31Å; M163-Q243 HydrophobicContact CE-CB 4.18Å; M163-L255 HydrophobicContact CE-CD1 4.17Å; M163-L255 HydrophobicContact CE-CD2 3.47Å; M163-L255 VanDerWaalsContact CE-CD2 3.47Å; M163-L255 HydrophobicContact CE-CG 4.37Å; M163-L255 HydrophobicContact SD-CD2 3.92Å
164	E	83.4	Confident	81.6	Confident	43 Å²	43	79.8 Å²	79.8	20%	0.201	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-68.1	127.1	171.5	-173	172	-175	0	0	109.4	K161 A162 D166 K266	K161-E164 WeakPolarHBondContact O-CB 3.44Å; K161-E164 PolarHBondContact O-N 3.41Å; A162-E164 VanDerWaalsContact C-N 3.33Å; E164-D166 PolarHBondContact O-N 3.24Å; E164-K266 IonicContact OE1-NZ 2.71Å; E164-K266 PolarHBondContact OE1-NZ 2.9Å; E164-K266 IonicContact OE2-NZ 2.66Å; E164-K266 PolarHBondContact OE2-NZ 3Å
165	V	74.9	Confident	81.7	Confident	49 Å²	49	79.5 Å²	79.5	30%	0.297	41%	0.409	S	S	.	.			trans	-86.9	97.8	179.6	178.5	0	0	0	0	108.7	M163 E167 F236 K238	M163-V165 PolarHBondContact O-N 2.85Å; V165-E167 VanDerWaalsContact C-N 3.31Å; V165-E167 WeakPolarHBondContact CG1-O 3.34Å; V165-F236 HydrophobicContact CB-CD1 4.08Å; V165-F236 WeakPolarHBondContact CB-O 3.41Å; V165-F236 HydrophobicContact CG2-CD1 3.67Å; V165-F236 HydrophobicContact CG2-CE1 4.21Å; V165-F236 PolarHBondContact N-O 3.27Å; V165-K238 HydrophobicContact CG2-CB 3.76Å
166	D	65	Low	81.9	Confident	141 Å²	141	73.5 Å²	73.5	75%	0.754	38%	0.381	S	S	*	.			trans	-65.9	-34	176	-69	-33.4	0	0	0	112	E164	E164-D166 PolarHBondContact O-N 3.24Å
167	E	65.6	Low	82	Confident	169 Å²	169	72.2 Å²	72.2	79%	0.79	38%	0.379	S	S	*	.	S	Bend	trans	-95.9	110.2	179.6	-72.1	-170.6	166.9	0	0	112	V165 P169	V165-E167 VanDerWaalsContact C-N 3.31Å; V165-E167 WeakPolarHBondContact CG1-O 3.34Å; E167-P169 WeakPolarHBondContact O-CD 3.33Å
168	R	66.2	Low	81.9	Confident	197 Å²	197	72.7 Å²	72.7	74%	0.743	39%	0.39	S	S	*	.			trans	-59.3	121.6	176.1	-65.9	179.7	-180	171.3	0.6	110.1	T170	R168-T170 PolarHBondContact O-N 3.34Å
169	P	67.5	Low	82.1	Confident	30 Å²	30	69.1 Å²	69.1	20%	0.195	36%	0.363	C	S	.	.			trans	-59.8	137.1	169.3	23.2	-29.9	0	0	0	109	E167 R226 A229 A230	E167-P169 WeakPolarHBondContact O-CD 3.33Å; P169-R226 HydrophobicContact CB-CB 4.06Å; P169-R226 HydrophobicContact CG-CB 4.27Å; P169-R226 WeakPolarHBondContact CG-O 3.44Å; P169-A229 HydrophobicContact CG-CB 4.09Å; P169-A230 HydrophobicContact CG-CB 4.44Å; P169-A230 WeakPolarHBondContact O-CB 3.3Å
170	T	78.2	Confident	82.2	Confident	129 Å²	129	71 Å²	71	79%	0.791	38%	0.379	S	S	*	.			trans	-96.4	6.9	-178.5	56.6	0	0	0	0	113.1	R168	R168-T170 PolarHBondContact O-N 3.34Å
171	E	81.8	Confident	82.4	Confident	53 Å²	53	78.7 Å²	78.7	25%	0.248	41%	0.413	C	S	.	.			trans	-67.4	132.9	-175.6	-65	175.6	-173.7	0	0	110.7	L223 R226 A227 A230	E171-L223 WeakPolarHBondContact OE2-CG 3.41Å; E171-R226 WeakPolarHBondContact OE2-CB 3.4Å; E171-A227 HydrophobicContact CB-CB 4.32Å; E171-A230 WeakPolarHBondContact O-CB 3.22Å
172	Q	86.4	Confident	82.7	Confident	107 Å²	107	75.3 Å²	75.3	50%	0.5	40%	0.399	S	S	.	.			trans	-105.6	157.8	177.9	-62.1	-173.1	11.9	0	0	111.1	S174 D175	Q172-S174 WeakPolarHBondContact CB-OG 3.35Å; Q172-S174 PolarHBondContact O-N 3.36Å; Q172-S174 VanDerWaalsContact O-N 3.16Å; Q172-D175 PolarHBondContact N-OD2 3.05Å; Q172-D175 WeakPolarHBondContact O-CB 3.44Å; Q172-D175 PolarHBondContact O-N 3.19Å
173	Y	88.6	Confident	82.9	Confident	52 Å²	52	72.1 Å²	72.1	20%	0.204	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-60.4	-24.7	174.2	-64.7	-60.7	0	0	0	112.8	D175 I176 I183 V187 L224 A227 C228 Q231	Y173-D175 PolarHBondContact O-N 3.16Å; Y173-I176 HydrophobicContact CD1-CD1 4.35Å; Y173-I176 PolarHBondContact O-N 3.28Å; Y173-I176 VanDerWaalsContact O-N 3.14Å; Y173-I183 HydrophobicContact CD1-CG1 4.37Å; Y173-I183 HydrophobicContact CD1-CG2 3.71Å; Y173-I183 HydrophobicContact CE1-CG2 4.01Å; Y173-I183 HydrophobicContact CG-CG2 4.11Å; Y173-V187 HydrophobicContact CE1-CG2 4.41Å; Y173-V187 HydrophobicContact CE2-CG2 4.2Å; Y173-L224 HydrophobicContact CD1-CD1 4.28Å; Y173-L224 HydrophobicContact CE1-CD1 4.13Å; Y173-A227 HydrophobicContact CD1-CB 4.18Å; Y173-A227 HydrophobicContact CE1-CB 4.23Å; Y173-C228 WeakPolarHBondContact OH-CA 3.48Å; Y173-Q231 HydrophobicContact CD2-CG 3.96Å; Y173-Q231 HydrophobicContact CE2-CB 3.99Å; Y173-Q231 HydrophobicContact CE2-CG 3.57Å
174	S	87.9	Confident	83.4	Confident	59 Å²	59	76.9 Å²	76.9	41%	0.413	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-66.3	-17.3	174.3	56.6	0	0	0	0	114.4	Q172 I176	Q172-S174 WeakPolarHBondContact CB-OG 3.35Å; Q172-S174 PolarHBondContact O-N 3.36Å; Q172-S174 VanDerWaalsContact O-N 3.16Å; S174-I176 VanDerWaalsContact C-N 3.3Å
175	D	87.3	Confident	83.8	Confident	65 Å²	65	78.1 Å²	78.1	35%	0.348	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-89	-1.1	177.6	-56.6	-33.1	0	0	0	111.8	Q172 Y173 I356	Q172-D175 PolarHBondContact N-OD2 3.05Å; Q172-D175 WeakPolarHBondContact O-CB 3.44Å; Q172-D175 PolarHBondContact O-N 3.19Å; Y173-D175 PolarHBondContact O-N 3.16Å; D175-I356 HydrophobicContact CB-CG2 4.48Å
176	I	89.1	Confident	84.6	Confident	17 Å²	17	75.8 Å²	75.8	9%	0.087	38%	0.383	C	S	.	.	S	Bend	trans	-105.3	118.4	178.1	-45.2	-167.9	0	0	0	108.6	Y173 S174 L179 I183 L223 L224 A227	Y173-I176 HydrophobicContact CD1-CD1 4.35Å; Y173-I176 PolarHBondContact O-N 3.28Å; Y173-I176 VanDerWaalsContact O-N 3.14Å; S174-I176 VanDerWaalsContact C-N 3.3Å; I176-L179 HydrophobicContact CG2-CB 4.16Å; I176-L179 HydrophobicContact CG2-CD1 3.96Å; I176-L179 HydrophobicContact CG2-CG 4.5Å; I176-I183 HydrophobicContact CB-CD1 4.09Å; I176-I183 HydrophobicContact CG2-CD1 4.15Å; I176-L223 HydrophobicContact CD1-CD2 3.54Å; I176-L223 HydrophobicContact CG1-CD2 3.45Å; I176-L223 VanDerWaalsContact CG1-CD2 3.45Å; I176-L224 HydrophobicContact CD1-CB 4.32Å; I176-L224 HydrophobicContact CD1-CD1 3.54Å; I176-A227 HydrophobicContact CD1-CB 3.83Å
177	G	88.5	Confident	85.9	Confident	7 Å²	7	71.1 Å²	71.1	7%	0.072	36%	0.36	C	S	.	.			trans	-96.8	132.5	-179.5	0	0	0	0	0	112.9	L179	G177-L179 VanDerWaalsContact C-N 3.34Å; G177-L179 PolarHBondContact O-N 2.86Å
178	G	86.6	Confident	87	Confident	38 Å²	38	67.1 Å²	67.1	39%	0.392	34%	0.341	S	S	.	.	S	Bend	trans	74.5	13.9	164.1	0	0	0	0	0	116.7
179	L	91.3	Very high	88.1	Confident	17 Å²	17	58 Å²	58	9%	0.089	31%	0.307	C	S	.	.			trans	-117.8	31.1	-178.8	-66.3	174.7	0	0	0	112.4	I176 G177 K181 Q182 I183 F342	I176-L179 HydrophobicContact CG2-CB 4.16Å; I176-L179 HydrophobicContact CG2-CD1 3.96Å; I176-L179 HydrophobicContact CG2-CG 4.5Å; G177-L179 VanDerWaalsContact C-N 3.34Å; G177-L179 PolarHBondContact O-N 2.86Å; L179-K181 VanDerWaalsContact C-N 3.3Å; L179-K181 PolarHBondContact O-N 3.23Å; L179-Q182 HydrophobicContact CB-CB 4.4Å; L179-Q182 HydrophobicContact CD2-CG 4.46Å; L179-Q182 PolarHBondContact O-N 3.37Å; L179-Q182 VanDerWaalsContact O-N 3.13Å; L179-Q182 PolarHBondContact O-OE1 3.39Å; L179-I183 VanDerWaalsContact O-CG1 3.28Å; L179-I183 WeakPolarHBondContact O-CG1 3.39Å; L179-I183 PolarHBondContact O-N 2.97Å; L179-F342 HydrophobicContact CD1-CD1 3.91Å; L179-F342 HydrophobicContact CD1-CE1 3.88Å; L179-F342 HydrophobicContact CD2-CD1 4.3Å
180	D	91.1	Very high	89.1	Confident	118 Å²	118	56.6 Å²	56.6	63%	0.631	30%	0.298	S	S	*	.	H	α-helix	trans	-59.6	-38.8	-171.7	-59.3	-50	0	0	0	112.9	I183 Q184	D180-I183 PolarHBondContact O-N 3.48Å; D180-Q184 WeakPolarHBondContact O-CB 2.97Å; D180-Q184 PolarHBondContact O-N 3.48Å
181	K	92.6	Very high	89.5	Confident	162 Å²	162	51.4 Å²	51.4	70%	0.704	27%	0.267	S	S	*	.	H	α-helix	trans	-63.4	-46.9	176	-68.2	-178.7	-179.3	178.2	0	111.5	L179 Q184 E185	L179-K181 VanDerWaalsContact C-N 3.3Å; L179-K181 PolarHBondContact O-N 3.23Å; K181-Q184 PolarHBondContact O-N 3.2Å; K181-E185 WeakPolarHBondContact O-CG 3.42Å; K181-E185 PolarHBondContact O-N 3.44Å
182	Q	93.6	Very high	89.8	Confident	28 Å²	28	51.7 Å²	51.7	13%	0.131	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-38.3	179.3	-68.8	76.8	8.6	0	0	111.7	L179 L186 I340 E341	L179-Q182 HydrophobicContact CB-CB 4.4Å; L179-Q182 HydrophobicContact CD2-CG 4.46Å; L179-Q182 PolarHBondContact O-N 3.37Å; L179-Q182 VanDerWaalsContact O-N 3.13Å; L179-Q182 PolarHBondContact O-OE1 3.39Å; Q182-L186 WeakPolarHBondContact O-CB 3.37Å; Q182-L186 PolarHBondContact O-N 3.43Å; Q182-I340 HydrophobicContact CB-CG2 3.75Å; Q182-I340 HydrophobicContact CG-CG2 3.51Å; Q182-E341 WeakPolarHBondContact CG-O 3.47Å; Q182-E341 PolarHBondContact NE2-O 3.23Å; Q182-E341 VanDerWaalsContact NE2-O 3.11Å
183	I	92.3	Very high	89.8	Confident	20 Å²	20	46.9 Å²	46.9	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-48.8	173.9	-68.2	162.3	0	0	0	109.6	Y173 I176 L179 D180 E185 L186 V187 L224	Y173-I183 HydrophobicContact CD1-CG1 4.37Å; Y173-I183 HydrophobicContact CD1-CG2 3.71Å; Y173-I183 HydrophobicContact CE1-CG2 4.01Å; Y173-I183 HydrophobicContact CG-CG2 4.11Å; I176-I183 HydrophobicContact CB-CD1 4.09Å; I176-I183 HydrophobicContact CG2-CD1 4.15Å; L179-I183 VanDerWaalsContact O-CG1 3.28Å; L179-I183 WeakPolarHBondContact O-CG1 3.39Å; L179-I183 PolarHBondContact O-N 2.97Å; D180-I183 PolarHBondContact O-N 3.48Å; I183-E185 PolarHBondContact O-N 2.94Å; I183-L186 PolarHBondContact O-N 3.38Å; I183-V187 HydrophobicContact CG2-CG2 4.18Å; I183-V187 WeakPolarHBondContact O-CB 3.5Å; I183-V187 WeakPolarHBondContact O-CG2 3.44Å; I183-V187 PolarHBondContact O-N 3.03Å; I183-L224 HydrophobicContact CB-CD1 4.44Å; I183-L224 HydrophobicContact CG1-CD1 3.56Å
184	Q	93.1	Very high	89.6	Confident	114 Å²	114	45.6 Å²	45.6	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-59.4	-49.4	179.5	-176.8	178.2	-5.3	0	0	111.9	D180 K181 L186 V187 E188	D180-Q184 WeakPolarHBondContact O-CB 2.97Å; D180-Q184 PolarHBondContact O-N 3.48Å; K181-Q184 PolarHBondContact O-N 3.2Å; Q184-L186 VanDerWaalsContact C-N 3.29Å; Q184-L186 PolarHBondContact O-N 2.83Å; Q184-V187 PolarHBondContact O-N 3.15Å; Q184-E188 HydrophobicContact CG-CG 4.41Å; Q184-E188 VanDerWaalsContact CG-OE1 3.3Å; Q184-E188 WeakPolarHBondContact CG-OE1 3.47Å; Q184-E188 PolarHBondContact NE2-OE1 3.08Å; Q184-E188 WeakPolarHBondContact O-CB 3.13Å; Q184-E188 WeakPolarHBondContact O-CG 3.47Å; Q184-E188 PolarHBondContact O-N 3.03Å
185	E	92.8	Very high	89.4	Confident	69 Å²	69	47.8 Å²	47.8	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-60.4	-38	179.7	-72.5	-176.6	179.6	0	0	112.9	K181 I183 A189 I340	K181-E185 WeakPolarHBondContact O-CG 3.42Å; K181-E185 PolarHBondContact O-N 3.44Å; I183-E185 PolarHBondContact O-N 2.94Å; E185-A189 WeakPolarHBondContact O-CB 3.38Å; E185-A189 PolarHBondContact O-N 3.04Å; E185-A189 VanDerWaalsContact O-N 3.13Å; E185-I340 HydrophobicContact CB-CD1 3.92Å; E185-I340 HydrophobicContact CB-CG1 4.39Å
186	L	91.8	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-71.9	-40.9	178	-173	131.3	0	0	0	111.8	Q182 I183 Q184 A189 I190 V211 M213 L224 C228 I340	Q182-L186 WeakPolarHBondContact O-CB 3.37Å; Q182-L186 PolarHBondContact O-N 3.43Å; I183-L186 PolarHBondContact O-N 3.38Å; Q184-L186 VanDerWaalsContact C-N 3.29Å; Q184-L186 PolarHBondContact O-N 2.83Å; L186-A189 PolarHBondContact O-N 2.81Å; L186-I190 HydrophobicContact CD1-CD1 4.3Å; L186-I190 HydrophobicContact CD2-CD1 4.26Å; L186-I190 HydrophobicContact CG-CD1 3.92Å; L186-I190 WeakPolarHBondContact O-CB 3.2Å; L186-I190 WeakPolarHBondContact O-CG1 3.38Å; L186-I190 PolarHBondContact O-N 2.73Å; L186-V211 HydrophobicContact CD1-CG1 4.49Å; L186-M213 HydrophobicContact CD1-SD 3.74Å; L186-L224 HydrophobicContact CB-CD2 4.31Å; L186-L224 HydrophobicContact CD1-CD2 3.87Å; L186-L224 HydrophobicContact CD1-CG 4.25Å; L186-L224 HydrophobicContact CD2-CG 4.38Å; L186-L224 HydrophobicContact CG-CD2 4.47Å; L186-C228 HydrophobicContact CD2-CB 3.62Å; L186-C228 VanDerWaalsContact CD2-SG 3.52Å; L186-I340 HydrophobicContact CB-CD1 3.9Å; L186-I340 HydrophobicContact CD1-CD1 4.44Å
187	V	91.1	Very high	89.1	Confident	43 Å²	43	51.6 Å²	51.6	26%	0.261	27%	0.265	S	S	.	.	I	π-helix	trans	-63.2	-44.3	176.2	169.5	0	0	0	0	110.9	Y173 I183 Q184 A189 V191 L192	Y173-V187 HydrophobicContact CE1-CG2 4.41Å; Y173-V187 HydrophobicContact CE2-CG2 4.2Å; I183-V187 HydrophobicContact CG2-CG2 4.18Å; I183-V187 WeakPolarHBondContact O-CB 3.5Å; I183-V187 WeakPolarHBondContact O-CG2 3.44Å; I183-V187 PolarHBondContact O-N 3.03Å; Q184-V187 PolarHBondContact O-N 3.15Å; V187-A189 VanDerWaalsContact C-N 3.33Å; V187-A189 PolarHBondContact O-N 2.97Å; V187-V191 HydrophobicContact CB-CG2 4.26Å; V187-V191 HydrophobicContact CG1-CB 3.95Å; V187-V191 HydrophobicContact CG1-CG1 4.49Å; V187-V191 HydrophobicContact CG1-CG2 4.11Å; V187-V191 HydrophobicContact CG2-CG2 4.21Å; V187-V191 WeakPolarHBondContact O-CA 3.22Å; V187-V191 VanDerWaalsContact O-CB 3.29Å; V187-V191 WeakPolarHBondContact O-CB 3.46Å; V187-V191 PolarHBondContact O-N 2.91Å; V187-L192 PolarHBondContact O-N 3.37Å
188	E	89.6	Confident	89.1	Confident	85 Å²	85	58.1 Å²	58.1	40%	0.397	29%	0.293	S	S	.	.	I	π-helix	trans	-63	-38.5	176.7	-73.7	174.8	-172.7	0	0	112.4	Q184 L192 P193	Q184-E188 HydrophobicContact CG-CG 4.41Å; Q184-E188 VanDerWaalsContact CG-OE1 3.3Å; Q184-E188 WeakPolarHBondContact CG-OE1 3.47Å; Q184-E188 PolarHBondContact NE2-OE1 3.08Å; Q184-E188 WeakPolarHBondContact O-CB 3.13Å; Q184-E188 WeakPolarHBondContact O-CG 3.47Å; Q184-E188 PolarHBondContact O-N 3.03Å; E188-L192 WeakPolarHBondContact O-CB 3.37Å; E188-P193 WeakPolarHBondContact O-CD 3.33Å
189	A	88.5	Confident	89.2	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.033	30%	0.3	C	S	.	.	I	π-helix	trans	-76.4	-32.1	-178.5	0	0	0	0	0	113.8	E185 L186 V187 P193 P208 V211 R338	E185-A189 WeakPolarHBondContact O-CB 3.38Å; E185-A189 PolarHBondContact O-N 3.04Å; E185-A189 VanDerWaalsContact O-N 3.13Å; L186-A189 PolarHBondContact O-N 2.81Å; V187-A189 VanDerWaalsContact C-N 3.33Å; V187-A189 PolarHBondContact O-N 2.97Å; A189-P193 WeakPolarHBondContact O-CG 3.44Å; A189-P208 HydrophobicContact CB-CG 3.93Å; A189-V211 HydrophobicContact CB-CG2 3.61Å; A189-R338 HydrophobicContact CB-CG 4.17Å
190	I	88.2	Confident	89	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	30%	0.302	C	S	.	.	I	π-helix	trans	-115.2	-51.1	-169.5	-54.7	-178.7	0	0	0	112.2	L186 P193 M194 V211 I270 K315 I317	L186-I190 HydrophobicContact CD1-CD1 4.3Å; L186-I190 HydrophobicContact CD2-CD1 4.26Å; L186-I190 HydrophobicContact CG-CD1 3.92Å; L186-I190 WeakPolarHBondContact O-CB 3.2Å; L186-I190 WeakPolarHBondContact O-CG1 3.38Å; L186-I190 PolarHBondContact O-N 2.73Å; I190-P193 WeakPolarHBondContact O-CD 3.36Å; I190-M194 VanDerWaalsContact O-CG 3.22Å; I190-M194 WeakPolarHBondContact O-CG 3.49Å; I190-V211 HydrophobicContact CD1-CB 4.49Å; I190-V211 HydrophobicContact CD1-CG2 3.97Å; I190-V211 HydrophobicContact CG1-CG2 3.89Å; I190-I270 HydrophobicContact CG2-CD1 3.86Å; I190-I270 HydrophobicContact CG2-CG1 4.32Å; I190-K315 HydrophobicContact CG2-CB 4.25Å; I190-K315 HydrophobicContact CG2-CG 4.38Å; I190-I317 HydrophobicContact CD1-CD1 3.34Å; I190-I317 HydrophobicContact CD1-CG1 3.35Å
191	V	87.8	Confident	88.8	Confident	20 Å²	20	63.9 Å²	63.9	12%	0.121	30%	0.303	C	S	.	.	I	π-helix	trans	-76.2	-40.6	-172.7	-174.1	0	0	0	0	110.7	V187 M194 N195 T232	V187-V191 HydrophobicContact CB-CG2 4.26Å; V187-V191 HydrophobicContact CG1-CB 3.95Å; V187-V191 HydrophobicContact CG1-CG1 4.49Å; V187-V191 HydrophobicContact CG1-CG2 4.11Å; V187-V191 HydrophobicContact CG2-CG2 4.21Å; V187-V191 WeakPolarHBondContact O-CA 3.22Å; V187-V191 VanDerWaalsContact O-CB 3.29Å; V187-V191 WeakPolarHBondContact O-CB 3.46Å; V187-V191 PolarHBondContact O-N 2.91Å; V191-M194 PolarHBondContact O-N 3.07Å; V191-N195 PolarHBondContact O-N 3Å; V191-T232 HydrophobicContact CB-CG2 4.31Å; V191-T232 HydrophobicContact CG1-CG2 4.25Å; V191-T232 HydrophobicContact CG2-CG2 3.64Å
192	L	87.8	Confident	88.7	Confident	58 Å²	58	62.9 Å²	62.9	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-46.4	-178.1	-147	124.9	0	0	0	112.4	V187 E188 M194 N195 H196 F200	V187-L192 PolarHBondContact O-N 3.37Å; E188-L192 WeakPolarHBondContact O-CB 3.37Å; L192-M194 VanDerWaalsContact C-N 3.26Å; L192-M194 PolarHBondContact O-N 3.21Å; L192-N195 PolarHBondContact O-N 3.42Å; L192-H196 WeakPolarHBondContact O-CA 3.35Å; L192-H196 PolarHBondContact O-N 2.97Å; L192-F200 HydrophobicContact CB-CE2 4.29Å; L192-F200 HydrophobicContact CB-CZ 4.39Å; L192-F200 HydrophobicContact CD2-CD2 4.46Å; L192-F200 HydrophobicContact CD2-CE2 3.45Å; L192-F200 VanDerWaalsContact CD2-CE2 3.45Å; L192-F200 HydrophobicContact CD2-CZ 3.62Å; L192-F200 HydrophobicContact CG-CE2 4.38Å
193	P	86.6	Confident	88.7	Confident	6 Å²	6	67.5 Å²	67.5	4%	0.039	33%	0.331	C	S	.	.	H	α-helix	trans	-67	-24	175.4	-21.9	33.7	0	0	0	114.3	E188 A189 I190 K197 F200 P207	E188-P193 WeakPolarHBondContact O-CD 3.33Å; A189-P193 WeakPolarHBondContact O-CG 3.44Å; I190-P193 WeakPolarHBondContact O-CD 3.36Å; P193-K197 WeakPolarHBondContact O-CE 3.49Å; P193-K197 WeakPolarHBondContact O-CG 3.43Å; P193-F200 HydrophobicContact CB-CD2 4.5Å; P193-F200 HydrophobicContact CB-CE2 3.99Å; P193-F200 HydrophobicContact CB-CZ 4.39Å; P193-F200 HydrophobicContact CG-CE1 4.48Å; P193-F200 HydrophobicContact CG-CE2 3.72Å; P193-F200 HydrophobicContact CG-CZ 3.67Å; P193-P207 HydrophobicContact CB-CB 3.69Å; P193-P207 HydrophobicContact CB-CG 4.35Å; P193-P207 HydrophobicContact CG-CB 3.67Å
194	M	83.6	Confident	88.4	Confident	26 Å²	26	69.7 Å²	69.7	13%	0.128	36%	0.359	C	S	.	.	H	α-helix	trans	-76.1	-45	178	-73.1	-69.5	-167.6	0	0	111.2	I190 V191 L192 P268 I270 Q313 K315	I190-M194 VanDerWaalsContact O-CG 3.22Å; I190-M194 WeakPolarHBondContact O-CG 3.49Å; V191-M194 PolarHBondContact O-N 3.07Å; L192-M194 VanDerWaalsContact C-N 3.26Å; L192-M194 PolarHBondContact O-N 3.21Å; M194-P268 HydrophobicContact CE-CB 4.13Å; M194-P268 HydrophobicContact SD-CB 3.65Å; M194-I270 HydrophobicContact CE-CG1 4.44Å; M194-Q313 WeakPolarHBondContact CE-O 3.36Å; M194-K315 HydrophobicContact CE-CB 4.36Å; M194-K315 HydrophobicContact CE-CG 3.7Å
195	N	85	Confident	88.2	Confident	105 Å²	105	68.4 Å²	68.4	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-89.2	-33	-174.5	-68.9	-15.8	0	0	0	113.8	V191 L192	V191-N195 PolarHBondContact O-N 3Å; L192-N195 PolarHBondContact O-N 3.42Å
196	H	85.9	Confident	87.7	Confident	90 Å²	90	71.8 Å²	71.8	42%	0.417	37%	0.37	S	S	.	.			trans	-130.1	60.6	-169.8	-59.1	96	0	0	0	112.2	L192 E198 K199	L192-H196 WeakPolarHBondContact O-CA 3.35Å; L192-H196 PolarHBondContact O-N 2.97Å; H196-E198 VanDerWaalsContact C-N 3.28Å; H196-E198 PolarHBondContact O-N 3.05Å; H196-K199 HydrophobicContact CB-CD 4.02Å; H196-K199 HydrophobicContact CB-CG 4.2Å; H196-K199 PolarHBondContact O-N 3.41Å
197	K	83.6	Confident	87.4	Confident	72 Å²	72	73 Å²	73	31%	0.313	38%	0.378	S	S	.	.	H	α-helix	trans	-59.7	-38.2	178.8	-68	176.8	-171	159.3	0	112.9	P193 K199 F200 E201	P193-K197 WeakPolarHBondContact O-CE 3.49Å; P193-K197 WeakPolarHBondContact O-CG 3.43Å; K197-K199 PolarHBondContact O-N 3.18Å; K197-K199 VanDerWaalsContact O-N 3.12Å; K197-F200 WeakPolarHBondContact O-CB 3.34Å; K197-F200 PolarHBondContact O-N 2.9Å; K197-E201 PolarHBondContact O-N 3.03Å; K197-E201 VanDerWaalsContact O-N 3.09Å
198	E	88.1	Confident	87.2	Confident	144 Å²	144	72.4 Å²	72.4	67%	0.673	38%	0.375	S	S	*	.	H	α-helix	trans	-55	-33.8	179.7	-61.2	177	-174.9	0	0	112.8	H196 F200 E201 N202	H196-E198 VanDerWaalsContact C-N 3.28Å; H196-E198 PolarHBondContact O-N 3.05Å; E198-F200 VanDerWaalsContact C-N 3.32Å; E198-F200 PolarHBondContact O-N 3.32Å; E198-E201 PolarHBondContact O-N 3.28Å; E198-N202 VanDerWaalsContact O-CB 3.27Å; E198-N202 WeakPolarHBondContact O-CB 3.28Å; E198-N202 PolarHBondContact O-N 3.21Å; E198-N202 PolarHBondContact O-ND2 2.89Å; E198-N202 VanDerWaalsContact O-ND2 3.16Å
199	K	88.9	Confident	86.9	Confident	123 Å²	123	70.4 Å²	70.4	54%	0.535	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-35.9	177.7	-69.1	-175.3	179.9	176.9	0	112.3	H196 K197 L203	H196-K199 HydrophobicContact CB-CD 4.02Å; H196-K199 HydrophobicContact CB-CG 4.2Å; H196-K199 PolarHBondContact O-N 3.41Å; K197-K199 PolarHBondContact O-N 3.18Å; K197-K199 VanDerWaalsContact O-N 3.12Å; K199-L203 WeakPolarHBondContact O-CB 3.42Å; K199-L203 PolarHBondContact O-N 2.9Å
200	F	86.9	Confident	86.9	Confident	27 Å²	27	70.4 Å²	70.4	12%	0.118	37%	0.365	C	S	.	.	H	α-helix	trans	-75.1	-40.3	176.7	-69.2	-87.5	0	0	0	111.3	L192 P193 K197 E198 L203 G204 I205 P207	L192-F200 HydrophobicContact CB-CE2 4.29Å; L192-F200 HydrophobicContact CB-CZ 4.39Å; L192-F200 HydrophobicContact CD2-CD2 4.46Å; L192-F200 HydrophobicContact CD2-CE2 3.45Å; L192-F200 VanDerWaalsContact CD2-CE2 3.45Å; L192-F200 HydrophobicContact CD2-CZ 3.62Å; L192-F200 HydrophobicContact CG-CE2 4.38Å; P193-F200 HydrophobicContact CB-CD2 4.5Å; P193-F200 HydrophobicContact CB-CE2 3.99Å; P193-F200 HydrophobicContact CB-CZ 4.39Å; P193-F200 HydrophobicContact CG-CE1 4.48Å; P193-F200 HydrophobicContact CG-CE2 3.72Å; P193-F200 HydrophobicContact CG-CZ 3.67Å; K197-F200 WeakPolarHBondContact O-CB 3.34Å; K197-F200 PolarHBondContact O-N 2.9Å; E198-F200 VanDerWaalsContact C-N 3.32Å; E198-F200 PolarHBondContact O-N 3.32Å; F200-L203 PolarHBondContact O-N 3.09Å; F200-G204 PolarHBondContact O-N 2.88Å; F200-I205 HydrophobicContact CD1-CD1 3.86Å; F200-I205 HydrophobicContact CD1-CG1 3.94Å; F200-I205 HydrophobicContact CE1-CD1 4.18Å; F200-I205 PolarHBondContact O-N 3.02Å; F200-P207 HydrophobicContact CD1-CB 4.12Å; F200-P207 HydrophobicContact CE1-CB 4.15Å; F200-P207 HydrophobicContact CG-CB 4.48Å; F200-P207 HydrophobicContact CZ-CB 4.49Å
201	E	87.3	Confident	87.2	Confident	143 Å²	143	70.4 Å²	70.4	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-64.8	-45.1	177.8	-68.8	176.7	-178.9	0	0	111.9	K197 E198 L203 G204	K197-E201 PolarHBondContact O-N 3.03Å; K197-E201 VanDerWaalsContact O-N 3.09Å; E198-E201 PolarHBondContact O-N 3.28Å; E201-L203 VanDerWaalsContact C-N 3.3Å; E201-L203 PolarHBondContact O-N 2.73Å; E201-G204 PolarHBondContact O-N 3.36Å; E201-G204 VanDerWaalsContact O-N 3.11Å
202	N	91.1	Very high	87.5	Confident	141 Å²	141	69.4 Å²	69.4	75%	0.754	36%	0.359	S	S	*	.	H	α-helix	trans	-64	-34.4	177.3	-72	-24.6	0	0	0	112.9	E198	E198-N202 VanDerWaalsContact O-CB 3.27Å; E198-N202 WeakPolarHBondContact O-CB 3.28Å; E198-N202 PolarHBondContact O-N 3.21Å; E198-N202 PolarHBondContact O-ND2 2.89Å; E198-N202 VanDerWaalsContact O-ND2 3.16Å
203	L	92	Very high	87.8	Confident	125 Å²	125	66.7 Å²	66.7	65%	0.654	35%	0.345	S	S	*	.	H	α-helix	trans	-82.1	-16.2	176.8	-172.3	60.1	0	0	0	112.3	K199 F200 E201 I205	K199-L203 WeakPolarHBondContact O-CB 3.42Å; K199-L203 PolarHBondContact O-N 2.9Å; F200-L203 PolarHBondContact O-N 3.09Å; E201-L203 VanDerWaalsContact C-N 3.3Å; E201-L203 PolarHBondContact O-N 2.73Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 HydrophobicContact CB-CG1 4.13Å; L203-I205 HydrophobicContact CD2-CD1 3.61Å; L203-I205 HydrophobicContact CD2-CG1 3.81Å; L203-I205 HydrophobicContact CD2-CG2 4.42Å; L203-I205 HydrophobicContact CG-CD1 4.35Å; L203-I205 HydrophobicContact CG-CG1 4Å; L203-I205 HydrophobicContact CG-CG2 4.16Å
204	G	87	Confident	88.2	Confident	67 Å²	67	68.7 Å²	68.7	69%	0.691	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	22.3	-179.1	0	0	0	0	0	114.4	F200 E201	F200-G204 PolarHBondContact O-N 2.88Å; E201-G204 PolarHBondContact O-N 3.36Å; E201-G204 VanDerWaalsContact O-N 3.11Å
205	I	88.1	Confident	88.6	Confident	87 Å²	87	68 Å²	68	45%	0.446	35%	0.351	S	S	.	.			trans	-107	146.7	179.6	58.9	159.5	0	0	0	111.4	F200 L203	F200-I205 HydrophobicContact CD1-CD1 3.86Å; F200-I205 HydrophobicContact CD1-CG1 3.94Å; F200-I205 HydrophobicContact CE1-CD1 4.18Å; F200-I205 PolarHBondContact O-N 3.02Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 HydrophobicContact CB-CG1 4.13Å; L203-I205 HydrophobicContact CD2-CD1 3.61Å; L203-I205 HydrophobicContact CD2-CG1 3.81Å; L203-I205 HydrophobicContact CD2-CG2 4.42Å; L203-I205 HydrophobicContact CG-CD1 4.35Å; L203-I205 HydrophobicContact CG-CG1 4Å; L203-I205 HydrophobicContact CG-CG2 4.16Å
206	Q	83.8	Confident	88.8	Confident	140 Å²	140	65 Å²	65	65%	0.654	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-84	135.2	174.9	-66	179.7	4.8	0	0	110.1	P310	Q206-P310 HydrophobicContact CB-CB 4.44Å; Q206-P310 HydrophobicContact CG-CB 4.21Å
207	P	85.7	Confident	89	Confident	26 Å²	26	64.7 Å²	64.7	17%	0.169	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-68.3	150.6	175.9	29.8	-34.9	0	0	0	110.5	P193 F200	P193-P207 HydrophobicContact CB-CB 3.69Å; P193-P207 HydrophobicContact CB-CG 4.35Å; P193-P207 HydrophobicContact CG-CB 3.67Å; F200-P207 HydrophobicContact CD1-CB 4.12Å; F200-P207 HydrophobicContact CE1-CB 4.15Å; F200-P207 HydrophobicContact CG-CB 4.48Å; F200-P207 HydrophobicContact CZ-CB 4.49Å
208	P	86.2	Confident	89.1	Confident	29 Å²	29	62.7 Å²	62.7	19%	0.188	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-60.6	142.6	176.2	26.1	-33.3	0	0	0	110.5	A189 K315 D337 R338	A189-P208 HydrophobicContact CB-CG 3.93Å; P208-K315 PolarHBondContact O-NZ 3.02Å; P208-D337 HydrophobicContact CB-CB 3.98Å; P208-R338 HydrophobicContact CB-CG 4.26Å
209	K	83.8	Confident	89.1	Confident	44 Å²	44	56.4 Å²	56.4	19%	0.191	32%	0.315	C	S	.	.			trans	-82	-38.5	-176.6	-70.7	-174.9	-179.3	-175	0	112.5	F308 V316 G334 D337	K209-F308 PolarHBondContact NZ-O 3.05Å; K209-V316 PolarHBondContact O-N 3.12Å; K209-G334 WeakPolarHBondContact CD-O 3.27Å; K209-D337 PolarHBondContact N-OD2 3.39Å
210	G	88.4	Confident	89	Confident	3 Å²	3	51.8 Å²	51.8	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	160	-176.6	0	0	0	0	0	114.3	V316 R335 D337 R338	G210-V316 CarbonylContact C-O 3.56Å; G210-V316 WeakPolarHBondContact CA-O 3.34Å; G210-R335 PolarHBondContact N-O 2.92Å; G210-D337 PolarHBondContact O-N 3.01Å; G210-D337 VanDerWaalsContact O-N 3.08Å; G210-R338 PolarHBondContact O-N 3.35Å
211	V	92.9	Very high	89.2	Confident	2 Å²	2	51 Å²	51	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132	-179.9	-175.4	0	0	0	0	108.9	L186 A189 I190 V316 I317 A318 R338 I340	L186-V211 HydrophobicContact CD1-CG1 4.49Å; A189-V211 HydrophobicContact CB-CG2 3.61Å; I190-V211 HydrophobicContact CD1-CB 4.49Å; I190-V211 HydrophobicContact CD1-CG2 3.97Å; I190-V211 HydrophobicContact CG1-CG2 3.89Å; V211-V316 PolarHBondContact N-O 2.93Å; V211-I317 WeakPolarHBondContact O-CA 3.48Å; V211-A318 PolarHBondContact O-N 3.4Å; V211-R338 CarbonylContact C-O 3.44Å; V211-R338 WeakPolarHBondContact CA-O 3.42Å; V211-R338 HydrophobicContact CG1-CB 4.31Å; V211-R338 HydrophobicContact CG2-CB 4.26Å; V211-I340 HydrophobicContact CG1-CD1 3.48Å; V211-I340 VanDerWaalsContact CG1-CD1 3.48Å; V211-I340 HydrophobicContact CG1-CG1 3.82Å
212	L	94.3	Very high	89.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.1	171.5	179.1	63.9	0	0	0	109.6	L276 A318 T320 V323 L326 L331 L336 R338 K339 I340	L212-L276 HydrophobicContact CD1-CD2 4.27Å; L212-A318 CarbonylContact C-O 3.44Å; L212-A318 WeakPolarHBondContact CA-O 3.41Å; L212-A318 HydrophobicContact CD1-CB 3.89Å; L212-T320 HydrophobicContact CD1-CG2 4.03Å; L212-V323 HydrophobicContact CD2-CG2 4.4Å; L212-L326 HydrophobicContact CD2-CD1 4.39Å; L212-L331 HydrophobicContact CD2-CD2 3.3Å; L212-L336 HydrophobicContact CB-CB 4.18Å; L212-L336 HydrophobicContact CB-CD1 4.17Å; L212-L336 HydrophobicContact CB-CD2 4.47Å; L212-L336 HydrophobicContact CD1-CD1 4.19Å; L212-L336 HydrophobicContact CD2-CD1 4.34Å; L212-L336 HydrophobicContact CG-CD1 4.47Å; L212-R338 PolarHBondContact N-O 3.34Å; L212-K339 CarbonylContact O-C 3.5Å; L212-K339 WeakPolarHBondContact O-CA 3.29Å; L212-I340 PolarHBondContact O-N 3.39Å
213	M	95.1	Very high	89.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.9	172.2	-61.6	-175.9	-62.3	0	0	109.5	L186 K221 L224 A225 F272 I317 A318 A319 T320 I340 F342	L186-M213 HydrophobicContact CD1-SD 3.74Å; M213-K221 HydrophobicContact CB-CB 4.49Å; M213-K221 HydrophobicContact CB-CD 4.34Å; M213-K221 HydrophobicContact CB-CG 4.2Å; M213-K221 HydrophobicContact CE-CB 4.5Å; M213-K221 WeakPolarHBondContact CE-O 3.4Å; M213-L224 HydrophobicContact SD-CD2 4.2Å; M213-A225 HydrophobicContact CE-CB 4.19Å; M213-F272 HydrophobicContact CE-CE2 3.82Å; M213-I317 HydrophobicContact CE-CG2 3.39Å; M213-I317 HydrophobicContact SD-CG2 4.32Å; M213-A318 PolarHBondContact N-O 3.33Å; M213-A319 HydrophobicContact CE-CB 4.18Å; M213-A319 WeakPolarHBondContact O-CA 3.43Å; M213-T320 PolarHBondContact O-N 2.88Å; M213-I340 WeakPolarHBondContact CA-O 3.46Å; M213-F342 HydrophobicContact CB-CD2 4.24Å; M213-F342 HydrophobicContact CB-CE2 3.63Å; M213-F342 HydrophobicContact CB-CZ 4.36Å; M213-F342 HydrophobicContact CG-CE2 3.69Å; M213-F342 HydrophobicContact CG-CZ 4.19Å; M213-F342 HydrophobicContact SD-CE2 3.9Å; M213-F342 HydrophobicContact SD-CZ 3.75Å
214	Y	94.4	Very high	89	Confident	49 Å²	49	36.3 Å²	36.3	19%	0.192	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.3	178	71.4	-85.5	0	0	0	111.9	T320 V323 K339 I340 E341 F342	Y214-T320 WeakPolarHBondContact CA-O 3.42Å; Y214-V323 HydrophobicContact CD2-CB 4.24Å; Y214-V323 HydrophobicContact CD2-CG1 3.95Å; Y214-V323 HydrophobicContact CE2-CG1 4.37Å; Y214-V323 HydrophobicContact CG-CB 4.2Å; Y214-V323 HydrophobicContact CG-CG1 4.4Å; Y214-V323 HydrophobicContact CG-CG2 4.49Å; Y214-K339 HydrophobicContact CE1-CB 3.98Å; Y214-I340 PolarHBondContact N-O 3.49Å; Y214-E341 HydrophobicContact CD2-CG 4.3Å; Y214-E341 HydrophobicContact CE1-CB 4.16Å; Y214-E341 HydrophobicContact CE2-CB 3.9Å; Y214-E341 HydrophobicContact CE2-CG 3.59Å; Y214-E341 PolarHBondContact OH-OE2 3.13Å; Y214-F342 PolarHBondContact O-N 3.32Å
215	G	92	Very high	89.1	Confident	10 Å²	10	33.1 Å²	33.1	10%	0.103	19%	0.194	C	C	.	.	S	Bend	trans	152.2	-176.8	179.8	0	0	0	0	0	112.4	K221 N321	G215-K221 PolarHBondContact O-NZ 3.39Å; G215-N321 WeakPolarHBondContact O-CA 3.46Å
216	P	90.2	Very high	88.9	Confident	43 Å²	43	33.7 Å²	33.7	28%	0.279	19%	0.19	S	C	.	.	S	Bend	trans	-58.8	153.3	177.2	-23.6	35	0	0	0	112.7	T219 F342 M344	P216-T219 HydrophobicContact CB-CG2 4.17Å; P216-T219 WeakPolarHBondContact O-CG2 3.46Å; P216-T219 PolarHBondContact O-OG1 3.17Å; P216-F342 VanDerWaalsContact CD-O 3.23Å; P216-F342 WeakPolarHBondContact CD-O 3.41Å; P216-M344 HydrophobicContact CB-CE 3.59Å; P216-M344 HydrophobicContact CB-SD 4.06Å; P216-M344 HydrophobicContact CG-CE 3.84Å; P216-M344 HydrophobicContact CG-CG 4.35Å; P216-M344 HydrophobicContact CG-SD 4.13Å
217	P	88.8	Confident	89.1	Confident	83 Å²	83	27 Å²	27	54%	0.539	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	146	173.6	29.1	-34.7	0	0	0	110.8	N380	P217-N380 PolarHBondContact O-ND2 3.22Å; P217-N380 VanDerWaalsContact O-ND2 3.09Å
218	G	85.8	Confident	89.1	Confident	31 Å²	31	25.8 Å²	25.8	32%	0.32	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	11.9	178.1	0	0	0	0	0	115.6	G381 A382	G218-G381 PolarHBondContact O-N 3.24Å; G218-G381 VanDerWaalsContact O-N 3.14Å; G218-A382 PolarHBondContact O-N 3.09Å; G218-A382 VanDerWaalsContact O-N 3.14Å
219	T	87.6	Confident	88.9	Confident	12 Å²	12	24.8 Å²	24.8	7%	0.074	15%	0.145	C	C	.	.	S	Bend	trans	-87.5	-2.1	173.9	50.6	0	0	0	0	114.2	P216 M344	P216-T219 HydrophobicContact CB-CG2 4.17Å; P216-T219 WeakPolarHBondContact O-CG2 3.46Å; P216-T219 PolarHBondContact O-OG1 3.17Å; T219-M344 HydrophobicContact CG2-SD 4.34Å
220	G	86.6	Confident	88.8	Confident	25 Å²	25	24 Å²	24	26%	0.258	15%	0.147	S	C	.	.	S	Bend	trans	94.2	18.1	172.8	0	0	0	0	0	116.5	T222 L223 L224	G220-T222 PolarHBondContact O-N 2.94Å; G220-L223 WeakPolarHBondContact O-CB 3.2Å; G220-L223 PolarHBondContact O-N 3.44Å; G220-L224 PolarHBondContact O-N 3.45Å
221	K	91.3	Very high	88.5	Confident	12 Å²	12	28.4 Å²	28.4	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-53.2	-49.7	177.1	-68.4	173.7	-70.9	-170	0	113.7	M213 G215 L223 L224 A225 A319 T320 N321 F342	M213-K221 HydrophobicContact CB-CB 4.49Å; M213-K221 HydrophobicContact CB-CD 4.34Å; M213-K221 HydrophobicContact CB-CG 4.2Å; M213-K221 HydrophobicContact CE-CB 4.5Å; M213-K221 WeakPolarHBondContact CE-O 3.4Å; G215-K221 PolarHBondContact O-NZ 3.39Å; K221-L223 VanDerWaalsContact C-N 3.28Å; K221-L223 PolarHBondContact O-N 2.95Å; K221-L224 PolarHBondContact O-N 2.89Å; K221-A225 PolarHBondContact O-N 3.16Å; K221-A319 HydrophobicContact CB-CB 4.47Å; K221-T320 PolarHBondContact NZ-O 2.9Å; K221-N321 PolarHBondContact NZ-OD1 2.79Å; K221-F342 HydrophobicContact CD-CD2 4.25Å; K221-F342 HydrophobicContact CD-CG 4.32Å; K221-F342 HydrophobicContact CG-CB 4.32Å; K221-F342 HydrophobicContact CG-CD1 3.83Å; K221-F342 HydrophobicContact CG-CD2 3.74Å; K221-F342 HydrophobicContact CG-CE1 3.99Å; K221-F342 HydrophobicContact CG-CE2 3.95Å; K221-F342 HydrophobicContact CG-CG 3.69Å; K221-F342 HydrophobicContact CG-CZ 4.03Å
222	T	88.6	Confident	87.8	Confident	42 Å²	42	29.1 Å²	29.1	26%	0.258	17%	0.171	S	C	.	.	H	α-helix	trans	-66.4	-30.7	177.5	-45.3	0	0	0	0	112.2	G220 R226 F272 D274	G220-T222 PolarHBondContact O-N 2.94Å; T222-R226 WeakPolarHBondContact O-CG 3.46Å; T222-R226 PolarHBondContact O-N 3.14Å; T222-F272 HydrophobicContact CG2-CE1 4.14Å; T222-F272 HydrophobicContact CG2-CZ 4.31Å; T222-D274 PolarHBondContact OG1-OD2 3.24Å; T222-D274 VanDerWaalsContact OG1-OD2 3.12Å
223	L	88.6	Confident	87.1	Confident	57 Å²	57	37.2 Å²	37.2	30%	0.298	21%	0.207	S	C	.	.	H	α-helix	trans	-70.7	-44.3	178.3	-165.7	164.9	0	0	0	110.2	E171 I176 G220 K221 A225 R226 A227	E171-L223 WeakPolarHBondContact OE2-CG 3.41Å; I176-L223 HydrophobicContact CD1-CD2 3.54Å; I176-L223 HydrophobicContact CG1-CD2 3.45Å; I176-L223 VanDerWaalsContact CG1-CD2 3.45Å; G220-L223 WeakPolarHBondContact O-CB 3.2Å; G220-L223 PolarHBondContact O-N 3.44Å; K221-L223 VanDerWaalsContact C-N 3.28Å; K221-L223 PolarHBondContact O-N 2.95Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.12Å; L223-R226 PolarHBondContact O-N 3.11Å; L223-A227 PolarHBondContact O-N 3.04Å
224	L	90.5	Very high	86.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-40	176	-172.4	64.8	0	0	0	112.4	Y173 I176 I183 L186 M213 G220 K221 R226 A227 C228 F342	Y173-L224 HydrophobicContact CD1-CD1 4.28Å; Y173-L224 HydrophobicContact CE1-CD1 4.13Å; I176-L224 HydrophobicContact CD1-CB 4.32Å; I176-L224 HydrophobicContact CD1-CD1 3.54Å; I183-L224 HydrophobicContact CB-CD1 4.44Å; I183-L224 HydrophobicContact CG1-CD1 3.56Å; L186-L224 HydrophobicContact CB-CD2 4.31Å; L186-L224 HydrophobicContact CD1-CD2 3.87Å; L186-L224 HydrophobicContact CD1-CG 4.25Å; L186-L224 HydrophobicContact CD2-CG 4.38Å; L186-L224 HydrophobicContact CG-CD2 4.47Å; M213-L224 HydrophobicContact SD-CD2 4.2Å; G220-L224 PolarHBondContact O-N 3.45Å; K221-L224 PolarHBondContact O-N 2.89Å; L224-R226 PolarHBondContact O-N 3.36Å; L224-A227 PolarHBondContact O-N 3.31Å; L224-C228 WeakPolarHBondContact O-CB 3.27Å; L224-C228 PolarHBondContact O-N 3.27Å; L224-F342 HydrophobicContact CB-CE1 4.49Å; L224-F342 HydrophobicContact CB-CZ 4.38Å; L224-F342 HydrophobicContact CD2-CE1 4.16Å; L224-F342 HydrophobicContact CD2-CZ 3.58Å
225	A	87.8	Confident	86.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-43.8	175.6	0	0	0	0	0	112.4	M213 K221 L223 C228 A229 F272	M213-A225 HydrophobicContact CE-CB 4.19Å; K221-A225 PolarHBondContact O-N 3.16Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.12Å; A225-C228 PolarHBondContact O-N 2.82Å; A225-A229 PolarHBondContact O-N 3.05Å; A225-F272 HydrophobicContact CB-CD1 4.45Å; A225-F272 HydrophobicContact CB-CD2 3.47Å; A225-F272 VanDerWaalsContact CB-CD2 3.47Å; A225-F272 HydrophobicContact CB-CE1 4.34Å; A225-F272 HydrophobicContact CB-CE2 3.35Å; A225-F272 HydrophobicContact CB-CG 4.04Å; A225-F272 HydrophobicContact CB-CZ 3.83Å
226	R	85.2	Confident	86	Confident	99 Å²	99	37.7 Å²	37.7	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-43.4	178	-72	177.8	-164.6	-168.7	4.1	112.2	P169 E171 T222 L223 L224 C228 A229 A230	P169-R226 HydrophobicContact CB-CB 4.06Å; P169-R226 HydrophobicContact CG-CB 4.27Å; P169-R226 WeakPolarHBondContact CG-O 3.44Å; E171-R226 WeakPolarHBondContact OE2-CB 3.4Å; T222-R226 WeakPolarHBondContact O-CG 3.46Å; T222-R226 PolarHBondContact O-N 3.14Å; L223-R226 PolarHBondContact O-N 3.11Å; L224-R226 PolarHBondContact O-N 3.36Å; R226-C228 VanDerWaalsContact C-N 3.29Å; R226-C228 PolarHBondContact O-N 3.03Å; R226-A229 WeakPolarHBondContact O-CB 3.5Å; R226-A229 PolarHBondContact O-N 3.42Å; R226-A230 PolarHBondContact O-N 3.07Å
227	A	86.9	Confident	86	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-37.7	175.5	0	0	0	0	0	112	E171 Y173 I176 L223 L224 A230 Q231	E171-A227 HydrophobicContact CB-CB 4.32Å; Y173-A227 HydrophobicContact CD1-CB 4.18Å; Y173-A227 HydrophobicContact CE1-CB 4.23Å; I176-A227 HydrophobicContact CD1-CB 3.83Å; L223-A227 PolarHBondContact O-N 3.04Å; L224-A227 PolarHBondContact O-N 3.31Å; A227-A230 WeakPolarHBondContact O-CB 3.27Å; A227-A230 PolarHBondContact O-N 3.25Å; A227-Q231 WeakPolarHBondContact O-CG 3.4Å; A227-Q231 PolarHBondContact O-N 2.89Å
228	C	86.1	Confident	86.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-40.2	174.3	-171.5	0	0	0	0	112.6	Y173 L186 L224 A225 R226 A230 Q231 T232	Y173-C228 WeakPolarHBondContact OH-CA 3.48Å; L186-C228 HydrophobicContact CD2-CB 3.62Å; L186-C228 VanDerWaalsContact CD2-SG 3.52Å; L224-C228 WeakPolarHBondContact O-CB 3.27Å; L224-C228 PolarHBondContact O-N 3.27Å; A225-C228 PolarHBondContact O-N 2.82Å; R226-C228 VanDerWaalsContact C-N 3.29Å; R226-C228 PolarHBondContact O-N 3.03Å; C228-A230 VanDerWaalsContact C-N 3.34Å; C228-Q231 PolarHBondContact O-N 2.87Å; C228-T232 WeakPolarHBondContact O-CG2 3.43Å; C228-T232 PolarHBondContact O-N 3.42Å; C228-T232 VanDerWaalsContact O-N 3.15Å; C228-T232 PolarHBondContact O-OG1 3.09Å
229	A	82.4	Confident	86.4	Confident	8 Å²	8	34.8 Å²	34.8	7%	0.066	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-42.3	175.6	0	0	0	0	0	111.7	P169 A225 R226 Q231 T232 F236	P169-A229 HydrophobicContact CG-CB 4.09Å; A225-A229 PolarHBondContact O-N 3.05Å; R226-A229 WeakPolarHBondContact O-CB 3.5Å; R226-A229 PolarHBondContact O-N 3.42Å; A229-Q231 VanDerWaalsContact C-N 3.31Å; A229-Q231 PolarHBondContact O-N 3.38Å; A229-T232 PolarHBondContact O-OG1 3.26Å; A229-F236 HydrophobicContact CB-CB 3.93Å; A229-F236 HydrophobicContact CB-CD1 4.23Å; A229-F236 HydrophobicContact CB-CD2 3.31Å; A229-F236 HydrophobicContact CB-CE2 3.75Å; A229-F236 HydrophobicContact CB-CG 3.57Å; A229-F236 HydrophobicContact CB-CZ 4.37Å
230	A	82.1	Confident	86.5	Confident	28 Å²	28	35.3 Å²	35.3	23%	0.231	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-42.4	178.1	0	0	0	0	0	112.6	P169 E171 R226 A227 C228	P169-A230 HydrophobicContact CG-CB 4.44Å; P169-A230 WeakPolarHBondContact O-CB 3.3Å; E171-A230 WeakPolarHBondContact O-CB 3.22Å; R226-A230 PolarHBondContact O-N 3.07Å; A227-A230 WeakPolarHBondContact O-CB 3.27Å; A227-A230 PolarHBondContact O-N 3.25Å; C228-A230 VanDerWaalsContact C-N 3.34Å
231	Q	81.1	Confident	86.6	Confident	95 Å²	95	34.1 Å²	34.1	44%	0.444	17%	0.172	S	C	.	.	H	α-helix	trans	-83	-32.7	-172.6	-67.9	-70	-22.8	0	0	113.5	Y173 A227 C228 A229 K233	Y173-Q231 HydrophobicContact CD2-CG 3.96Å; Y173-Q231 HydrophobicContact CE2-CB 3.99Å; Y173-Q231 HydrophobicContact CE2-CG 3.57Å; A227-Q231 WeakPolarHBondContact O-CG 3.4Å; A227-Q231 PolarHBondContact O-N 2.89Å; C228-Q231 PolarHBondContact O-N 2.87Å; A229-Q231 VanDerWaalsContact C-N 3.31Å; A229-Q231 PolarHBondContact O-N 3.38Å; Q231-K233 VanDerWaalsContact C-N 3.35Å; Q231-K233 PolarHBondContact O-N 3.36Å
232	T	78.6	Confident	86.6	Confident	18 Å²	18	36.5 Å²	36.5	11%	0.11	19%	0.189	C	C	.	.	H	α-helix	trans	-78.1	-16.8	-174.9	48.6	0	0	0	0	114.1	V191 C228 A229 A234 I270	V191-T232 HydrophobicContact CB-CG2 4.31Å; V191-T232 HydrophobicContact CG1-CG2 4.25Å; V191-T232 HydrophobicContact CG2-CG2 3.64Å; C228-T232 WeakPolarHBondContact O-CG2 3.43Å; C228-T232 PolarHBondContact O-N 3.42Å; C228-T232 VanDerWaalsContact O-N 3.15Å; C228-T232 PolarHBondContact O-OG1 3.09Å; A229-T232 PolarHBondContact O-OG1 3.26Å; T232-A234 PolarHBondContact O-N 2.98Å; T232-I270 HydrophobicContact CG2-CD1 4.22Å; T232-I270 WeakPolarHBondContact OG1-CD1 3.28Å
233	K	79.8	Confident	86.7	Confident	170 Å²	170	38.9 Å²	38.9	74%	0.739	20%	0.197	S	C	*	.			trans	51.9	17.6	-172.3	-58.8	179	-179.7	174.9	0	113.7	Q231	Q231-K233 VanDerWaalsContact C-N 3.35Å; Q231-K233 PolarHBondContact O-N 3.36Å
234	A	82.3	Confident	86.7	Confident	14 Å²	14	36.2 Å²	36.2	12%	0.116	18%	0.183	C	C	.	.			trans	-83.2	158.3	176.9	0	0	0	0	0	110	T232 F236 I270	T232-A234 PolarHBondContact O-N 2.98Å; A234-F236 PolarHBondContact O-N 2.7Å; A234-I270 HydrophobicContact CB-CD1 4.21Å; A234-I270 HydrophobicContact CB-CG1 4.24Å
235	T	86.7	Confident	86.6	Confident	39 Å²	39	39.3 Å²	39.3	24%	0.239	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	120.6	174.2	-48.3	0	0	0	0	108.9	L237 K266 P268 S269 I270	T235-L237 HydrophobicContact CG2-CD1 3.75Å; T235-K266 HydrophobicContact CG2-CB 3.89Å; T235-K266 HydrophobicContact CG2-CD 3.95Å; T235-K266 PolarHBondContact OG1-O 3.44Å; T235-P268 PolarHBondContact N-O 2.88Å; T235-S269 CarbonylContact O-C 3.56Å; T235-S269 VanDerWaalsContact O-CA 3.22Å; T235-S269 WeakPolarHBondContact O-CA 3.37Å; T235-S269 WeakPolarHBondContact O-CB 3.48Å; T235-I270 PolarHBondContact O-N 3.2Å
236	F	89.2	Confident	86.6	Confident	16 Å²	16	41.9 Å²	41.9	7%	0.07	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.7	-179.2	-175	-101.6	0	0	0	110.4	V165 A229 A234 K238 I270 F272	V165-F236 HydrophobicContact CB-CD1 4.08Å; V165-F236 WeakPolarHBondContact CB-O 3.41Å; V165-F236 HydrophobicContact CG2-CD1 3.67Å; V165-F236 HydrophobicContact CG2-CE1 4.21Å; V165-F236 PolarHBondContact N-O 3.27Å; A229-F236 HydrophobicContact CB-CB 3.93Å; A229-F236 HydrophobicContact CB-CD1 4.23Å; A229-F236 HydrophobicContact CB-CD2 3.31Å; A229-F236 HydrophobicContact CB-CE2 3.75Å; A229-F236 HydrophobicContact CB-CG 3.57Å; A229-F236 HydrophobicContact CB-CZ 4.37Å; A234-F236 PolarHBondContact O-N 2.7Å; F236-K238 HydrophobicContact CD1-CB 4.48Å; F236-K238 HydrophobicContact CE1-CB 3.98Å; F236-I270 HydrophobicContact CD2-CB 4.23Å; F236-I270 HydrophobicContact CD2-CG2 4.16Å; F236-I270 HydrophobicContact CE2-CG2 4.33Å; F236-F272 HydrophobicContact CE1-CB 4.27Å; F236-F272 HydrophobicContact CE2-CB 3.5Å; F236-F272 HydrophobicContact CE2-CG 4.25Å; F236-F272 HydrophobicContact CZ-CB 3.33Å; F236-F272 AromaticContact CZ-CD1 3.97Å; F236-F272 HydrophobicContact CZ-CD1 3.97Å; F236-F272 AromaticContact CZ-CG 3.78Å; F236-F272 HydrophobicContact CZ-CG 3.78Å
237	L	90.4	Very high	86.7	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.7	174.5	-82.8	77.6	0	0	0	108.6	T235 L262 A263 I270 I271 F272	T235-L237 HydrophobicContact CG2-CD1 3.75Å; L237-L262 HydrophobicContact CD2-CD2 4.18Å; L237-L262 HydrophobicContact CD2-CG 4.44Å; L237-A263 HydrophobicContact CD2-CB 4.25Å; L237-I270 PolarHBondContact N-O 3.35Å; L237-I271 HydrophobicContact CB-CG1 4.44Å; L237-F272 PolarHBondContact O-N 2.97Å
238	K	90.8	Very high	86.8	Confident	85 Å²	85	51.9 Å²	51.9	37%	0.37	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.6	177.2	-177.2	-174.1	175.2	-166.9	0	109.7	M163 V165 F236 F272	M163-K238 WeakPolarHBondContact CB-O 3.47Å; M163-K238 WeakPolarHBondContact CG-O 3.47Å; M163-K238 PolarHBondContact O-N 3.15Å; V165-K238 HydrophobicContact CG2-CB 3.76Å; F236-K238 HydrophobicContact CD1-CB 4.48Å; F236-K238 HydrophobicContact CE1-CB 3.98Å; K238-F272 HydrophobicContact CG-CD1 4.36Å
239	L	91.3	Very high	86.9	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.9	177.6	-172.1	154.4	0	0	0	108.8	M163 L244 A259 F272 I273 D274	M163-L239 HydrophobicContact SD-CD1 4.36Å; M163-L239 HydrophobicContact SD-CG 4.31Å; L239-L244 HydrophobicContact CD1-CD1 4.37Å; L239-L244 HydrophobicContact CD1-CD2 4.09Å; L239-L244 HydrophobicContact CD1-CG 4.45Å; L239-L244 HydrophobicContact CD2-CD1 3.61Å; L239-L244 HydrophobicContact CD2-CD2 4.35Å; L239-L244 HydrophobicContact CD2-CG 3.83Å; L239-L244 HydrophobicContact CG-CD2 4.47Å; L239-L244 HydrophobicContact CG-CG 4.44Å; L239-A259 HydrophobicContact CD1-CB 4.43Å; L239-F272 PolarHBondContact N-O 3.45Å; L239-F272 VanDerWaalsContact O-O 3.06Å; L239-I273 HydrophobicContact CD2-CB 4.44Å; L239-I273 HydrophobicContact CD2-CG1 4.18Å; L239-I273 HydrophobicContact CD2-CG2 3.91Å; L239-I273 CarbonylContact O-C 3.54Å; L239-I273 VanDerWaalsContact O-CA 3.3Å; L239-I273 WeakPolarHBondContact O-CA 3.5Å; L239-D274 PolarHBondContact O-N 3.02Å
240	A	91.2	Very high	87.2	Confident	23 Å²	23	59.1 Å²	59.1	19%	0.19	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.6	170.4	0	0	0	0	0	109.8	P242 Q243	A240-P242 VanDerWaalsContact C-N 3.34Å; A240-Q243 HydrophobicContact CB-CG 4.02Å; A240-Q243 VanDerWaalsContact O-CB 3.3Å; A240-Q243 WeakPolarHBondContact O-CB 3.34Å; A240-Q243 PolarHBondContact O-N 2.94Å
241	G	88.6	Confident	87.6	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-48.6	-47.5	-178.7	0	0	0	0	0	113.8	Q243 L244 D274 I279	G241-Q243 PolarHBondContact O-N 3.44Å; G241-L244 WeakPolarHBondContact O-CB 3.37Å; G241-L244 PolarHBondContact O-N 2.99Å; G241-L244 VanDerWaalsContact O-N 3.14Å; G241-D274 PolarHBondContact N-O 3.49Å; G241-I279 WeakPolarHBondContact O-CG2 3.33Å
242	P	90.3	Very high	88.1	Confident	62 Å²	62	55.5 Å²	55.5	40%	0.403	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-60.9	-26.1	177.3	-26.5	35.2	0	0	0	114.9	A240 L244 V245 E275 A278	A240-P242 VanDerWaalsContact C-N 3.34Å; P242-L244 PolarHBondContact O-N 3.38Å; P242-V245 PolarHBondContact O-N 3.44Å; P242-V245 VanDerWaalsContact O-N 3.13Å; P242-E275 WeakPolarHBondContact CG-OE2 3.35Å; P242-A278 HydrophobicContact CG-CB 3.86Å
243	Q	89.8	Confident	88.7	Confident	92 Å²	92	55.1 Å²	55.1	43%	0.43	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-67.5	-20.5	178.9	-66.8	174.7	-27.9	0	0	112.6	M163 A240 G241 V245 Q246	M163-Q243 HydrophobicContact CE-CB 4.18Å; A240-Q243 HydrophobicContact CB-CG 4.02Å; A240-Q243 VanDerWaalsContact O-CB 3.3Å; A240-Q243 WeakPolarHBondContact O-CB 3.34Å; A240-Q243 PolarHBondContact O-N 2.94Å; G241-Q243 PolarHBondContact O-N 3.44Å; Q243-V245 VanDerWaalsContact C-N 3.3Å; Q243-Q246 PolarHBondContact O-NE2 2.96Å
244	L	88.6	Confident	89.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-78.2	-16.9	176.2	-67.3	-179.2	0	0	0	113.2	L239 G241 P242 Q246 G252 L255 V256 I279 T297	L239-L244 HydrophobicContact CD1-CD1 4.37Å; L239-L244 HydrophobicContact CD1-CD2 4.09Å; L239-L244 HydrophobicContact CD1-CG 4.45Å; L239-L244 HydrophobicContact CD2-CD1 3.61Å; L239-L244 HydrophobicContact CD2-CD2 4.35Å; L239-L244 HydrophobicContact CD2-CG 3.83Å; L239-L244 HydrophobicContact CG-CD2 4.47Å; L239-L244 HydrophobicContact CG-CG 4.44Å; G241-L244 WeakPolarHBondContact O-CB 3.37Å; G241-L244 PolarHBondContact O-N 2.99Å; G241-L244 VanDerWaalsContact O-N 3.14Å; P242-L244 PolarHBondContact O-N 3.38Å; L244-Q246 PolarHBondContact O-N 3.41Å; L244-G252 VanDerWaalsContact O-CA 3.24Å; L244-G252 WeakPolarHBondContact O-CA 3.37Å; L244-L255 HydrophobicContact CD2-CD2 3.53Å; L244-V256 HydrophobicContact CD1-CG2 3.9Å; L244-V256 HydrophobicContact CD2-CG2 3.6Å; L244-V256 HydrophobicContact CG-CG2 4.33Å; L244-I279 HydrophobicContact CB-CG2 4.09Å; L244-I279 HydrophobicContact CD1-CD1 3.61Å; L244-T297 HydrophobicContact CB-CG2 3.96Å
245	V	88.8	Confident	89.7	Confident	65 Å²	65	50.8 Å²	50.8	39%	0.394	26%	0.262	S	S	.	.			trans	-85.6	112.4	177.8	-173.6	0	0	0	0	108.6	P242 Q243 I279 V294	P242-V245 PolarHBondContact O-N 3.44Å; P242-V245 VanDerWaalsContact O-N 3.13Å; Q243-V245 VanDerWaalsContact C-N 3.3Å; V245-I279 HydrophobicContact CG2-CG2 4.15Å; V245-V294 HydrophobicContact CG1-CG2 4.04Å; V245-V294 HydrophobicContact CG2-CG2 4.07Å
246	Q	89	Confident	89.9	Confident	54 Å²	54	49 Å²	49	25%	0.252	25%	0.251	S	S	.	.			trans	-118.9	153.6	-176.1	-65.2	-64	-44.5	0	0	111	Q243 L244 F248 D251	Q243-Q246 PolarHBondContact O-NE2 2.96Å; L244-Q246 PolarHBondContact O-N 3.41Å; Q246-F248 VanDerWaalsContact C-N 3.33Å; Q246-D251 HydrophobicContact CB-CB 3.78Å; Q246-D251 HydrophobicContact CG-CB 3.98Å
247	M	87.4	Confident	89.9	Confident	174 Å²	174	54.1 Å²	54.1	86%	0.857	27%	0.27	S	S	*	.	S	Bend	trans	-68.7	-33.6	177.9	-177.3	-179.3	170.5	0	0	112.1
248	F	88.8	Confident	89.9	Confident	136 Å²	136	55.3 Å²	55.3	60%	0.596	28%	0.276	S	S	*	.	S	Bend	trans	-88.8	134.7	-179.5	-62.5	-71.4	0	0	0	111.4	Q246 G250 D251	Q246-F248 VanDerWaalsContact C-N 3.33Å; F248-G250 PolarHBondContact O-N 3.49Å; F248-D251 HydrophobicContact CB-CB 4.39Å; F248-D251 PolarHBondContact O-N 2.8Å
249	I	88.6	Confident	89.9	Confident	143 Å²	143	51.4 Å²	51.4	73%	0.733	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	104.2	177.7	-61.1	172.4	0	0	0	108.3
250	G	88.3	Confident	89.8	Confident	17 Å²	17	51.1 Å²	51.1	18%	0.175	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	119.7	-11.8	164.1	0	0	0	0	0	112.7	F248 G252 A253 K254 E293	F248-G250 PolarHBondContact O-N 3.49Å; G250-G252 VanDerWaalsContact C-N 3.33Å; G250-A253 PolarHBondContact O-N 3.18Å; G250-K254 WeakPolarHBondContact O-CB 3.44Å; G250-K254 PolarHBondContact O-N 3.22Å; G250-E293 PolarHBondContact N-OE1 3.36Å
251	D	90.6	Very high	89.7	Confident	46 Å²	46	51.7 Å²	51.7	25%	0.246	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-39.2	178.7	-80.2	10.7	0	0	0	111	Q246 F248 K254 L255	Q246-D251 HydrophobicContact CB-CB 3.78Å; Q246-D251 HydrophobicContact CG-CB 3.98Å; F248-D251 HydrophobicContact CB-CB 4.39Å; F248-D251 PolarHBondContact O-N 2.8Å; D251-K254 PolarHBondContact O-N 3.35Å; D251-L255 VanDerWaalsContact O-CB 3.28Å; D251-L255 WeakPolarHBondContact O-CB 3.2Å; D251-L255 PolarHBondContact O-N 2.86Å
252	G	90.7	Very high	89.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-50.4	175.2	0	0	0	0	0	112.1	L244 G250 K254 L255 V256	L244-G252 VanDerWaalsContact O-CA 3.24Å; L244-G252 WeakPolarHBondContact O-CA 3.37Å; G250-G252 VanDerWaalsContact C-N 3.33Å; G252-K254 PolarHBondContact O-N 2.94Å; G252-L255 PolarHBondContact O-N 2.85Å; G252-V256 WeakPolarHBondContact O-CG2 3.5Å; G252-V256 PolarHBondContact O-N 2.88Å
253	A	90.7	Very high	89.7	Confident	10 Å²	10	49 Å²	49	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-37.3	177.3	0	0	0	0	0	112.8	G250 R257 E300	G250-A253 PolarHBondContact O-N 3.18Å; A253-R257 WeakPolarHBondContact O-CG 3.22Å; A253-R257 PolarHBondContact O-N 3.24Å; A253-E300 HydrophobicContact CB-CB 3.96Å; A253-E300 HydrophobicContact CB-CG 4.02Å
254	K	91.3	Very high	89.6	Confident	91 Å²	91	48.8 Å²	48.8	40%	0.396	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-45.3	172.8	-172.8	-170.7	172	-164.7	0	110.9	G250 D251 G252 V256 R257 D258	G250-K254 WeakPolarHBondContact O-CB 3.44Å; G250-K254 PolarHBondContact O-N 3.22Å; D251-K254 PolarHBondContact O-N 3.35Å; G252-K254 PolarHBondContact O-N 2.94Å; K254-V256 VanDerWaalsContact C-N 3.33Å; K254-V256 PolarHBondContact O-N 2.63Å; K254-R257 WeakPolarHBondContact O-CB 3.49Å; K254-R257 PolarHBondContact O-N 3.32Å; K254-R257 VanDerWaalsContact O-N 3.13Å; K254-D258 WeakPolarHBondContact CE-OD2 3.49Å; K254-D258 PolarHBondContact O-N 3.23Å
255	L	92	Very high	89.5	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-40.7	-178.7	-163.2	151.2	0	0	0	111.8	R159 V160 M163 L244 D251 G252 D258 A259	R159-L255 HydrophobicContact CB-CD1 4.01Å; V160-L255 HydrophobicContact CG2-CD2 4.16Å; V160-L255 HydrophobicContact CG2-CG 3.88Å; M163-L255 HydrophobicContact CE-CD1 4.17Å; M163-L255 HydrophobicContact CE-CD2 3.47Å; M163-L255 VanDerWaalsContact CE-CD2 3.47Å; M163-L255 HydrophobicContact CE-CG 4.37Å; M163-L255 HydrophobicContact SD-CD2 3.92Å; L244-L255 HydrophobicContact CD2-CD2 3.53Å; D251-L255 VanDerWaalsContact O-CB 3.28Å; D251-L255 WeakPolarHBondContact O-CB 3.2Å; D251-L255 PolarHBondContact O-N 2.86Å; G252-L255 PolarHBondContact O-N 2.85Å; L255-D258 PolarHBondContact O-N 2.84Å; L255-A259 VanDerWaalsContact O-CB 3.3Å; L255-A259 WeakPolarHBondContact O-CB 3.36Å; L255-A259 PolarHBondContact O-N 2.8Å
256	V	91.5	Very high	89.4	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-52.3	172.1	173.8	0	0	0	0	110.2	L244 G252 K254 D258 A259 F260 T297 E300 L301 Q304	L244-V256 HydrophobicContact CD1-CG2 3.9Å; L244-V256 HydrophobicContact CD2-CG2 3.6Å; L244-V256 HydrophobicContact CG-CG2 4.33Å; G252-V256 WeakPolarHBondContact O-CG2 3.5Å; G252-V256 PolarHBondContact O-N 2.88Å; K254-V256 VanDerWaalsContact C-N 3.33Å; K254-V256 PolarHBondContact O-N 2.63Å; V256-D258 VanDerWaalsContact C-N 3.34Å; V256-D258 PolarHBondContact O-N 3.5Å; V256-A259 PolarHBondContact O-N 2.72Å; V256-F260 HydrophobicContact CG1-CD2 3.72Å; V256-F260 HydrophobicContact CG1-CE2 3.8Å; V256-F260 VanDerWaalsContact O-CD2 3.22Å; V256-F260 WeakPolarHBondContact O-CD2 3.46Å; V256-F260 PolarHBondContact O-N 3.41Å; V256-T297 HydrophobicContact CG2-CG2 3.85Å; V256-E300 HydrophobicContact CB-CG 4.45Å; V256-E300 HydrophobicContact CG1-CG 4.36Å; V256-L301 HydrophobicContact CG1-CB 4.21Å; V256-L301 HydrophobicContact CG1-CD1 4.22Å; V256-Q304 HydrophobicContact CG1-CG 4.1Å
257	R	89.8	Confident	89.2	Confident	124 Å²	124	54.2 Å²	54.2	47%	0.468	27%	0.27	S	S	.	.	H	α-helix	trans	-57.9	-44.7	179.4	-72.8	-174.7	-67.2	161	0.8	112.8	A253 K254 F260 A261 E300	A253-R257 WeakPolarHBondContact O-CG 3.22Å; A253-R257 PolarHBondContact O-N 3.24Å; K254-R257 WeakPolarHBondContact O-CB 3.49Å; K254-R257 PolarHBondContact O-N 3.32Å; K254-R257 VanDerWaalsContact O-N 3.13Å; R257-F260 PolarHBondContact O-N 2.99Å; R257-A261 WeakPolarHBondContact O-CB 3.5Å; R257-A261 PolarHBondContact O-N 3.37Å; R257-E300 VanDerWaalsContact CD-OE1 3.25Å; R257-E300 WeakPolarHBondContact CD-OE1 3.38Å; R257-E300 HydrophobicContact CG-CG 3.99Å; R257-E300 WeakPolarHBondContact CG-OE1 3.05Å
258	D	90.8	Very high	89.2	Confident	29 Å²	29	48.5 Å²	48.5	16%	0.155	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-41.7	-179.7	-69.7	-5.2	0	0	0	111.1	Y156 V160 K254 L255 V256 A261 L262	Y156-D258 HydrophobicContact CD1-CB 4.21Å; V160-D258 HydrophobicContact CG2-CB 3.91Å; K254-D258 WeakPolarHBondContact CE-OD2 3.49Å; K254-D258 PolarHBondContact O-N 3.23Å; L255-D258 PolarHBondContact O-N 2.84Å; V256-D258 VanDerWaalsContact C-N 3.34Å; V256-D258 PolarHBondContact O-N 3.5Å; D258-A261 PolarHBondContact O-N 3.27Å; D258-L262 WeakPolarHBondContact O-CB 3.3Å; D258-L262 PolarHBondContact O-N 3.02Å
259	A	90.6	Very high	89.2	Confident	3 Å²	3	42 Å²	42	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-43.3	176.1	0	0	0	0	0	112.3	V160 L239 L255 V256 A263	V160-A259 HydrophobicContact CG1-CB 4.13Å; V160-A259 HydrophobicContact CG2-CB 4.47Å; L239-A259 HydrophobicContact CD1-CB 4.43Å; L255-A259 VanDerWaalsContact O-CB 3.3Å; L255-A259 WeakPolarHBondContact O-CB 3.36Å; L255-A259 PolarHBondContact O-N 2.8Å; V256-A259 PolarHBondContact O-N 2.72Å; A259-A263 WeakPolarHBondContact O-CB 3.45Å; A259-A263 PolarHBondContact O-N 3.32Å
260	F	89.6	Confident	89.3	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-44	174.9	-84.7	-77.5	0	0	0	111.4	V256 R257 A263 K264 I271 L301 Q304 L305 F308 V316	V256-F260 HydrophobicContact CG1-CD2 3.72Å; V256-F260 HydrophobicContact CG1-CE2 3.8Å; V256-F260 VanDerWaalsContact O-CD2 3.22Å; V256-F260 WeakPolarHBondContact O-CD2 3.46Å; V256-F260 PolarHBondContact O-N 3.41Å; R257-F260 PolarHBondContact O-N 2.99Å; F260-A263 WeakPolarHBondContact O-CB 3.07Å; F260-A263 PolarHBondContact O-N 3.41Å; F260-K264 WeakPolarHBondContact O-CG 3.25Å; F260-K264 PolarHBondContact O-N 3.08Å; F260-I271 HydrophobicContact CD1-CD1 3.51Å; F260-I271 HydrophobicContact CE1-CD1 3.39Å; F260-I271 HydrophobicContact CG-CD1 4.2Å; F260-I271 HydrophobicContact CZ-CD1 3.99Å; F260-L301 HydrophobicContact CE2-CD1 3.5Å; F260-L301 VanDerWaalsContact CE2-CD1 3.5Å; F260-L301 HydrophobicContact CZ-CD1 3.77Å; F260-Q304 HydrophobicContact CB-CG 4.48Å; F260-Q304 HydrophobicContact CD1-CB 4.31Å; F260-Q304 HydrophobicContact CD2-CB 3.69Å; F260-Q304 HydrophobicContact CD2-CG 3.92Å; F260-Q304 HydrophobicContact CE1-CB 4.49Å; F260-Q304 HydrophobicContact CE2-CB 3.93Å; F260-Q304 HydrophobicContact CG-CB 3.92Å; F260-Q304 HydrophobicContact CG-CG 4.23Å; F260-Q304 HydrophobicContact CZ-CB 4.32Å; F260-L305 HydrophobicContact CZ-CD2 4.19Å; F260-F308 HydrophobicContact CD1-CE1 4.41Å; F260-F308 AromaticContact CD1-CE2 3.71Å; F260-F308 HydrophobicContact CD1-CE2 3.71Å; F260-F308 AromaticContact CD1-CZ 3.33Å; F260-F308 HydrophobicContact CD1-CZ 3.33Å; F260-F308 AromaticContact CE1-CE2 3.38Å; F260-F308 HydrophobicContact CE1-CE2 3.38Å; F260-F308 AromaticContact CE1-CZ 3.4Å; F260-F308 HydrophobicContact CE1-CZ 3.4Å; F260-F308 HydrophobicContact CZ-CE2 4.42Å; F260-V316 HydrophobicContact CE1-CG2 4.14Å; F260-V316 HydrophobicContact CZ-CG2 4.44Å
261	A	88.5	Confident	89.5	Confident	34 Å²	34	34.6 Å²	34.6	28%	0.281	18%	0.175	S	C	.	.	H	α-helix	trans	-60.8	-44.7	178	0	0	0	0	0	112.5	Y156 R257 D258 A263 K264 E265	Y156-A261 HydrophobicContact CE1-CB 3.7Å; R257-A261 WeakPolarHBondContact O-CB 3.5Å; R257-A261 PolarHBondContact O-N 3.37Å; D258-A261 PolarHBondContact O-N 3.27Å; A261-A263 VanDerWaalsContact C-N 3.29Å; A261-A263 PolarHBondContact O-N 3.16Å; A261-K264 WeakPolarHBondContact O-CB 3.5Å; A261-K264 PolarHBondContact O-N 2.96Å; A261-K264 VanDerWaalsContact O-N 3.07Å; A261-E265 PolarHBondContact O-N 3.39Å; A261-E265 VanDerWaalsContact O-N 3.07Å
262	L	89.3	Confident	89.6	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-41.4	173.8	-178.8	65	0	0	0	111.4	Y156 V160 L237 D258 K264 E265 K266	Y156-L262 HydrophobicContact CD2-CB 4.38Å; Y156-L262 HydrophobicContact CD2-CD1 3.81Å; Y156-L262 HydrophobicContact CE2-CB 4.39Å; Y156-L262 HydrophobicContact CE2-CD1 3.82Å; Y156-L262 HydrophobicContact CG-CB 4.46Å; V160-L262 HydrophobicContact CG1-CB 4.2Å; V160-L262 HydrophobicContact CG1-CD2 3.68Å; L237-L262 HydrophobicContact CD2-CD2 4.18Å; L237-L262 HydrophobicContact CD2-CG 4.44Å; D258-L262 WeakPolarHBondContact O-CB 3.3Å; D258-L262 PolarHBondContact O-N 3.02Å; L262-K264 VanDerWaalsContact C-N 3.27Å; L262-K264 PolarHBondContact O-N 3.29Å; L262-E265 PolarHBondContact O-N 3.01Å; L262-K266 HydrophobicContact CD1-CD 4.11Å; L262-K266 HydrophobicContact CD1-CG 4.33Å; L262-K266 HydrophobicContact CG-CD 4.48Å; L262-K266 PolarHBondContact O-N 3.01Å
263	A	89	Confident	89.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-31.7	175.9	0	0	0	0	0	112.7	L237 A259 F260 A261 A267 S269 I271 V314	L237-A263 HydrophobicContact CD2-CB 4.25Å; A259-A263 WeakPolarHBondContact O-CB 3.45Å; A259-A263 PolarHBondContact O-N 3.32Å; F260-A263 WeakPolarHBondContact O-CB 3.07Å; F260-A263 PolarHBondContact O-N 3.41Å; A261-A263 VanDerWaalsContact C-N 3.29Å; A261-A263 PolarHBondContact O-N 3.16Å; A263-A267 PolarHBondContact O-N 3.41Å; A263-S269 WeakPolarHBondContact CB-OG 3.34Å; A263-S269 PolarHBondContact O-OG 2.84Å; A263-I271 HydrophobicContact CB-CD1 3.7Å; A263-I271 HydrophobicContact CB-CG1 3.92Å; A263-V314 HydrophobicContact CB-CG1 4.08Å; A263-V314 HydrophobicContact CB-CG2 4.47Å
264	K	87.4	Confident	89.8	Confident	88 Å²	88	33.7 Å²	33.7	38%	0.383	17%	0.169	S	C	.	.	H	α-helix	trans	-68.3	-43	174	-52.9	-164.1	167.9	168.8	0	111.6	F260 A261 L262 K266 A267 M312	F260-K264 WeakPolarHBondContact O-CG 3.25Å; F260-K264 PolarHBondContact O-N 3.08Å; A261-K264 WeakPolarHBondContact O-CB 3.5Å; A261-K264 PolarHBondContact O-N 2.96Å; A261-K264 VanDerWaalsContact O-N 3.07Å; L262-K264 VanDerWaalsContact C-N 3.27Å; L262-K264 PolarHBondContact O-N 3.29Å; K264-K266 VanDerWaalsContact C-N 3.34Å; K264-A267 WeakPolarHBondContact O-CB 3.43Å; K264-M312 HydrophobicContact CB-CE 3.38Å; K264-M312 HydrophobicContact CD-CE 3.5Å; K264-M312 VanDerWaalsContact CD-CE 3.5Å; K264-M312 HydrophobicContact CD-SD 4.1Å; K264-M312 HydrophobicContact CG-CE 3.19Å; K264-M312 HydrophobicContact CG-SD 4.19Å
265	E	87.2	Confident	89.8	Confident	121 Å²	121	33.8 Å²	33.8	57%	0.565	17%	0.171	S	C	*	.	H	α-helix	trans	-64.6	-40.4	178.4	-168.6	-171.3	171.7	0	0	111.2	Y156 A261 L262 A267	Y156-E265 WeakPolarHBondContact CE2-OE2 3.28Å; Y156-E265 PolarHBondContact OH-OE2 3.04Å; A261-E265 PolarHBondContact O-N 3.39Å; A261-E265 VanDerWaalsContact O-N 3.07Å; L262-E265 PolarHBondContact O-N 3.01Å; E265-A267 VanDerWaalsContact C-N 3.33Å; E265-A267 PolarHBondContact O-N 3.44Å
266	K	87.3	Confident	89.8	Confident	68 Å²	68	33.8 Å²	33.8	30%	0.296	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	26	-177.7	-61.7	-166.6	168.9	-172.7	0	114.6	E164 T235 L262 K264 P268	E164-K266 IonicContact OE1-NZ 2.71Å; E164-K266 PolarHBondContact OE1-NZ 2.9Å; E164-K266 IonicContact OE2-NZ 2.66Å; E164-K266 PolarHBondContact OE2-NZ 3Å; T235-K266 HydrophobicContact CG2-CB 3.89Å; T235-K266 HydrophobicContact CG2-CD 3.95Å; T235-K266 PolarHBondContact OG1-O 3.44Å; L262-K266 HydrophobicContact CD1-CD 4.11Å; L262-K266 HydrophobicContact CD1-CG 4.33Å; L262-K266 HydrophobicContact CG-CD 4.48Å; L262-K266 PolarHBondContact O-N 3.01Å; K264-K266 VanDerWaalsContact C-N 3.34Å; K266-P268 CarbonylContact O-C 3.56Å
267	A	84.8	Confident	89.7	Confident	44 Å²	44	35.3 Å²	35.3	36%	0.364	18%	0.179	S	C	.	.			trans	-61.1	134.4	177.8	0	0	0	0	0	111.4	A263 K264 E265 Q313	A263-A267 PolarHBondContact O-N 3.41Å; K264-A267 WeakPolarHBondContact O-CB 3.43Å; E265-A267 VanDerWaalsContact C-N 3.33Å; E265-A267 PolarHBondContact O-N 3.44Å; A267-Q313 HydrophobicContact CB-CB 4.25Å
268	P	87.8	Confident	89.6	Confident	54 Å²	54	31.2 Å²	31.2	35%	0.351	17%	0.172	S	C	.	.	S	Bend	cis	-77.3	135.4	4.1	30.9	-35	0	0	0	113.7	M194 T235 K266 Q313	M194-P268 HydrophobicContact CE-CB 4.13Å; M194-P268 HydrophobicContact SD-CB 3.65Å; T235-P268 PolarHBondContact N-O 2.88Å; K266-P268 CarbonylContact O-C 3.56Å; P268-Q313 HydrophobicContact CB-CB 4.23Å
269	S	88.7	Confident	89.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	153.3	-176.2	64.6	0	0	0	0	113.9	T235 A263 Q313 V314 K315	T235-S269 CarbonylContact O-C 3.56Å; T235-S269 VanDerWaalsContact O-CA 3.22Å; T235-S269 WeakPolarHBondContact O-CA 3.37Å; T235-S269 WeakPolarHBondContact O-CB 3.48Å; A263-S269 WeakPolarHBondContact CB-OG 3.34Å; A263-S269 PolarHBondContact O-OG 2.84Å; S269-Q313 PolarHBondContact N-O 3.13Å; S269-Q313 VanDerWaalsContact N-O 3.08Å; S269-V314 WeakPolarHBondContact O-CA 3.3Å; S269-K315 PolarHBondContact O-N 3.19Å
270	I	90.3	Very high	89.1	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.7	177.2	-59.8	173.1	0	0	0	107.8	I190 M194 T232 A234 T235 F236 L237 K315 I317	I190-I270 HydrophobicContact CG2-CD1 3.86Å; I190-I270 HydrophobicContact CG2-CG1 4.32Å; M194-I270 HydrophobicContact CE-CG1 4.44Å; T232-I270 HydrophobicContact CG2-CD1 4.22Å; T232-I270 WeakPolarHBondContact OG1-CD1 3.28Å; A234-I270 HydrophobicContact CB-CD1 4.21Å; A234-I270 HydrophobicContact CB-CG1 4.24Å; T235-I270 PolarHBondContact O-N 3.2Å; F236-I270 HydrophobicContact CD2-CB 4.23Å; F236-I270 HydrophobicContact CD2-CG2 4.16Å; F236-I270 HydrophobicContact CE2-CG2 4.33Å; L237-I270 PolarHBondContact N-O 3.35Å; I270-K315 CarbonylContact C-O 3.6Å; I270-K315 WeakPolarHBondContact CA-O 3.33Å; I270-I317 HydrophobicContact CG2-CD1 3.63Å; I270-I317 HydrophobicContact CG2-CG1 3.93Å
271	I	92.2	Very high	88.9	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	116.3	173.3	-57.6	172.4	0	0	0	107.7	L237 F260 A263 I273 V314 K315 V316 I317	L237-I271 HydrophobicContact CB-CG1 4.44Å; F260-I271 HydrophobicContact CD1-CD1 3.51Å; F260-I271 HydrophobicContact CE1-CD1 3.39Å; F260-I271 HydrophobicContact CG-CD1 4.2Å; F260-I271 HydrophobicContact CZ-CD1 3.99Å; A263-I271 HydrophobicContact CB-CD1 3.7Å; A263-I271 HydrophobicContact CB-CG1 3.92Å; I271-I273 HydrophobicContact CG2-CG1 4.11Å; I271-V314 HydrophobicContact CD1-CG1 3.87Å; I271-V314 HydrophobicContact CG1-CG1 4.2Å; I271-K315 PolarHBondContact N-O 2.94Å; I271-V316 HydrophobicContact CB-CG2 4.47Å; I271-V316 WeakPolarHBondContact O-CA 3.46Å; I271-I317 PolarHBondContact O-N 2.85Å
272	F	93.4	Very high	88.4	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.009	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.5	174	177	-111.6	0	0	0	110.4	M213 T222 A225 F236 L237 K238 L239 D274 I317 A319	M213-F272 HydrophobicContact CE-CE2 3.82Å; T222-F272 HydrophobicContact CG2-CE1 4.14Å; T222-F272 HydrophobicContact CG2-CZ 4.31Å; A225-F272 HydrophobicContact CB-CD1 4.45Å; A225-F272 HydrophobicContact CB-CD2 3.47Å; A225-F272 VanDerWaalsContact CB-CD2 3.47Å; A225-F272 HydrophobicContact CB-CE1 4.34Å; A225-F272 HydrophobicContact CB-CE2 3.35Å; A225-F272 HydrophobicContact CB-CG 4.04Å; A225-F272 HydrophobicContact CB-CZ 3.83Å; F236-F272 HydrophobicContact CE1-CB 4.27Å; F236-F272 HydrophobicContact CE2-CB 3.5Å; F236-F272 HydrophobicContact CE2-CG 4.25Å; F236-F272 HydrophobicContact CZ-CB 3.33Å; F236-F272 AromaticContact CZ-CD1 3.97Å; F236-F272 HydrophobicContact CZ-CD1 3.97Å; F236-F272 AromaticContact CZ-CG 3.78Å; F236-F272 HydrophobicContact CZ-CG 3.78Å; L237-F272 PolarHBondContact O-N 2.97Å; K238-F272 HydrophobicContact CG-CD1 4.36Å; L239-F272 PolarHBondContact N-O 3.45Å; L239-F272 VanDerWaalsContact O-O 3.06Å; F272-D274 HydrophobicContact CD1-CB 4.47Å; F272-D274 HydrophobicContact CE1-CB 3.67Å; F272-D274 HydrophobicContact CZ-CB 4Å; F272-I317 CarbonylContact C-O 3.56Å; F272-I317 WeakPolarHBondContact CA-O 3.47Å; F272-I317 HydrophobicContact CD2-CB 3.91Å; F272-I317 HydrophobicContact CD2-CG2 3.67Å; F272-I317 HydrophobicContact CE2-CG2 4.02Å; F272-A319 HydrophobicContact CE2-CB 3.97Å; F272-A319 HydrophobicContact CZ-CB 4.05Å
273	I	93.4	Very high	87.6	Confident	3 Å²	3	41 Å²	41	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	107.5	176.3	-53.9	177.8	0	0	0	108.2	L239 I271 L276 L301 V316 I317 A318 A319	L239-I273 HydrophobicContact CD2-CB 4.44Å; L239-I273 HydrophobicContact CD2-CG1 4.18Å; L239-I273 HydrophobicContact CD2-CG2 3.91Å; L239-I273 CarbonylContact O-C 3.54Å; L239-I273 VanDerWaalsContact O-CA 3.3Å; L239-I273 WeakPolarHBondContact O-CA 3.5Å; I271-I273 HydrophobicContact CG2-CG1 4.11Å; I273-L276 HydrophobicContact CG2-CD1 3.84Å; I273-L301 HydrophobicContact CD1-CD1 4.01Å; I273-L301 HydrophobicContact CD1-CD2 4.2Å; I273-V316 HydrophobicContact CD1-CG1 4.11Å; I273-I317 PolarHBondContact N-O 2.93Å; I273-A318 CarbonylContact O-C 3.6Å; I273-A318 WeakPolarHBondContact O-CA 3.39Å; I273-A319 PolarHBondContact O-N 3.18Å
274	D	92.1	Very high	86.6	Confident	33 Å²	33	47.8 Å²	47.8	18%	0.176	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	154.5	172.1	-145.2	-16.1	0	0	0	110.6	T222 L239 G241 F272 L276	T222-D274 PolarHBondContact OG1-OD2 3.24Å; T222-D274 VanDerWaalsContact OG1-OD2 3.12Å; L239-D274 PolarHBondContact O-N 3.02Å; G241-D274 PolarHBondContact N-O 3.49Å; F272-D274 HydrophobicContact CD1-CB 4.47Å; F272-D274 HydrophobicContact CE1-CB 3.67Å; F272-D274 HydrophobicContact CZ-CB 4Å; D274-L276 PolarHBondContact O-N 3.3Å
275	E	90.9	Very high	85.6	Confident	92 Å²	92	51.9 Å²	51.9	43%	0.43	26%	0.262	S	S	.	.			trans	51	51.1	179	-60	-176.9	166	0	0	113.4	P242 D277 A278 A319	P242-E275 WeakPolarHBondContact CG-OE2 3.35Å; E275-D277 VanDerWaalsContact CA-OD1 3.27Å; E275-D277 WeakPolarHBondContact CA-OD1 3.28Å; E275-D277 PolarHBondContact O-N 3.32Å; E275-D277 VanDerWaalsContact O-N 3.08Å; E275-A278 WeakPolarHBondContact O-CB 3.47Å; E275-A278 PolarHBondContact O-N 2.9Å; E275-A319 PolarHBondContact N-O 3.39Å
276	L	90.7	Very high	84.4	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-58.9	-23	179.4	-172.8	67.9	0	0	0	112.7	L212 I273 D274 A278 I279 G280 L301 A318 A319 L326 L330 L336	L212-L276 HydrophobicContact CD1-CD2 4.27Å; I273-L276 HydrophobicContact CG2-CD1 3.84Å; D274-L276 PolarHBondContact O-N 3.3Å; L276-A278 PolarHBondContact O-N 2.9Å; L276-I279 HydrophobicContact CD1-CD1 3.92Å; L276-I279 HydrophobicContact CD1-CG1 4.04Å; L276-I279 WeakPolarHBondContact O-CG1 3.36Å; L276-I279 PolarHBondContact O-N 3.31Å; L276-G280 WeakPolarHBondContact O-CA 3.49Å; L276-G280 PolarHBondContact O-N 3.07Å; L276-L301 HydrophobicContact CD1-CD2 4.22Å; L276-A318 HydrophobicContact CD2-CB 3.92Å; L276-A319 PolarHBondContact N-O 2.83Å; L276-A319 VanDerWaalsContact N-O 3.11Å; L276-L326 HydrophobicContact CD2-CD1 4.16Å; L276-L326 HydrophobicContact CD2-CD2 4.27Å; L276-L326 HydrophobicContact CG-CD2 4.21Å; L276-L330 HydrophobicContact CD2-CD1 4.41Å; L276-L336 HydrophobicContact CD2-CD1 4.21Å
277	D	89.6	Confident	83.3	Confident	34 Å²	34	54.5 Å²	54.5	18%	0.182	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-61.6	-21.1	174.4	47	-15.8	0	0	0	114.4	E275 I279 T281 I325	E275-D277 VanDerWaalsContact CA-OD1 3.27Å; E275-D277 WeakPolarHBondContact CA-OD1 3.28Å; E275-D277 PolarHBondContact O-N 3.32Å; E275-D277 VanDerWaalsContact O-N 3.08Å; D277-I279 VanDerWaalsContact C-N 3.27Å; D277-I279 PolarHBondContact O-N 2.88Å; D277-T281 WeakPolarHBondContact O-CG2 3.32Å; D277-I325 HydrophobicContact CB-CD1 3.43Å; D277-I325 VanDerWaalsContact CB-CD1 3.43Å; D277-I325 HydrophobicContact CB-CG1 4.18Å
278	A	88.3	Confident	82.7	Confident	37 Å²	37	60 Å²	60	31%	0.306	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-65.2	-31.3	175.4	0	0	0	0	0	113.1	P242 E275 L276	P242-A278 HydrophobicContact CG-CB 3.86Å; E275-A278 WeakPolarHBondContact O-CB 3.47Å; E275-A278 PolarHBondContact O-N 2.9Å; L276-A278 PolarHBondContact O-N 2.9Å
279	I	87.7	Confident	81.9	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-23.5	-176.9	65.2	-177.9	0	0	0	113.3	G241 L244 V245 L276 D277 T281 V294 M298 L301	G241-I279 WeakPolarHBondContact O-CG2 3.33Å; L244-I279 HydrophobicContact CB-CG2 4.09Å; L244-I279 HydrophobicContact CD1-CD1 3.61Å; V245-I279 HydrophobicContact CG2-CG2 4.15Å; L276-I279 HydrophobicContact CD1-CD1 3.92Å; L276-I279 HydrophobicContact CD1-CG1 4.04Å; L276-I279 WeakPolarHBondContact O-CG1 3.36Å; L276-I279 PolarHBondContact O-N 3.31Å; D277-I279 VanDerWaalsContact C-N 3.27Å; D277-I279 PolarHBondContact O-N 2.88Å; I279-T281 VanDerWaalsContact C-N 3.32Å; I279-T281 PolarHBondContact O-N 3.35Å; I279-V294 HydrophobicContact CB-CG1 4.31Å; I279-V294 HydrophobicContact CG2-CG1 4.5Å; I279-M298 WeakPolarHBondContact O-CB 3.48Å; I279-L301 HydrophobicContact CD1-CD2 3.63Å
280	G	83.1	Confident	81.1	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.			trans	-90.1	14.6	-168.7	0	0	0	0	0	114.5	L276 L326 D327	L276-G280 WeakPolarHBondContact O-CA 3.49Å; L276-G280 PolarHBondContact O-N 3.07Å; G280-L326 CarbonylContact O-C 3.59Å; G280-L326 WeakPolarHBondContact O-CA 3.32Å; G280-D327 PolarHBondContact O-N 3Å
281	T	84.7	Confident	80.5	Confident	53 Å²	53	67.2 Å²	67.2	33%	0.325	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-62.3	144	-176.3	51.8	0	0	0	0	112	D277 I279 I325	D277-T281 WeakPolarHBondContact O-CG2 3.32Å; I279-T281 VanDerWaalsContact C-N 3.32Å; I279-T281 PolarHBondContact O-N 3.35Å; T281-I325 CarbonylContact C-O 3.52Å; T281-I325 WeakPolarHBondContact CA-O 3.47Å
282	K	78.7	Confident	80.1	Confident	87 Å²	87	76.6 Å²	76.6	38%	0.378	39%	0.391	S	S	.	.			trans	-53.3	142.5	172.9	-79.2	170.7	179.1	159.8	0	110.9	F284 D324 I325 L326	K282-F284 HydrophobicContact CB-CE2 4.36Å; K282-F284 HydrophobicContact CB-CZ 4.49Å; K282-F284 WeakPolarHBondContact O-CD2 3.18Å; K282-F284 WeakPolarHBondContact O-CE2 3.48Å; K282-F284 PolarHBondContact O-N 3.13Å; K282-D324 PolarHBondContact NZ-O 2.93Å; K282-I325 PolarHBondContact N-O 2.82Å; K282-L326 WeakPolarHBondContact CE-O 3.43Å
283	R	72.5	Confident	79.7	Confident	139 Å²	139	77.6 Å²	77.6	53%	0.525	40%	0.396	S	S	.	.			trans	-63.9	109.4	176.3	-56.7	179.2	-164.1	-159.8	-1.6	109	L299 D327	R283-L299 VanDerWaalsContact NH2-CD2 3.32Å; R283-D327 IonicContact NE-OD2 3.24Å; R283-D327 PolarHBondContact NE-OD2 3.44Å; R283-D327 IonicContact NH2-OD2 3.98Å
284	F	68.7	Low	79.4	Confident	142 Å²	142	78.6 Å²	78.6	62%	0.623	40%	0.402	S	S	*	.			trans	-94.4	141.2	162	-63.1	-76.9	0	0	0	107.6	K282 S286	K282-F284 HydrophobicContact CB-CE2 4.36Å; K282-F284 HydrophobicContact CB-CZ 4.49Å; K282-F284 WeakPolarHBondContact O-CD2 3.18Å; K282-F284 WeakPolarHBondContact O-CE2 3.48Å; K282-F284 PolarHBondContact O-N 3.13Å; F284-S286 PolarHBondContact O-N 2.95Å; F284-S286 PolarHBondContact O-OG 3.32Å
285	D	64.8	Low	79.2	Confident	174 Å²	174	79.2 Å²	79.2	93%	0.93	40%	0.404	S	S	*	.			trans	-75.2	56	172.1	-160.5	19.1	0	0	0	109.1
286	S	62.9	Low	79.1	Confident	41 Å²	41	79.6 Å²	79.6	29%	0.287	40%	0.401	S	S	.	.			trans	-92	119.6	178.4	30.2	0	0	0	0	109.3	F284 K288 D291	F284-S286 PolarHBondContact O-N 2.95Å; F284-S286 PolarHBondContact O-OG 3.32Å; S286-K288 PolarHBondContact O-N 3.47Å; S286-D291 WeakPolarHBondContact CB-OD2 3.48Å; S286-D291 PolarHBondContact OG-OD2 2.95Å
287	E	64.4	Low	79.1	Confident	203 Å²	203	79.6 Å²	79.6	95%	0.949	40%	0.401	S	S	*	.			trans	-68	3.6	177.8	-66.6	-174.4	146.1	0	0	114.2
288	K	72.3	Confident	79.1	Confident	159 Å²	159	78 Å²	78	69%	0.691	39%	0.393	S	S	*	.			trans	-78.6	128.3	-177.8	-66.6	-175.2	-177.7	177.8	0	110.6	S286 G290 D291	S286-K288 PolarHBondContact O-N 3.47Å; K288-G290 PolarHBondContact O-N 3.33Å; K288-G290 VanDerWaalsContact O-N 3.12Å; K288-D291 PolarHBondContact O-N 3.46Å
289	A	70	Confident	79.2	Confident	86 Å²	86	79.4 Å²	79.4	71%	0.711	39%	0.394	S	S	*	.	H	α-helix	trans	-57.2	-29.5	-176.2	0	0	0	0	0	114.8
290	G	71.9	Confident	79.3	Confident	51 Å²	51	81.1 Å²	81.1	53%	0.526	40%	0.403	S	S	.	.	H	α-helix	trans	-65.4	-43.5	-179.1	0	0	0	0	0	113.6	K288 R292 E293	K288-G290 PolarHBondContact O-N 3.33Å; K288-G290 VanDerWaalsContact O-N 3.12Å; G290-R292 VanDerWaalsContact C-N 3.27Å; G290-R292 PolarHBondContact O-N 2.99Å; G290-E293 PolarHBondContact O-N 3.38Å
291	D	78.9	Confident	79.6	Confident	71 Å²	71	81.3 Å²	81.3	38%	0.38	40%	0.403	S	S	.	.	H	α-helix	trans	-67.6	-32.9	-177.6	-63.8	-14.8	0	0	0	111.1	S286 K288 E293 V294 Q295	S286-D291 WeakPolarHBondContact CB-OD2 3.48Å; S286-D291 PolarHBondContact OG-OD2 2.95Å; K288-D291 PolarHBondContact O-N 3.46Å; D291-E293 VanDerWaalsContact C-N 3.34Å; D291-E293 PolarHBondContact O-N 2.98Å; D291-V294 PolarHBondContact O-N 3.28Å; D291-Q295 WeakPolarHBondContact O-CB 3.1Å; D291-Q295 VanDerWaalsContact O-CG 3.25Å; D291-Q295 WeakPolarHBondContact O-CG 3.34Å; D291-Q295 PolarHBondContact O-N 2.87Å
292	R	82.9	Confident	79.8	Confident	198 Å²	198	79 Å²	79	75%	0.747	39%	0.389	S	S	*	.	H	α-helix	trans	-65.5	-34.8	-179.7	-168.7	173.8	177.8	174.9	-0.3	112.7	G290 R296	G290-R292 VanDerWaalsContact C-N 3.27Å; G290-R292 PolarHBondContact O-N 2.99Å; R292-R296 PolarHBondContact O-N 3.23Å
293	E	85.3	Confident	80.3	Confident	24 Å²	24	79.2 Å²	79.2	11%	0.112	40%	0.395	C	S	.	.	H	α-helix	trans	-73.2	-39.9	178	-178.3	59.2	-175.1	0	0	112.1	G250 G290 D291 Q295 R296 T297	G250-E293 PolarHBondContact N-OE1 3.36Å; G290-E293 PolarHBondContact O-N 3.38Å; D291-E293 VanDerWaalsContact C-N 3.34Å; D291-E293 PolarHBondContact O-N 2.98Å; E293-Q295 VanDerWaalsContact C-N 3.34Å; E293-R296 VanDerWaalsContact CD-NH2 3.29Å; E293-R296 PolarHBondContact O-N 3.35Å; E293-R296 IonicContact OE1-CZ 3.8Å; E293-R296 IonicContact OE1-NH2 3.08Å; E293-R296 PolarHBondContact OE1-NH2 3.4Å; E293-R296 IonicContact OE2-CZ 3.8Å; E293-R296 IonicContact OE2-NE 2.92Å; E293-R296 PolarHBondContact OE2-NE 2.91Å; E293-R296 VanDerWaalsContact OE2-NE 3.1Å; E293-R296 IonicContact OE2-NH2 3Å; E293-R296 PolarHBondContact OE2-NH2 3.32Å; E293-T297 PolarHBondContact O-N 3.01Å; E293-T297 PolarHBondContact O-OG1 3.08Å; E293-T297 VanDerWaalsContact O-OG1 3.11Å
294	V	87.6	Confident	81	Confident	23 Å²	23	74.4 Å²	74.4	14%	0.139	38%	0.378	C	S	.	.	H	α-helix	trans	-60.7	-46.5	174	180	0	0	0	0	110.1	V245 I279 D291 R296 T297 M298	V245-V294 HydrophobicContact CG1-CG2 4.04Å; V245-V294 HydrophobicContact CG2-CG2 4.07Å; I279-V294 HydrophobicContact CB-CG1 4.31Å; I279-V294 HydrophobicContact CG2-CG1 4.5Å; D291-V294 PolarHBondContact O-N 3.28Å; V294-R296 VanDerWaalsContact C-N 3.32Å; V294-R296 PolarHBondContact O-N 3.31Å; V294-T297 PolarHBondContact O-N 3.1Å; V294-M298 PolarHBondContact O-N 3.28Å
295	Q	87.5	Confident	81.7	Confident	47 Å²	47	68 Å²	68	22%	0.22	35%	0.35	C	S	.	.	H	α-helix	trans	-59.7	-40.2	175.9	-73.3	175	12	0	0	112.4	D291 E293 M298 L299	D291-Q295 WeakPolarHBondContact O-CB 3.1Å; D291-Q295 VanDerWaalsContact O-CG 3.25Å; D291-Q295 WeakPolarHBondContact O-CG 3.34Å; D291-Q295 PolarHBondContact O-N 2.87Å; E293-Q295 VanDerWaalsContact C-N 3.34Å; Q295-M298 WeakPolarHBondContact O-CB 3.39Å; Q295-M298 PolarHBondContact O-N 3.19Å; Q295-L299 VanDerWaalsContact O-CG 3.31Å; Q295-L299 WeakPolarHBondContact O-CG 3.22Å; Q295-L299 PolarHBondContact O-N 3.4Å
296	R	88.4	Confident	82.4	Confident	99 Å²	99	63.1 Å²	63.1	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-40.9	177.6	-170.9	171.3	63.6	143.4	0.1	112	R292 E293 V294 M298 L299 E300	R292-R296 PolarHBondContact O-N 3.23Å; E293-R296 VanDerWaalsContact CD-NH2 3.29Å; E293-R296 PolarHBondContact O-N 3.35Å; E293-R296 IonicContact OE1-CZ 3.8Å; E293-R296 IonicContact OE1-NH2 3.08Å; E293-R296 PolarHBondContact OE1-NH2 3.4Å; E293-R296 IonicContact OE2-CZ 3.8Å; E293-R296 IonicContact OE2-NE 2.92Å; E293-R296 PolarHBondContact OE2-NE 2.91Å; E293-R296 VanDerWaalsContact OE2-NE 3.1Å; E293-R296 IonicContact OE2-NH2 3Å; E293-R296 PolarHBondContact OE2-NH2 3.32Å; V294-R296 VanDerWaalsContact C-N 3.32Å; V294-R296 PolarHBondContact O-N 3.31Å; R296-M298 VanDerWaalsContact C-N 3.35Å; R296-L299 PolarHBondContact O-N 3.02Å; R296-E300 PolarHBondContact O-N 3.34Å
297	T	90.7	Very high	82.6	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-38.8	176	-55.7	0	0	0	0	111.4	L244 V256 E293 V294 E300 L301	L244-T297 HydrophobicContact CB-CG2 3.96Å; V256-T297 HydrophobicContact CG2-CG2 3.85Å; E293-T297 PolarHBondContact O-N 3.01Å; E293-T297 PolarHBondContact O-OG1 3.08Å; E293-T297 VanDerWaalsContact O-OG1 3.11Å; V294-T297 PolarHBondContact O-N 3.1Å; T297-E300 PolarHBondContact O-N 2.94Å; T297-L301 PolarHBondContact O-N 3.41Å
298	M	90	Very high	82.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-45.4	172.4	-176.8	-169.5	66	0	0	111.8	I279 V294 Q295 R296 E300 L301 L302 D327 L330	I279-M298 WeakPolarHBondContact O-CB 3.48Å; V294-M298 PolarHBondContact O-N 3.28Å; Q295-M298 WeakPolarHBondContact O-CB 3.39Å; Q295-M298 PolarHBondContact O-N 3.19Å; R296-M298 VanDerWaalsContact C-N 3.35Å; M298-E300 VanDerWaalsContact C-N 3.29Å; M298-E300 PolarHBondContact O-N 3.36Å; M298-L301 WeakPolarHBondContact O-CB 3.31Å; M298-L301 PolarHBondContact O-N 3.4Å; M298-L302 WeakPolarHBondContact O-CG 3.44Å; M298-L302 PolarHBondContact O-N 3.24Å; M298-D327 HydrophobicContact CE-CB 4.42Å; M298-D327 HydrophobicContact SD-CB 4.07Å; M298-L330 HydrophobicContact CG-CD1 4.44Å; M298-L330 HydrophobicContact SD-CD1 4.24Å
299	L	89.6	Confident	81.9	Confident	66 Å²	66	54.8 Å²	54.8	35%	0.346	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-39.9	177.1	-75.5	174.4	0	0	0	111.8	R283 Q295 R296 L302 N303	R283-L299 VanDerWaalsContact NH2-CD2 3.32Å; Q295-L299 VanDerWaalsContact O-CG 3.31Å; Q295-L299 WeakPolarHBondContact O-CG 3.22Å; Q295-L299 PolarHBondContact O-N 3.4Å; R296-L299 PolarHBondContact O-N 3.02Å; L299-L302 HydrophobicContact CD2-CD1 4.39Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 2.79Å; L299-N303 VanDerWaalsContact O-CG 3.27Å; L299-N303 PolarHBondContact O-N 3.31Å; L299-N303 PolarHBondContact O-ND2 3.45Å
300	E	90.2	Very high	81.1	Confident	38 Å²	38	52.5 Å²	52.5	18%	0.178	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-41.9	175	-173.3	56.5	-151.3	0	0	111.6	A253 V256 R257 R296 T297 M298 L302 N303 Q304	A253-E300 HydrophobicContact CB-CB 3.96Å; A253-E300 HydrophobicContact CB-CG 4.02Å; V256-E300 HydrophobicContact CB-CG 4.45Å; V256-E300 HydrophobicContact CG1-CG 4.36Å; R257-E300 VanDerWaalsContact CD-OE1 3.25Å; R257-E300 WeakPolarHBondContact CD-OE1 3.38Å; R257-E300 HydrophobicContact CG-CG 3.99Å; R257-E300 WeakPolarHBondContact CG-OE1 3.05Å; R296-E300 PolarHBondContact O-N 3.34Å; T297-E300 PolarHBondContact O-N 2.94Å; M298-E300 VanDerWaalsContact C-N 3.29Å; M298-E300 PolarHBondContact O-N 3.36Å; E300-L302 VanDerWaalsContact C-N 3.29Å; E300-L302 PolarHBondContact O-N 3.41Å; E300-N303 PolarHBondContact O-N 3.07Å; E300-Q304 WeakPolarHBondContact O-CG 3.03Å; E300-Q304 PolarHBondContact O-N 2.87Å; E300-Q304 PolarHBondContact OE1-NE2 2.73Å
301	L	89.9	Confident	80.1	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-43.3	172.6	177.7	63	0	0	0	111.5	V256 F260 I273 L276 I279 T297 M298 N303 Q304 L305	V256-L301 HydrophobicContact CG1-CB 4.21Å; V256-L301 HydrophobicContact CG1-CD1 4.22Å; F260-L301 HydrophobicContact CE2-CD1 3.5Å; F260-L301 VanDerWaalsContact CE2-CD1 3.5Å; F260-L301 HydrophobicContact CZ-CD1 3.77Å; I273-L301 HydrophobicContact CD1-CD1 4.01Å; I273-L301 HydrophobicContact CD1-CD2 4.2Å; L276-L301 HydrophobicContact CD1-CD2 4.22Å; I279-L301 HydrophobicContact CD1-CD2 3.63Å; T297-L301 PolarHBondContact O-N 3.41Å; M298-L301 WeakPolarHBondContact O-CB 3.31Å; M298-L301 PolarHBondContact O-N 3.4Å; L301-N303 PolarHBondContact O-N 2.95Å; L301-Q304 PolarHBondContact O-N 2.8Å; L301-L305 HydrophobicContact CD1-CD1 4.27Å; L301-L305 HydrophobicContact CD1-CG 4.29Å; L301-L305 HydrophobicContact CG-CD1 4.06Å; L301-L305 HydrophobicContact CG-CG 4.49Å; L301-L305 WeakPolarHBondContact O-CB 3.48Å; L301-L305 WeakPolarHBondContact O-CG 3.34Å; L301-L305 PolarHBondContact O-N 3.4Å
302	L	88.3	Confident	79.5	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-61.6	-42.9	175.7	-68.3	-179.4	0	0	0	112.4	M298 L299 E300 Q304 L305 D306 A329 L330	M298-L302 WeakPolarHBondContact O-CG 3.44Å; M298-L302 PolarHBondContact O-N 3.24Å; L299-L302 HydrophobicContact CD2-CD1 4.39Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 2.79Å; E300-L302 VanDerWaalsContact C-N 3.29Å; E300-L302 PolarHBondContact O-N 3.41Å; L302-Q304 VanDerWaalsContact C-N 3.35Å; L302-L305 PolarHBondContact O-N 2.88Å; L302-D306 PolarHBondContact O-N 3.29Å; L302-A329 HydrophobicContact CD1-CB 3.99Å; L302-L330 HydrophobicContact CD2-CD2 3.29Å; L302-L330 HydrophobicContact CD2-CG 3.8Å; L302-L330 HydrophobicContact CG-CD2 4.27Å
303	N	88.5	Confident	79.1	Confident	93 Å²	93	49.9 Å²	49.9	50%	0.497	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-41.4	177.3	-70.1	-21.3	0	0	0	111.5	L299 E300 L301 G307	L299-N303 VanDerWaalsContact O-CG 3.27Å; L299-N303 PolarHBondContact O-N 3.31Å; L299-N303 PolarHBondContact O-ND2 3.45Å; E300-N303 PolarHBondContact O-N 3.07Å; L301-N303 PolarHBondContact O-N 2.95Å; N303-G307 WeakPolarHBondContact O-CA 3.42Å; N303-G307 PolarHBondContact O-N 3.35Å
304	Q	87.7	Confident	79.1	Confident	37 Å²	37	49.1 Å²	49.1	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-38.9	176	-65.7	-54.2	-42.7	0	0	112	V256 F260 E300 L301 L302 F308	V256-Q304 HydrophobicContact CG1-CG 4.1Å; F260-Q304 HydrophobicContact CB-CG 4.48Å; F260-Q304 HydrophobicContact CD1-CB 4.31Å; F260-Q304 HydrophobicContact CD2-CB 3.69Å; F260-Q304 HydrophobicContact CD2-CG 3.92Å; F260-Q304 HydrophobicContact CE1-CB 4.49Å; F260-Q304 HydrophobicContact CE2-CB 3.93Å; F260-Q304 HydrophobicContact CG-CB 3.92Å; F260-Q304 HydrophobicContact CG-CG 4.23Å; F260-Q304 HydrophobicContact CZ-CB 4.32Å; E300-Q304 WeakPolarHBondContact O-CG 3.03Å; E300-Q304 PolarHBondContact O-N 2.87Å; E300-Q304 PolarHBondContact OE1-NE2 2.73Å; L301-Q304 PolarHBondContact O-N 2.8Å; L302-Q304 VanDerWaalsContact C-N 3.35Å; Q304-F308 WeakPolarHBondContact O-CD2 3.47Å; Q304-F308 VanDerWaalsContact O-CE2 3.31Å; Q304-F308 WeakPolarHBondContact O-CE2 3.3Å
305	L	84.3	Confident	79.2	Confident	8 Å²	8	48.5 Å²	48.5	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-40.7	176.9	-70	172.4	0	0	0	112.8	F260 L301 L302 F308 V316 R335	F260-L305 HydrophobicContact CZ-CD2 4.19Å; L301-L305 HydrophobicContact CD1-CD1 4.27Å; L301-L305 HydrophobicContact CD1-CG 4.29Å; L301-L305 HydrophobicContact CG-CD1 4.06Å; L301-L305 HydrophobicContact CG-CG 4.49Å; L301-L305 WeakPolarHBondContact O-CB 3.48Å; L301-L305 WeakPolarHBondContact O-CG 3.34Å; L301-L305 PolarHBondContact O-N 3.4Å; L302-L305 PolarHBondContact O-N 2.88Å; L305-F308 HydrophobicContact CD2-CE2 4.42Å; L305-F308 WeakPolarHBondContact O-CD2 3.46Å; L305-V316 HydrophobicContact CD2-CB 4.15Å; L305-V316 HydrophobicContact CD2-CG1 4.14Å; L305-V316 HydrophobicContact CD2-CG2 3.7Å; L305-R335 HydrophobicContact CB-CB 4.48Å; L305-R335 HydrophobicContact CB-CG 4.24Å
306	D	78.3	Confident	79.4	Confident	72 Å²	72	46.4 Å²	46.4	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-74.7	-38.3	177.3	-77.3	-11	0	0	0	112	L302 F308 R335	L302-D306 PolarHBondContact O-N 3.29Å; D306-F308 PolarHBondContact O-N 3.37Å; D306-F308 VanDerWaalsContact O-N 3.08Å; D306-R335 VanDerWaalsContact CG-NE 3.33Å; D306-R335 WeakPolarHBondContact OD1-CG 3.31Å; D306-R335 IonicContact OD1-CZ 3.01Å; D306-R335 IonicContact OD1-NE 3.81Å; D306-R335 PolarHBondContact OD1-NE 2.96Å; D306-R335 IonicContact OD1-NH2 3.75Å; D306-R335 IonicContact OD2-CZ 3.99Å; D306-R335 IonicContact OD2-NE 2.71Å; D306-R335 PolarHBondContact OD2-NE 3.42Å; D306-R335 IonicContact OD2-NH2 3.1Å; D306-R335 PolarHBondContact OD2-NH2 2.91Å
307	G	67.1	Low	79.6	Confident	57 Å²	57	41.8 Å²	41.8	59%	0.588	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-3	-178.5	0	0	0	0	0	114.7	N303 Q309	N303-G307 WeakPolarHBondContact O-CA 3.42Å; N303-G307 PolarHBondContact O-N 3.35Å; G307-Q309 PolarHBondContact O-N 3.2Å
308	F	63.4	Low	79.8	Confident	17 Å²	17	41.8 Å²	41.8	8%	0.075	23%	0.227	C	C	.	.			trans	-68.7	121.3	170.9	-79.4	-70.8	0	0	0	111.8	K209 F260 Q304 L305 D306 M312 V314	K209-F308 PolarHBondContact NZ-O 3.05Å; F260-F308 HydrophobicContact CD1-CE1 4.41Å; F260-F308 AromaticContact CD1-CE2 3.71Å; F260-F308 HydrophobicContact CD1-CE2 3.71Å; F260-F308 AromaticContact CD1-CZ 3.33Å; F260-F308 HydrophobicContact CD1-CZ 3.33Å; F260-F308 AromaticContact CE1-CE2 3.38Å; F260-F308 HydrophobicContact CE1-CE2 3.38Å; F260-F308 AromaticContact CE1-CZ 3.4Å; F260-F308 HydrophobicContact CE1-CZ 3.4Å; F260-F308 HydrophobicContact CZ-CE2 4.42Å; Q304-F308 WeakPolarHBondContact O-CD2 3.47Å; Q304-F308 VanDerWaalsContact O-CE2 3.31Å; Q304-F308 WeakPolarHBondContact O-CE2 3.3Å; L305-F308 HydrophobicContact CD2-CE2 4.42Å; L305-F308 WeakPolarHBondContact O-CD2 3.46Å; D306-F308 PolarHBondContact O-N 3.37Å; D306-F308 VanDerWaalsContact O-N 3.08Å; F308-M312 HydrophobicContact CD1-CB 4.08Å; F308-M312 HydrophobicContact CD1-CG 4.07Å; F308-M312 HydrophobicContact CD1-SD 3.52Å; F308-M312 VanDerWaalsContact CD1-SD 3.52Å; F308-M312 HydrophobicContact CE1-CG 4.27Å; F308-M312 HydrophobicContact CE1-SD 3.65Å; F308-V314 HydrophobicContact CE1-CB 3.75Å; F308-V314 HydrophobicContact CE1-CG1 3.99Å; F308-V314 HydrophobicContact CE1-CG2 4.24Å; F308-V314 HydrophobicContact CZ-CB 4.12Å; F308-V314 HydrophobicContact CZ-CG1 3.85Å
309	Q	59	Low	80	Confident	154 Å²	154	41.8 Å²	41.8	72%	0.72	23%	0.227	S	C	*	.			trans	-60	134.6	157	-67.2	-175	-6.7	0	0	108.6	G307 N311 M312	G307-Q309 PolarHBondContact O-N 3.2Å; Q309-N311 PolarHBondContact O-N 3.34Å; Q309-M312 VanDerWaalsContact O-CB 3.28Å; Q309-M312 WeakPolarHBondContact O-CB 3.43Å; Q309-M312 PolarHBondContact O-N 3.24Å; Q309-M312 VanDerWaalsContact O-N 3.09Å
310	P	53.5	Low	80.2	Confident	37 Å²	37	38.7 Å²	38.7	24%	0.24	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.4	-174.6	24.2	-33.6	0	0	0	113.7	Q206 M312	Q206-P310 HydrophobicContact CB-CB 4.44Å; Q206-P310 HydrophobicContact CG-CB 4.21Å; P310-M312 VanDerWaalsContact C-N 3.27Å; P310-M312 PolarHBondContact O-N 2.87Å
311	N	51.5	Low	80.2	Confident	143 Å²	143	40.1 Å²	40.1	77%	0.765	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	2	-179.9	-64.5	3.4	0	0	0	113.5	Q309	Q309-N311 PolarHBondContact O-N 3.34Å
312	M	65.3	Low	80.2	Confident	49 Å²	49	46 Å²	46	24%	0.241	24%	0.242	C	C	.	.			trans	-77.7	135.9	-175	-166.3	156.1	-159.9	0	0	112.1	K264 F308 Q309 P310 V314	K264-M312 HydrophobicContact CB-CE 3.38Å; K264-M312 HydrophobicContact CD-CE 3.5Å; K264-M312 VanDerWaalsContact CD-CE 3.5Å; K264-M312 HydrophobicContact CD-SD 4.1Å; K264-M312 HydrophobicContact CG-CE 3.19Å; K264-M312 HydrophobicContact CG-SD 4.19Å; F308-M312 HydrophobicContact CD1-CB 4.08Å; F308-M312 HydrophobicContact CD1-CG 4.07Å; F308-M312 HydrophobicContact CD1-SD 3.52Å; F308-M312 VanDerWaalsContact CD1-SD 3.52Å; F308-M312 HydrophobicContact CE1-CG 4.27Å; F308-M312 HydrophobicContact CE1-SD 3.65Å; Q309-M312 VanDerWaalsContact O-CB 3.28Å; Q309-M312 WeakPolarHBondContact O-CB 3.43Å; Q309-M312 PolarHBondContact O-N 3.24Å; Q309-M312 VanDerWaalsContact O-N 3.09Å; P310-M312 VanDerWaalsContact C-N 3.27Å; P310-M312 PolarHBondContact O-N 2.87Å; M312-V314 HydrophobicContact CE-CG2 3.88Å; M312-V314 HydrophobicContact CG-CB 4.27Å; M312-V314 HydrophobicContact CG-CG2 3.89Å; M312-V314 PolarHBondContact O-N 3.48Å; M312-V314 HydrophobicContact SD-CG2 4.27Å
313	Q	74.6	Confident	80.3	Confident	74 Å²	74	48.1 Å²	48.1	35%	0.346	26%	0.255	S	S	.	.	S	Bend	trans	-80.9	28.1	-178.7	-44.7	-174.1	19.8	0	0	113.4	M194 A267 P268 S269	M194-Q313 WeakPolarHBondContact CE-O 3.36Å; A267-Q313 HydrophobicContact CB-CB 4.25Å; P268-Q313 HydrophobicContact CB-CB 4.23Å; S269-Q313 PolarHBondContact N-O 3.13Å; S269-Q313 VanDerWaalsContact N-O 3.08Å
314	V	86.8	Confident	80.3	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.6	177.8	-176.5	0	0	0	0	107.6	A263 S269 I271 F308 M312	A263-V314 HydrophobicContact CB-CG1 4.08Å; A263-V314 HydrophobicContact CB-CG2 4.47Å; S269-V314 WeakPolarHBondContact O-CA 3.3Å; I271-V314 HydrophobicContact CD1-CG1 3.87Å; I271-V314 HydrophobicContact CG1-CG1 4.2Å; F308-V314 HydrophobicContact CE1-CB 3.75Å; F308-V314 HydrophobicContact CE1-CG1 3.99Å; F308-V314 HydrophobicContact CE1-CG2 4.24Å; F308-V314 HydrophobicContact CZ-CB 4.12Å; F308-V314 HydrophobicContact CZ-CG1 3.85Å; M312-V314 HydrophobicContact CE-CG2 3.88Å; M312-V314 HydrophobicContact CG-CB 4.27Å; M312-V314 HydrophobicContact CG-CG2 3.89Å; M312-V314 PolarHBondContact O-N 3.48Å; M312-V314 HydrophobicContact SD-CG2 4.27Å
315	K	88.9	Confident	80.4	Confident	10 Å²	10	48 Å²	48	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	143.2	177.7	-62.4	-62.4	-179.2	-173.4	0	110.5	I190 M194 P208 S269 I270 I271	I190-K315 HydrophobicContact CG2-CB 4.25Å; I190-K315 HydrophobicContact CG2-CG 4.38Å; M194-K315 HydrophobicContact CE-CB 4.36Å; M194-K315 HydrophobicContact CE-CG 3.7Å; P208-K315 PolarHBondContact O-NZ 3.02Å; S269-K315 PolarHBondContact O-N 3.19Å; I270-K315 CarbonylContact C-O 3.6Å; I270-K315 WeakPolarHBondContact CA-O 3.33Å; I271-K315 PolarHBondContact N-O 2.94Å
316	V	91.5	Very high	80.6	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.024	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.3	-179.8	-176.7	0	0	0	0	110.2	K209 G210 V211 F260 I271 I273 L305	K209-V316 PolarHBondContact O-N 3.12Å; G210-V316 CarbonylContact C-O 3.56Å; G210-V316 WeakPolarHBondContact CA-O 3.34Å; V211-V316 PolarHBondContact N-O 2.93Å; F260-V316 HydrophobicContact CE1-CG2 4.14Å; F260-V316 HydrophobicContact CZ-CG2 4.44Å; I271-V316 HydrophobicContact CB-CG2 4.47Å; I271-V316 WeakPolarHBondContact O-CA 3.46Å; I273-V316 HydrophobicContact CD1-CG1 4.11Å; L305-V316 HydrophobicContact CD2-CB 4.15Å; L305-V316 HydrophobicContact CD2-CG1 4.14Å; L305-V316 HydrophobicContact CD2-CG2 3.7Å
317	I	93.3	Very high	81.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.4	171.3	-56.2	177.8	0	0	0	107	I190 V211 M213 I270 I271 F272 I273	I190-I317 HydrophobicContact CD1-CD1 3.34Å; I190-I317 HydrophobicContact CD1-CG1 3.35Å; V211-I317 WeakPolarHBondContact O-CA 3.48Å; M213-I317 HydrophobicContact CE-CG2 3.39Å; M213-I317 HydrophobicContact SD-CG2 4.32Å; I270-I317 HydrophobicContact CG2-CD1 3.63Å; I270-I317 HydrophobicContact CG2-CG1 3.93Å; I271-I317 PolarHBondContact O-N 2.85Å; F272-I317 CarbonylContact C-O 3.56Å; F272-I317 WeakPolarHBondContact CA-O 3.47Å; F272-I317 HydrophobicContact CD2-CB 3.91Å; F272-I317 HydrophobicContact CD2-CG2 3.67Å; F272-I317 HydrophobicContact CE2-CG2 4.02Å; I273-I317 PolarHBondContact N-O 2.93Å
318	A	94.1	Very high	82.1	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.4	173.7	0	0	0	0	0	110.2	V211 L212 M213 I273 L276 L336	V211-A318 PolarHBondContact O-N 3.4Å; L212-A318 CarbonylContact C-O 3.44Å; L212-A318 WeakPolarHBondContact CA-O 3.41Å; L212-A318 HydrophobicContact CD1-CB 3.89Å; M213-A318 PolarHBondContact N-O 3.33Å; I273-A318 CarbonylContact O-C 3.6Å; I273-A318 WeakPolarHBondContact O-CA 3.39Å; L276-A318 HydrophobicContact CD2-CB 3.92Å; A318-L336 HydrophobicContact CB-CD1 4.4Å; A318-L336 HydrophobicContact CB-CD2 4.03Å
319	A	94.1	Very high	83.2	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	137	172.8	0	0	0	0	0	110.6	M213 K221 F272 I273 E275 L276	M213-A319 HydrophobicContact CE-CB 4.18Å; M213-A319 WeakPolarHBondContact O-CA 3.43Å; K221-A319 HydrophobicContact CB-CB 4.47Å; F272-A319 HydrophobicContact CE2-CB 3.97Å; F272-A319 HydrophobicContact CZ-CB 4.05Å; I273-A319 PolarHBondContact O-N 3.18Å; E275-A319 PolarHBondContact N-O 3.39Å; L276-A319 PolarHBondContact N-O 2.83Å; L276-A319 VanDerWaalsContact N-O 3.11Å
320	T	93.4	Very high	84.5	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	152	172.1	-177	0	0	0	0	110.7	L212 M213 Y214 K221 R322 V323 L326	L212-T320 HydrophobicContact CD1-CG2 4.03Å; M213-T320 PolarHBondContact O-N 2.88Å; Y214-T320 WeakPolarHBondContact CA-O 3.42Å; K221-T320 PolarHBondContact NZ-O 2.9Å; T320-R322 PolarHBondContact OG1-N 3.14Å; T320-R322 PolarHBondContact OG1-O 2.66Å; T320-R322 VanDerWaalsContact OG1-O 3.1Å; T320-V323 HydrophobicContact CG2-CB 4.47Å; T320-L326 HydrophobicContact CG2-CD1 3.86Å
321	N	91.6	Very high	86.1	Confident	68 Å²	68	38.8 Å²	38.8	36%	0.364	20%	0.202	S	C	.	.	S	Bend	trans	-87.8	-25.3	167.8	-64.6	-43.9	0	0	0	111.9	G215 K221	G215-N321 WeakPolarHBondContact O-CA 3.46Å; K221-N321 PolarHBondContact NZ-OD1 2.79Å
322	R	88.7	Confident	87.7	Confident	126 Å²	126	39.9 Å²	39.9	48%	0.475	20%	0.196	S	C	.	.			trans	-131	97.9	-169.4	-70.3	-170.2	66.4	-178.6	0.7	110	T320 D324 I325	T320-R322 PolarHBondContact OG1-N 3.14Å; T320-R322 PolarHBondContact OG1-O 2.66Å; T320-R322 VanDerWaalsContact OG1-O 3.1Å; R322-D324 VanDerWaalsContact C-N 3.34Å; R322-D324 WeakPolarHBondContact CA-OD1 3.43Å; R322-D324 VanDerWaalsContact CB-OD1 3.3Å; R322-D324 WeakPolarHBondContact CB-OD1 3.24Å; R322-D324 IonicContact CZ-OD2 3.74Å; R322-D324 IonicContact NE-OD1 3.59Å; R322-D324 IonicContact NE-OD2 3.64Å; R322-D324 IonicContact NH2-OD2 2.94Å; R322-D324 PolarHBondContact NH2-OD2 3.13Å; R322-I325 HydrophobicContact CB-CD1 3.73Å; R322-I325 HydrophobicContact CB-CG1 3.81Å; R322-I325 WeakPolarHBondContact O-CG1 3.3Å
323	V	90	Very high	88.4	Confident	49 Å²	49	42.4 Å²	42.4	30%	0.297	22%	0.219	S	C	.	.	S	Bend	trans	-79.2	-21.1	177.8	69.6	0	0	0	0	112.2	L212 Y214 T320 I325 L326 L331	L212-V323 HydrophobicContact CD2-CG2 4.4Å; Y214-V323 HydrophobicContact CD2-CB 4.24Å; Y214-V323 HydrophobicContact CD2-CG1 3.95Å; Y214-V323 HydrophobicContact CE2-CG1 4.37Å; Y214-V323 HydrophobicContact CG-CB 4.2Å; Y214-V323 HydrophobicContact CG-CG1 4.4Å; Y214-V323 HydrophobicContact CG-CG2 4.49Å; T320-V323 HydrophobicContact CG2-CB 4.47Å; V323-I325 VanDerWaalsContact C-N 3.33Å; V323-I325 PolarHBondContact O-N 3.26Å; V323-L326 HydrophobicContact CG2-CD1 4.43Å; V323-L326 PolarHBondContact O-N 3.2Å; V323-L331 HydrophobicContact CG2-CD1 4.25Å; V323-L331 HydrophobicContact CG2-CD2 4.24Å
324	D	89.4	Confident	88.5	Confident	87 Å²	87	40.1 Å²	40.1	47%	0.465	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.4	-179	57.2	-52.9	0	0	0	113.7	K282 R322	K282-D324 PolarHBondContact NZ-O 2.93Å; R322-D324 VanDerWaalsContact C-N 3.34Å; R322-D324 WeakPolarHBondContact CA-OD1 3.43Å; R322-D324 VanDerWaalsContact CB-OD1 3.3Å; R322-D324 WeakPolarHBondContact CB-OD1 3.24Å; R322-D324 IonicContact CZ-OD2 3.74Å; R322-D324 IonicContact NE-OD1 3.59Å; R322-D324 IonicContact NE-OD2 3.64Å; R322-D324 IonicContact NH2-OD2 2.94Å; R322-D324 PolarHBondContact NH2-OD2 3.13Å
325	I	89.7	Confident	88.4	Confident	40 Å²	40	41 Å²	41	21%	0.205	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.8	-177.8	60.2	177	0	0	0	113.6	D277 T281 K282 R322 V323	D277-I325 HydrophobicContact CB-CD1 3.43Å; D277-I325 VanDerWaalsContact CB-CD1 3.43Å; D277-I325 HydrophobicContact CB-CG1 4.18Å; T281-I325 CarbonylContact C-O 3.52Å; T281-I325 WeakPolarHBondContact CA-O 3.47Å; K282-I325 PolarHBondContact N-O 2.82Å; R322-I325 HydrophobicContact CB-CD1 3.73Å; R322-I325 HydrophobicContact CB-CG1 3.81Å; R322-I325 WeakPolarHBondContact O-CG1 3.3Å; V323-I325 VanDerWaalsContact C-N 3.33Å; V323-I325 PolarHBondContact O-N 3.26Å
326	L	89.1	Confident	88.3	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-70.9	143.6	-176.5	-68.3	-179.1	0	0	0	112.2	L212 L276 G280 K282 T320 V323 P328 L330 L331	L212-L326 HydrophobicContact CD2-CD1 4.39Å; L276-L326 HydrophobicContact CD2-CD1 4.16Å; L276-L326 HydrophobicContact CD2-CD2 4.27Å; L276-L326 HydrophobicContact CG-CD2 4.21Å; G280-L326 CarbonylContact O-C 3.59Å; G280-L326 WeakPolarHBondContact O-CA 3.32Å; K282-L326 WeakPolarHBondContact CE-O 3.43Å; T320-L326 HydrophobicContact CG2-CD1 3.86Å; V323-L326 HydrophobicContact CG2-CD1 4.43Å; V323-L326 PolarHBondContact O-N 3.2Å; L326-P328 WeakPolarHBondContact O-CD 3.3Å; L326-L330 HydrophobicContact CD2-CD1 4.47Å; L326-L331 HydrophobicContact CD1-CD2 4.28Å
327	D	88.8	Confident	88	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.08	23%	0.227	C	C	.	.			trans	-61	125.6	171.1	-170.7	-29.4	0	0	0	109.2	G280 R283 M298 A329 L330	G280-D327 PolarHBondContact O-N 3Å; R283-D327 IonicContact NE-OD2 3.24Å; R283-D327 PolarHBondContact NE-OD2 3.44Å; R283-D327 IonicContact NH2-OD2 3.98Å; M298-D327 HydrophobicContact CE-CB 4.42Å; M298-D327 HydrophobicContact SD-CB 4.07Å; D327-A329 PolarHBondContact O-N 3.45Å; D327-A329 WeakPolarHBondContact OD1-CB 3.38Å; D327-A329 PolarHBondContact OD1-N 2.89Å; D327-L330 WeakPolarHBondContact O-CB 3.44Å; D327-L330 PolarHBondContact O-N 3.38Å
328	P	87.5	Confident	87.9	Confident	82 Å²	82	47.5 Å²	47.5	53%	0.532	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-24.2	174.2	-27.1	34.8	0	0	0	114.1	L326 L330 L331 R332	L326-P328 WeakPolarHBondContact O-CD 3.3Å; P328-L330 VanDerWaalsContact C-N 3.32Å; P328-L330 PolarHBondContact O-N 2.98Å; P328-L331 PolarHBondContact O-N 2.82Å; P328-R332 PolarHBondContact O-N 3.45Å
329	A	87.1	Confident	87.8	Confident	15 Å²	15	52.1 Å²	52.1	12%	0.124	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-41.6	173.6	0	0	0	0	0	111.7	L302 D327 L331 R332 R335	L302-A329 HydrophobicContact CD1-CB 3.99Å; D327-A329 PolarHBondContact O-N 3.45Å; D327-A329 WeakPolarHBondContact OD1-CB 3.38Å; D327-A329 PolarHBondContact OD1-N 2.89Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.27Å; A329-R332 WeakPolarHBondContact O-CB 3.42Å; A329-R332 PolarHBondContact O-N 3.04Å; A329-R335 WeakPolarHBondContact O-CD 3.47Å; A329-R335 PolarHBondContact O-NH1 3.4Å
330	L	85.7	Confident	87.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-33.5	177.4	-74.9	162.6	0	0	0	112	L276 M298 L302 L326 D327 P328 R332 L336	L276-L330 HydrophobicContact CD2-CD1 4.41Å; M298-L330 HydrophobicContact CG-CD1 4.44Å; M298-L330 HydrophobicContact SD-CD1 4.24Å; L302-L330 HydrophobicContact CD2-CD2 3.29Å; L302-L330 HydrophobicContact CD2-CG 3.8Å; L302-L330 HydrophobicContact CG-CD2 4.27Å; L326-L330 HydrophobicContact CD2-CD1 4.47Å; D327-L330 WeakPolarHBondContact O-CB 3.44Å; D327-L330 PolarHBondContact O-N 3.38Å; P328-L330 VanDerWaalsContact C-N 3.32Å; P328-L330 PolarHBondContact O-N 2.98Å; L330-R332 VanDerWaalsContact C-N 3.29Å; L330-R332 PolarHBondContact O-N 3.17Å; L330-L336 HydrophobicContact CB-CD1 4.48Å
331	L	86.1	Confident	87.8	Confident	36 Å²	36	57 Å²	57	19%	0.188	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	0.2	-174.9	-59.7	179.8	0	0	0	114.3	L212 V323 L326 P328 A329 K339	L212-L331 HydrophobicContact CD2-CD2 3.3Å; V323-L331 HydrophobicContact CG2-CD1 4.25Å; V323-L331 HydrophobicContact CG2-CD2 4.24Å; L326-L331 HydrophobicContact CD1-CD2 4.28Å; P328-L331 PolarHBondContact O-N 2.82Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.27Å; L331-K339 WeakPolarHBondContact O-CE 3.42Å; L331-K339 PolarHBondContact O-NZ 3.03Å
332	R	86.6	Confident	87.9	Confident	166 Å²	166	53.8 Å²	53.8	63%	0.626	27%	0.27	S	S	*	.	S	Bend	trans	-72.9	142.7	179.9	-170.7	-179	-72.9	178.2	-3.8	110.3	P328 A329 L330 R335	P328-R332 PolarHBondContact O-N 3.45Å; A329-R332 WeakPolarHBondContact O-CB 3.42Å; A329-R332 PolarHBondContact O-N 3.04Å; L330-R332 VanDerWaalsContact C-N 3.29Å; L330-R332 PolarHBondContact O-N 3.17Å; R332-R335 PolarHBondContact O-N 3.31Å
333	S	79.9	Confident	88	Confident	103 Å²	103	50.7 Å²	50.7	72%	0.72	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	141.6	171.5	-174.6	0	0	0	0	110.5	D337	S333-D337 PolarHBondContact OG-OD1 3.48Å
334	G	76.4	Confident	88	Confident	25 Å²	25	52.5 Å²	52.5	26%	0.258	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-5.2	-169.2	0	0	0	0	0	114.1	K209 D337	K209-G334 WeakPolarHBondContact CD-O 3.27Å; G334-D337 PolarHBondContact N-OD1 3.01Å
335	R	85	Confident	88.1	Confident	25 Å²	25	49.3 Å²	49.3	9%	0.094	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-80.2	175.8	-61.4	168.2	-178.4	-176.8	-5.5	109.7	G210 L305 D306 A329 R332	G210-R335 PolarHBondContact N-O 2.92Å; L305-R335 HydrophobicContact CB-CB 4.48Å; L305-R335 HydrophobicContact CB-CG 4.24Å; D306-R335 VanDerWaalsContact CG-NE 3.33Å; D306-R335 WeakPolarHBondContact OD1-CG 3.31Å; D306-R335 IonicContact OD1-CZ 3.01Å; D306-R335 IonicContact OD1-NE 3.81Å; D306-R335 PolarHBondContact OD1-NE 2.96Å; D306-R335 IonicContact OD1-NH2 3.75Å; D306-R335 IonicContact OD2-CZ 3.99Å; D306-R335 IonicContact OD2-NE 2.71Å; D306-R335 PolarHBondContact OD2-NE 3.42Å; D306-R335 IonicContact OD2-NH2 3.1Å; D306-R335 PolarHBondContact OD2-NH2 2.91Å; A329-R335 WeakPolarHBondContact O-CD 3.47Å; A329-R335 PolarHBondContact O-NH1 3.4Å; R332-R335 PolarHBondContact O-N 3.31Å
336	L	87.3	Confident	88.2	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	28%	0.278	C	S	.	.	S	Bend	trans	-105	83.8	176.2	-62.7	172.5	0	0	0	108.7	L212 L276 A318 L330	L212-L336 HydrophobicContact CB-CB 4.18Å; L212-L336 HydrophobicContact CB-CD1 4.17Å; L212-L336 HydrophobicContact CB-CD2 4.47Å; L212-L336 HydrophobicContact CD1-CD1 4.19Å; L212-L336 HydrophobicContact CD2-CD1 4.34Å; L212-L336 HydrophobicContact CG-CD1 4.47Å; L276-L336 HydrophobicContact CD2-CD1 4.21Å; A318-L336 HydrophobicContact CB-CD1 4.4Å; A318-L336 HydrophobicContact CB-CD2 4.03Å; L330-L336 HydrophobicContact CB-CD1 4.48Å
337	D	85.1	Confident	88.4	Confident	48 Å²	48	57 Å²	57	26%	0.257	30%	0.295	S	S	.	.			trans	-72.8	-46.4	-171.5	-67.5	-44.8	0	0	0	112.4	P208 K209 G210 S333 G334	P208-D337 HydrophobicContact CB-CB 3.98Å; K209-D337 PolarHBondContact N-OD2 3.39Å; G210-D337 PolarHBondContact O-N 3.01Å; G210-D337 VanDerWaalsContact O-N 3.08Å; S333-D337 PolarHBondContact OG-OD1 3.48Å; G334-D337 PolarHBondContact N-OD1 3.01Å
338	R	90.1	Very high	88.6	Confident	100 Å²	100	64.3 Å²	64.3	38%	0.377	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126	-178.5	-62.3	-69.9	-78.3	177.4	-4.6	109.5	A189 P208 G210 V211 L212	A189-R338 HydrophobicContact CB-CG 4.17Å; P208-R338 HydrophobicContact CB-CG 4.26Å; G210-R338 PolarHBondContact O-N 3.35Å; V211-R338 CarbonylContact C-O 3.44Å; V211-R338 WeakPolarHBondContact CA-O 3.42Å; V211-R338 HydrophobicContact CG1-CB 4.31Å; V211-R338 HydrophobicContact CG2-CB 4.26Å; L212-R338 PolarHBondContact N-O 3.34Å
339	K	92.7	Very high	88.9	Confident	100 Å²	100	60.9 Å²	60.9	44%	0.435	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	107.1	178.4	-58.2	178	-169.9	177.1	0	107.4	L212 Y214 L331	L212-K339 CarbonylContact O-C 3.5Å; L212-K339 WeakPolarHBondContact O-CA 3.29Å; Y214-K339 HydrophobicContact CE1-CB 3.98Å; L331-K339 WeakPolarHBondContact O-CE 3.42Å; L331-K339 PolarHBondContact O-NZ 3.03Å
340	I	93.6	Very high	89.2	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.8	-176.5	-55.7	-177.2	0	0	0	108	Q182 E185 L186 V211 L212 M213 Y214 F342	Q182-I340 HydrophobicContact CB-CG2 3.75Å; Q182-I340 HydrophobicContact CG-CG2 3.51Å; E185-I340 HydrophobicContact CB-CD1 3.92Å; E185-I340 HydrophobicContact CB-CG1 4.39Å; L186-I340 HydrophobicContact CB-CD1 3.9Å; L186-I340 HydrophobicContact CD1-CD1 4.44Å; V211-I340 HydrophobicContact CG1-CD1 3.48Å; V211-I340 VanDerWaalsContact CG1-CD1 3.48Å; V211-I340 HydrophobicContact CG1-CG1 3.82Å; L212-I340 PolarHBondContact O-N 3.39Å; M213-I340 WeakPolarHBondContact CA-O 3.46Å; Y214-I340 PolarHBondContact N-O 3.49Å; I340-F342 HydrophobicContact CB-CE2 4.38Å; I340-F342 HydrophobicContact CG2-CD2 4.31Å; I340-F342 HydrophobicContact CG2-CE2 3.83Å
341	E	93.6	Very high	89.6	Confident	106 Å²	106	61.8 Å²	61.8	50%	0.495	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	134	174.9	-168.5	167	155.4	0	0	111.1	Q182 Y214 P343	Q182-E341 WeakPolarHBondContact CG-O 3.47Å; Q182-E341 PolarHBondContact NE2-O 3.23Å; Q182-E341 VanDerWaalsContact NE2-O 3.11Å; Y214-E341 HydrophobicContact CD2-CG 4.3Å; Y214-E341 HydrophobicContact CE1-CB 4.16Å; Y214-E341 HydrophobicContact CE2-CB 3.9Å; Y214-E341 HydrophobicContact CE2-CG 3.59Å; Y214-E341 PolarHBondContact OH-OE2 3.13Å; E341-P343 VanDerWaalsContact O-CD 3.25Å; E341-P343 WeakPolarHBondContact O-CD 3.39Å
342	F	93.3	Very high	90	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.322	C	S	.	.			trans	-102.8	99.1	173.8	-76.3	-111.7	0	0	0	108.7	L179 M213 Y214 P216 K221 L224 I340	L179-F342 HydrophobicContact CD1-CD1 3.91Å; L179-F342 HydrophobicContact CD1-CE1 3.88Å; L179-F342 HydrophobicContact CD2-CD1 4.3Å; M213-F342 HydrophobicContact CB-CD2 4.24Å; M213-F342 HydrophobicContact CB-CE2 3.63Å; M213-F342 HydrophobicContact CB-CZ 4.36Å; M213-F342 HydrophobicContact CG-CE2 3.69Å; M213-F342 HydrophobicContact CG-CZ 4.19Å; M213-F342 HydrophobicContact SD-CE2 3.9Å; M213-F342 HydrophobicContact SD-CZ 3.75Å; Y214-F342 PolarHBondContact O-N 3.32Å; P216-F342 VanDerWaalsContact CD-O 3.23Å; P216-F342 WeakPolarHBondContact CD-O 3.41Å; K221-F342 HydrophobicContact CD-CD2 4.25Å; K221-F342 HydrophobicContact CD-CG 4.32Å; K221-F342 HydrophobicContact CG-CB 4.32Å; K221-F342 HydrophobicContact CG-CD1 3.83Å; K221-F342 HydrophobicContact CG-CD2 3.74Å; K221-F342 HydrophobicContact CG-CE1 3.99Å; K221-F342 HydrophobicContact CG-CE2 3.95Å; K221-F342 HydrophobicContact CG-CG 3.69Å; K221-F342 HydrophobicContact CG-CZ 4.03Å; L224-F342 HydrophobicContact CB-CE1 4.49Å; L224-F342 HydrophobicContact CB-CZ 4.38Å; L224-F342 HydrophobicContact CD2-CE1 4.16Å; L224-F342 HydrophobicContact CD2-CZ 3.58Å; I340-F342 HydrophobicContact CB-CE2 4.38Å; I340-F342 HydrophobicContact CG2-CD2 4.31Å; I340-F342 HydrophobicContact CG2-CE2 3.83Å
343	P	91.6	Very high	90.3	Very high	60 Å²	60	58.4 Å²	58.4	39%	0.39	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-70.3	166	174.4	31.4	-35.4	0	0	0	110.7	E341	E341-P343 VanDerWaalsContact O-CD 3.25Å; E341-P343 WeakPolarHBondContact O-CD 3.39Å
344	M	90.3	Very high	91	Very high	88 Å²	88	53.5 Å²	53.5	43%	0.433	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-63.1	147.7	164.7	-70.2	-64	-162.2	0	0	109.9	P216 T219 N346 N380	P216-M344 HydrophobicContact CB-CE 3.59Å; P216-M344 HydrophobicContact CB-SD 4.06Å; P216-M344 HydrophobicContact CG-CE 3.84Å; P216-M344 HydrophobicContact CG-CG 4.35Å; P216-M344 HydrophobicContact CG-SD 4.13Å; T219-M344 HydrophobicContact CG2-SD 4.34Å; M344-N346 PolarHBondContact O-N 3.28Å; M344-N380 HydrophobicContact SD-CB 4.16Å
345	P	91.6	Very high	91.8	Very high	20 Å²	20	55.9 Å²	55.9	13%	0.13	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-69.1	131.7	-177.4	28.7	-34.6	0	0	0	111.5	A349 R350 I353 F379	P345-A349 HydrophobicContact CB-CB 3.77Å; P345-R350 HydrophobicContact CB-CG 3.96Å; P345-R350 HydrophobicContact CG-CG 3.86Å; P345-R350 PolarHBondContact O-NH1 2.85Å; P345-I353 HydrophobicContact CB-CD1 4.04Å; P345-I353 HydrophobicContact CG-CD1 4.5Å; P345-F379 WeakPolarHBondContact CD-O 3.23Å; P345-F379 WeakPolarHBondContact CG-O 3.45Å
346	N	92	Very high	92.2	Very high	123 Å²	123	55.3 Å²	55.3	66%	0.658	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-64.8	168.3	169.6	-65.8	-11.5	0	0	0	111.2	M344 E348 A349 R350	M344-N346 PolarHBondContact O-N 3.28Å; N346-E348 PolarHBondContact O-N 3.26Å; N346-A349 WeakPolarHBondContact O-CA 3.22Å; N346-A349 WeakPolarHBondContact O-CB 3.39Å; N346-A349 PolarHBondContact O-N 2.8Å; N346-R350 WeakPolarHBondContact O-CG 3.12Å; N346-R350 PolarHBondContact O-N 2.8Å
347	E	92.4	Very high	92.4	Very high	79 Å²	79	57.6 Å²	57.6	37%	0.369	28%	0.276	S	S	.	.	H	α-helix	trans	-50.7	-51.5	177.9	-172.5	-177.5	153.8	0	0	112.2	A349 R350 A351 A373 R374	E347-A349 VanDerWaalsContact C-N 3.29Å; E347-A349 PolarHBondContact O-N 2.75Å; E347-R350 PolarHBondContact O-N 2.95Å; E347-A351 PolarHBondContact O-N 3.3Å; E347-A373 HydrophobicContact CG-CB 3.95Å; E347-A373 VanDerWaalsContact O-CB 3.3Å; E347-A373 WeakPolarHBondContact O-CB 3.5Å; E347-R374 HydrophobicContact CG-CG 4.21Å; E347-R374 WeakPolarHBondContact OE1-CD 3.1Å; E347-R374 WeakPolarHBondContact OE1-CG 3.18Å; E347-R374 IonicContact OE1-CZ 2.63Å; E347-R374 IonicContact OE1-NE 3.68Å; E347-R374 PolarHBondContact OE1-NE 3.34Å; E347-R374 IonicContact OE1-NH2 3.5Å
348	E	92.9	Very high	92.8	Very high	169 Å²	169	55.4 Å²	55.4	79%	0.79	26%	0.264	S	S	*	.	H	α-helix	trans	-60.2	-38.4	177	-63.3	-179	174.4	0	0	112.7	N346 A351 R352	N346-E348 PolarHBondContact O-N 3.26Å; E348-A351 PolarHBondContact O-N 3.46Å; E348-R352 WeakPolarHBondContact O-CB 3.46Å; E348-R352 PolarHBondContact O-N 2.9Å
349	A	92.9	Very high	92.8	Very high	10 Å²	10	56.9 Å²	56.9	8%	0.083	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-40.5	178.2	0	0	0	0	0	111.3	P345 N346 E347 R352 I353	P345-A349 HydrophobicContact CB-CB 3.77Å; N346-A349 WeakPolarHBondContact O-CA 3.22Å; N346-A349 WeakPolarHBondContact O-CB 3.39Å; N346-A349 PolarHBondContact O-N 2.8Å; E347-A349 VanDerWaalsContact C-N 3.29Å; E347-A349 PolarHBondContact O-N 2.75Å; A349-R352 PolarHBondContact O-N 3.36Å; A349-I353 WeakPolarHBondContact O-CB 3.3Å; A349-I353 WeakPolarHBondContact O-CD1 3.4Å; A349-I353 WeakPolarHBondContact O-CG1 3.43Å; A349-I353 PolarHBondContact O-N 3.23Å
350	R	94.1	Very high	92.7	Very high	21 Å²	21	61.6 Å²	61.6	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-46.3	176	-67.8	-169.3	-60.3	-100.3	15.9	111.5	P345 N346 E347 R352 I353 M354 A373 T376 D377	P345-R350 HydrophobicContact CB-CG 3.96Å; P345-R350 HydrophobicContact CG-CG 3.86Å; P345-R350 PolarHBondContact O-NH1 2.85Å; N346-R350 WeakPolarHBondContact O-CG 3.12Å; N346-R350 PolarHBondContact O-N 2.8Å; E347-R350 PolarHBondContact O-N 2.95Å; R350-R352 VanDerWaalsContact C-N 3.27Å; R350-R352 PolarHBondContact O-N 3.16Å; R350-I353 PolarHBondContact O-N 3.37Å; R350-M354 WeakPolarHBondContact O-CG 3.37Å; R350-M354 PolarHBondContact O-N 2.99Å; R350-A373 HydrophobicContact CB-CB 4.18Å; R350-A373 PolarHBondContact NE-O 3.03Å; R350-A373 VanDerWaalsContact NE-O 3.11Å; R350-A373 PolarHBondContact NH2-O 3.08Å; R350-T376 WeakPolarHBondContact CD-O 3.48Å; R350-T376 PolarHBondContact NE-O 3.08Å; R350-D377 IonicContact NH2-OD1 2.8Å
351	A	94	Very high	92.6	Very high	14 Å²	14	64.7 Å²	64.7	12%	0.116	31%	0.306	C	S	.	.	H	α-helix	trans	-54.5	-47.1	174.1	0	0	0	0	0	110.6	E347 E348 M354 Q355 A373	E347-A351 PolarHBondContact O-N 3.3Å; E348-A351 PolarHBondContact O-N 3.46Å; A351-M354 PolarHBondContact O-N 3.11Å; A351-Q355 WeakPolarHBondContact O-CB 3.11Å; A351-Q355 PolarHBondContact O-N 3.14Å; A351-A373 HydrophobicContact CB-CB 3.83Å
352	R	93.9	Very high	92.6	Very high	113 Å²	113	64.5 Å²	64.5	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-65.2	-41.7	179.6	-170.7	56.7	172.9	-170.8	-6.9	113.2	E348 A349 R350 Q355 I356	E348-R352 WeakPolarHBondContact O-CB 3.46Å; E348-R352 PolarHBondContact O-N 2.9Å; A349-R352 PolarHBondContact O-N 3.36Å; R350-R352 VanDerWaalsContact C-N 3.27Å; R350-R352 PolarHBondContact O-N 3.16Å; R352-Q355 WeakPolarHBondContact O-CB 3.4Å; R352-Q355 PolarHBondContact O-N 2.81Å; R352-I356 HydrophobicContact CG-CD1 4.1Å; R352-I356 VanDerWaalsContact O-CG1 3.27Å; R352-I356 WeakPolarHBondContact O-CG1 3.44Å; R352-I356 PolarHBondContact O-N 2.79Å
353	I	93.6	Very high	92.7	Very high	19 Å²	19	66 Å²	66	10%	0.097	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-46	178.5	-70	162.3	0	0	0	110.6	P345 A349 R350 Q355 I356 H357 C384	P345-I353 HydrophobicContact CB-CD1 4.04Å; P345-I353 HydrophobicContact CG-CD1 4.5Å; A349-I353 WeakPolarHBondContact O-CB 3.3Å; A349-I353 WeakPolarHBondContact O-CD1 3.4Å; A349-I353 WeakPolarHBondContact O-CG1 3.43Å; A349-I353 PolarHBondContact O-N 3.23Å; R350-I353 PolarHBondContact O-N 3.37Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 2.84Å; I353-I356 PolarHBondContact O-N 2.95Å; I353-H357 PolarHBondContact O-CD2 3.42Å; I353-H357 VanDerWaalsContact O-CD2 3.31Å; I353-H357 PolarHBondContact O-N 3.32Å; I353-H357 VanDerWaalsContact O-N 3.1Å; I353-C384 HydrophobicContact CB-CB 4.36Å; I353-C384 HydrophobicContact CG2-CB 3.67Å
354	M	93.9	Very high	92.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-41.5	176	-69.3	-175.1	177.1	0	0	111.5	R350 A351 I356 H357 S358 Y369 L372 T376 C384 V387	R350-M354 WeakPolarHBondContact O-CG 3.37Å; R350-M354 PolarHBondContact O-N 2.99Å; A351-M354 PolarHBondContact O-N 3.11Å; M354-I356 VanDerWaalsContact C-N 3.35Å; M354-I356 PolarHBondContact O-N 2.65Å; M354-H357 PolarHBondContact O-N 3.29Å; M354-S358 WeakPolarHBondContact O-CB 3.25Å; M354-S358 PolarHBondContact O-N 3.14Å; M354-S358 PolarHBondContact O-OG 2.75Å; M354-Y369 HydrophobicContact CB-CD1 4Å; M354-Y369 HydrophobicContact CB-CE1 4.38Å; M354-L372 HydrophobicContact SD-CB 4Å; M354-T376 HydrophobicContact CE-CG2 3.49Å; M354-T376 VanDerWaalsContact CE-CG2 3.49Å; M354-C384 HydrophobicContact CE-CB 4.26Å; M354-C384 HydrophobicContact CG-CB 4.05Å; M354-V387 HydrophobicContact CE-CB 4.37Å; M354-V387 HydrophobicContact CE-CG1 4.26Å; M354-V387 HydrophobicContact CE-CG2 4.49Å
355	Q	93.7	Very high	92.8	Very high	74 Å²	74	65.6 Å²	65.6	35%	0.346	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-41.2	175.7	-166.5	-176	31.3	0	0	112.1	A351 R352 I353 S358 R359 Y369	A351-Q355 WeakPolarHBondContact O-CB 3.11Å; A351-Q355 PolarHBondContact O-N 3.14Å; R352-Q355 WeakPolarHBondContact O-CB 3.4Å; R352-Q355 PolarHBondContact O-N 2.81Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 2.84Å; Q355-S358 VanDerWaalsContact CA-OG 3.3Å; Q355-S358 WeakPolarHBondContact CA-OG 3.36Å; Q355-S358 PolarHBondContact O-OG 2.93Å; Q355-R359 WeakPolarHBondContact O-CG 3.44Å; Q355-R359 PolarHBondContact O-N 2.91Å; Q355-Y369 HydrophobicContact CG-CD2 4.42Å; Q355-Y369 HydrophobicContact CG-CE2 4.22Å
356	I	93.3	Very high	92.8	Very high	14 Å²	14	70.9 Å²	70.9	7%	0.072	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-47.2	178.1	-70.6	162.2	0	0	0	110.8	D175 R352 I353 M354 S358 R359	D175-I356 HydrophobicContact CB-CG2 4.48Å; R352-I356 HydrophobicContact CG-CD1 4.1Å; R352-I356 VanDerWaalsContact O-CG1 3.27Å; R352-I356 WeakPolarHBondContact O-CG1 3.44Å; R352-I356 PolarHBondContact O-N 2.79Å; I353-I356 PolarHBondContact O-N 2.95Å; M354-I356 VanDerWaalsContact C-N 3.35Å; M354-I356 PolarHBondContact O-N 2.65Å; I356-S358 VanDerWaalsContact C-N 3.3Å; I356-S358 PolarHBondContact O-N 3.26Å; I356-R359 WeakPolarHBondContact O-CB 3.47Å; I356-R359 PolarHBondContact O-N 3.12Å
357	H	92.1	Very high	92.9	Very high	51 Å²	51	65.6 Å²	65.6	24%	0.236	32%	0.321	C	S	.	.	H	α-helix	trans	-71.1	-26.6	-177.3	-73.2	-48.2	0	0	0	113.6	I353 M354 C388	I353-H357 PolarHBondContact O-CD2 3.42Å; I353-H357 VanDerWaalsContact O-CD2 3.31Å; I353-H357 PolarHBondContact O-N 3.32Å; I353-H357 VanDerWaalsContact O-N 3.1Å; M354-H357 PolarHBondContact O-N 3.29Å; H357-C388 HydrophobicContact CB-CB 4.22Å
358	S	92.5	Very high	93	Very high	3 Å²	3	65.2 Å²	65.2	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-79.8	-13.8	177	52.2	0	0	0	0	114.3	M354 Q355 I356 K360 M361 Y369 Y408	M354-S358 WeakPolarHBondContact O-CB 3.25Å; M354-S358 PolarHBondContact O-N 3.14Å; M354-S358 PolarHBondContact O-OG 2.75Å; Q355-S358 VanDerWaalsContact CA-OG 3.3Å; Q355-S358 WeakPolarHBondContact CA-OG 3.36Å; Q355-S358 PolarHBondContact O-OG 2.93Å; I356-S358 VanDerWaalsContact C-N 3.3Å; I356-S358 PolarHBondContact O-N 3.26Å; S358-K360 PolarHBondContact O-N 3.32Å; S358-M361 PolarHBondContact O-N 3.16Å; S358-Y369 PolarHBondContact OG-OH 3.3Å; S358-Y408 WeakPolarHBondContact CB-OH 3.31Å
359	R	91.3	Very high	93	Very high	130 Å²	130	59.2 Å²	59.2	49%	0.491	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.6	176.8	-70.8	-178.9	-173.9	160.6	3.8	114.8	Q355 I356	Q355-R359 WeakPolarHBondContact O-CG 3.44Å; Q355-R359 PolarHBondContact O-N 2.91Å; I356-R359 WeakPolarHBondContact O-CB 3.47Å; I356-R359 PolarHBondContact O-N 3.12Å
360	K	89.7	Confident	93.1	Very high	200 Å²	200	64.9 Å²	64.9	87%	0.87	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-9	179.8	-65.2	-173.3	178.7	-176	0	113	S358	S358-K360 PolarHBondContact O-N 3.32Å
361	M	92.8	Very high	93.1	Very high	64 Å²	64	68.3 Å²	68.3	32%	0.315	33%	0.333	S	S	.	.	S	Bend	trans	-108.7	157.3	-175.3	-56.3	176.8	-171.9	0	0	109.9	S358 V363 C388 L403	S358-M361 PolarHBondContact O-N 3.16Å; M361-V363 HydrophobicContact CB-CG2 4.25Å; M361-V363 PolarHBondContact O-N 3.4Å; M361-C388 HydrophobicContact CE-CB 4.28Å; M361-L403 HydrophobicContact CB-CD1 3.75Å; M361-L403 HydrophobicContact CG-CD1 4.37Å; M361-L403 HydrophobicContact SD-CD1 3.83Å
362	N	93.8	Very high	93	Very high	102 Å²	102	67.6 Å²	67.6	55%	0.545	33%	0.328	S	S	.	.			trans	-85.4	107.3	173.2	-172.8	29.5	0	0	0	109.3	T401 E402 L403	N362-T401 WeakPolarHBondContact CB-O 3.37Å; N362-T401 PolarHBondContact ND2-O 3.44Å; N362-E402 WeakPolarHBondContact O-CA 3.49Å; N362-L403 PolarHBondContact O-N 2.85Å
363	V	94.2	Very high	93	Very high	32 Å²	32	62.3 Å²	62.3	19%	0.194	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-115.5	135.4	-174.4	-170.6	0	0	0	0	109.9	M361 V367 L403 Y408	M361-V363 HydrophobicContact CB-CG2 4.25Å; M361-V363 PolarHBondContact O-N 3.4Å; V363-V367 HydrophobicContact CG1-CB 3.87Å; V363-V367 HydrophobicContact CG1-CG1 4.36Å; V363-V367 HydrophobicContact CG1-CG2 3.53Å; V363-L403 HydrophobicContact CG1-CB 4.32Å; V363-L403 HydrophobicContact CG2-CB 4.36Å; V363-L403 HydrophobicContact CG2-CD1 4.04Å; V363-Y408 HydrophobicContact CG1-CE2 4.17Å
364	S	93.7	Very high	93	Very high	10 Å²	10	68.8 Å²	68.8	7%	0.07	33%	0.331	C	S	.	.			trans	-63	140.8	172.8	172.9	0	0	0	0	110.4	D366 V367 L403	S364-D366 PolarHBondContact O-N 3.4Å; S364-D366 VanDerWaalsContact O-N 3.07Å; S364-D366 PolarHBondContact OG-N 2.88Å; S364-D366 PolarHBondContact OG-OD2 3.24Å; S364-V367 WeakPolarHBondContact O-CG2 3.48Å; S364-V367 PolarHBondContact O-N 3.28Å; S364-L403 VanDerWaalsContact CB-O 3.27Å; S364-L403 WeakPolarHBondContact CB-O 3.27Å; S364-L403 PolarHBondContact N-O 3Å
365	P	90.8	Very high	92.9	Very high	129 Å²	129	71 Å²	71	84%	0.838	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.3	174.4	28.1	-36.5	0	0	0	113.4	V367	P365-V367 PolarHBondContact O-N 2.77Å
366	D	91.6	Very high	92.7	Very high	131 Å²	131	67.5 Å²	67.5	70%	0.701	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-4.7	179	-60.4	-28.5	0	0	0	113.3	S364 N368	S364-D366 PolarHBondContact O-N 3.4Å; S364-D366 VanDerWaalsContact O-N 3.07Å; S364-D366 PolarHBondContact OG-N 2.88Å; S364-D366 PolarHBondContact OG-OD2 3.24Å; D366-N368 PolarHBondContact O-N 3.11Å
367	V	93.1	Very high	92.4	Very high	13 Å²	13	72 Å²	72	8%	0.079	35%	0.354	C	S	.	.			trans	-78.8	112	-178.9	178.7	0	0	0	0	111.5	V363 S364 P365 Y369 L372 Y408	V363-V367 HydrophobicContact CG1-CB 3.87Å; V363-V367 HydrophobicContact CG1-CG1 4.36Å; V363-V367 HydrophobicContact CG1-CG2 3.53Å; S364-V367 WeakPolarHBondContact O-CG2 3.48Å; S364-V367 PolarHBondContact O-N 3.28Å; P365-V367 PolarHBondContact O-N 2.77Å; V367-Y369 HydrophobicContact CG1-CD1 4.46Å; V367-Y369 HydrophobicContact CG1-CE1 4.16Å; V367-Y369 HydrophobicContact CG1-CE2 4.48Å; V367-L372 HydrophobicContact CG1-CD1 3.81Å; V367-Y408 HydrophobicContact CG1-CD2 3.98Å; V367-Y408 HydrophobicContact CG1-CE2 3.98Å; V367-Y408 HydrophobicContact CG2-CD2 4.28Å; V367-Y408 HydrophobicContact CG2-CE2 4.18Å
368	N	94.9	Very high	92.2	Very high	70 Å²	70	75.3 Å²	75.3	37%	0.374	37%	0.373	S	S	.	.			trans	-89.2	105.4	172.5	-173.1	-1.5	0	0	0	112.6	D366 E370 E371 L372	D366-N368 PolarHBondContact O-N 3.11Å; N368-E370 VanDerWaalsContact C-N 3.33Å; N368-E370 PolarHBondContact O-N 3.38Å; N368-E370 WeakPolarHBondContact OD1-CB 3.46Å; N368-E370 PolarHBondContact OD1-N 3.49Å; N368-E371 HydrophobicContact CB-CB 4.13Å; N368-E371 PolarHBondContact O-N 2.91Å; N368-L372 WeakPolarHBondContact O-CG 3.45Å; N368-L372 PolarHBondContact O-N 2.99Å
369	Y	94.1	Very high	92.1	Very high	43 Å²	43	75.4 Å²	75.4	17%	0.169	37%	0.373	C	S	.	.	H	α-helix	trans	-70.6	-23.7	178.2	-62.8	-77.7	0	0	0	114.4	M354 Q355 S358 V367 L372 A373	M354-Y369 HydrophobicContact CB-CD1 4Å; M354-Y369 HydrophobicContact CB-CE1 4.38Å; Q355-Y369 HydrophobicContact CG-CD2 4.42Å; Q355-Y369 HydrophobicContact CG-CE2 4.22Å; S358-Y369 PolarHBondContact OG-OH 3.3Å; V367-Y369 HydrophobicContact CG1-CD1 4.46Å; V367-Y369 HydrophobicContact CG1-CE1 4.16Å; V367-Y369 HydrophobicContact CG1-CE2 4.48Å; Y369-L372 HydrophobicContact CD1-CD1 4.32Å; Y369-A373 VanDerWaalsContact O-CB 3.31Å; Y369-A373 WeakPolarHBondContact O-CB 3.49Å; Y369-A373 PolarHBondContact O-N 3.38Å
370	E	93.9	Very high	92	Very high	129 Å²	129	70.3 Å²	70.3	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-68.8	-41	176.5	-63.1	-179	178.6	0	0	110.4	N368 A373 R374	N368-E370 VanDerWaalsContact C-N 3.33Å; N368-E370 PolarHBondContact O-N 3.38Å; N368-E370 WeakPolarHBondContact OD1-CB 3.46Å; N368-E370 PolarHBondContact OD1-N 3.49Å; E370-A373 PolarHBondContact O-N 2.93Å; E370-R374 WeakPolarHBondContact O-CG 3.49Å; E370-R374 PolarHBondContact O-N 3.27Å; E370-R374 VanDerWaalsContact O-N 3.14Å
371	E	93.8	Very high	92	Very high	93 Å²	93	61.6 Å²	61.6	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-46.8	174.5	-177.7	169.4	-166.2	0	0	111.5	N368 A373 R374 C375 H405	N368-E371 HydrophobicContact CB-CB 4.13Å; N368-E371 PolarHBondContact O-N 2.91Å; E371-A373 VanDerWaalsContact C-N 3.26Å; E371-A373 PolarHBondContact O-N 2.9Å; E371-R374 WeakPolarHBondContact O-CB 3.43Å; E371-R374 PolarHBondContact O-N 2.89Å; E371-R374 VanDerWaalsContact O-N 3.11Å; E371-C375 PolarHBondContact O-N 3.04Å; E371-C375 PolarHBondContact O-SG 3.18Å; E371-C375 VanDerWaalsContact O-SG 3.39Å; E371-H405 IonicContact OE2-CE1 3.39Å; E371-H405 IonicContact OE2-NE2 2.73Å
372	L	93.6	Very high	91.9	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-36.6	175.8	-64.3	177.4	0	0	0	112.4	M354 V367 N368 Y369 C375 T376 Y408 M409 I412	M354-L372 HydrophobicContact SD-CB 4Å; V367-L372 HydrophobicContact CG1-CD1 3.81Å; N368-L372 WeakPolarHBondContact O-CG 3.45Å; N368-L372 PolarHBondContact O-N 2.99Å; Y369-L372 HydrophobicContact CD1-CD1 4.32Å; L372-C375 PolarHBondContact O-N 3.34Å; L372-T376 WeakPolarHBondContact O-CG2 2.98Å; L372-T376 PolarHBondContact O-N 3.43Å; L372-T376 PolarHBondContact O-OG1 3.41Å; L372-Y408 HydrophobicContact CD1-CD1 3.97Å; L372-Y408 HydrophobicContact CD1-CD2 4.17Å; L372-Y408 HydrophobicContact CD1-CG 3.67Å; L372-M409 HydrophobicContact CD2-CG 4.37Å; L372-M409 HydrophobicContact CD2-SD 4Å; L372-I412 HydrophobicContact CD2-CD1 3.95Å
373	A	93.9	Very high	91.7	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-35.6	176.5	0	0	0	0	0	113.2	E347 R350 A351 Y369 E370 E371 T376	E347-A373 HydrophobicContact CG-CB 3.95Å; E347-A373 VanDerWaalsContact O-CB 3.3Å; E347-A373 WeakPolarHBondContact O-CB 3.5Å; R350-A373 HydrophobicContact CB-CB 4.18Å; R350-A373 PolarHBondContact NE-O 3.03Å; R350-A373 VanDerWaalsContact NE-O 3.11Å; R350-A373 PolarHBondContact NH2-O 3.08Å; A351-A373 HydrophobicContact CB-CB 3.83Å; Y369-A373 VanDerWaalsContact O-CB 3.31Å; Y369-A373 WeakPolarHBondContact O-CB 3.49Å; Y369-A373 PolarHBondContact O-N 3.38Å; E370-A373 PolarHBondContact O-N 2.93Å; E371-A373 VanDerWaalsContact C-N 3.26Å; E371-A373 PolarHBondContact O-N 2.9Å; A373-T376 WeakPolarHBondContact CA-OG1 3.39Å; A373-T376 PolarHBondContact O-N 3.4Å; A373-T376 PolarHBondContact O-OG1 3.25Å
374	R	93.1	Very high	91.7	Very high	156 Å²	156	56.8 Å²	56.8	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-68.8	-34.9	172.5	-70	178.4	-178.2	177.5	5.6	112.5	E347 E370 E371 T376	E347-R374 HydrophobicContact CG-CG 4.21Å; E347-R374 WeakPolarHBondContact OE1-CD 3.1Å; E347-R374 WeakPolarHBondContact OE1-CG 3.18Å; E347-R374 IonicContact OE1-CZ 2.63Å; E347-R374 IonicContact OE1-NE 3.68Å; E347-R374 PolarHBondContact OE1-NE 3.34Å; E347-R374 IonicContact OE1-NH2 3.5Å; E370-R374 WeakPolarHBondContact O-CG 3.49Å; E370-R374 PolarHBondContact O-N 3.27Å; E370-R374 VanDerWaalsContact O-N 3.14Å; E371-R374 WeakPolarHBondContact O-CB 3.43Å; E371-R374 PolarHBondContact O-N 2.89Å; E371-R374 VanDerWaalsContact O-N 3.11Å; R374-T376 VanDerWaalsContact C-N 3.26Å; R374-T376 PolarHBondContact O-N 3.35Å
375	C	91.3	Very high	91.6	Very high	47 Å²	47	61.6 Å²	61.6	32%	0.318	32%	0.323	S	S	.	.	H	α-helix	trans	-76.4	-12	177.4	-63.7	0	0	0	0	113.7	E371 L372 M409 I412	E371-C375 PolarHBondContact O-N 3.04Å; E371-C375 PolarHBondContact O-SG 3.18Å; E371-C375 VanDerWaalsContact O-SG 3.39Å; L372-C375 PolarHBondContact O-N 3.34Å; C375-M409 HydrophobicContact CB-SD 4.34Å; C375-I412 HydrophobicContact CB-CD1 4.16Å
376	T	89.7	Confident	91.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.296	C	S	.	.			trans	-107.7	55.2	-176.5	49.9	0	0	0	0	113.8	R350 M354 L372 A373 R374 F379 I412	R350-T376 WeakPolarHBondContact CD-O 3.48Å; R350-T376 PolarHBondContact NE-O 3.08Å; M354-T376 HydrophobicContact CE-CG2 3.49Å; M354-T376 VanDerWaalsContact CE-CG2 3.49Å; L372-T376 WeakPolarHBondContact O-CG2 2.98Å; L372-T376 PolarHBondContact O-N 3.43Å; L372-T376 PolarHBondContact O-OG1 3.41Å; A373-T376 WeakPolarHBondContact CA-OG1 3.39Å; A373-T376 PolarHBondContact O-N 3.4Å; A373-T376 PolarHBondContact O-OG1 3.25Å; R374-T376 VanDerWaalsContact C-N 3.26Å; R374-T376 PolarHBondContact O-N 3.35Å; T376-F379 HydrophobicContact CG2-CD2 3.67Å; T376-F379 HydrophobicContact CG2-CE2 3.77Å; T376-F379 HydrophobicContact CG2-CG 4.26Å; T376-F379 HydrophobicContact CG2-CZ 4.42Å; T376-F379 PolarHBondContact O-N 2.88Å; T376-I412 HydrophobicContact CG2-CB 4.45Å; T376-I412 HydrophobicContact CG2-CD1 3.54Å; T376-I412 HydrophobicContact CG2-CG1 3.56Å; T376-I412 HydrophobicContact CG2-CG2 4.01Å
377	D	87.1	Confident	91.8	Very high	107 Å²	107	50.9 Å²	50.9	57%	0.572	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	139.5	175.4	-70.1	-30.5	0	0	0	112.5	R350 F379	R350-D377 IonicContact NH2-OD1 2.8Å; D377-F379 VanDerWaalsContact O-CD1 3.31Å; D377-F379 WeakPolarHBondContact O-CD1 3.25Å; D377-F379 PolarHBondContact O-N 3.36Å
378	D	87.2	Confident	91.9	Very high	122 Å²	122	50.3 Å²	50.3	65%	0.652	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	23.3	-178.5	-63.8	-30.4	0	0	0	115.7
379	F	89.8	Confident	91.9	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.018	26%	0.264	C	S	.	.			trans	-80.5	134.3	175.6	-84.6	30.7	0	0	0	111.3	P345 T376 D377 Q383 V387 I412 V415 Q416	P345-F379 WeakPolarHBondContact CD-O 3.23Å; P345-F379 WeakPolarHBondContact CG-O 3.45Å; T376-F379 HydrophobicContact CG2-CD2 3.67Å; T376-F379 HydrophobicContact CG2-CE2 3.77Å; T376-F379 HydrophobicContact CG2-CG 4.26Å; T376-F379 HydrophobicContact CG2-CZ 4.42Å; T376-F379 PolarHBondContact O-N 2.88Å; D377-F379 VanDerWaalsContact O-CD1 3.31Å; D377-F379 WeakPolarHBondContact O-CD1 3.25Å; D377-F379 PolarHBondContact O-N 3.36Å; F379-Q383 HydrophobicContact CB-CB 4.2Å; F379-Q383 HydrophobicContact CD2-CB 3.8Å; F379-Q383 HydrophobicContact CE2-CB 4.33Å; F379-Q383 HydrophobicContact CG-CB 4.02Å; F379-V387 HydrophobicContact CD2-CG2 4.09Å; F379-V387 HydrophobicContact CE2-CG2 3.55Å; F379-I412 HydrophobicContact CZ-CG2 4.36Å; F379-V415 HydrophobicContact CE2-CB 4.39Å; F379-V415 HydrophobicContact CE2-CG1 3.89Å; F379-V415 HydrophobicContact CZ-CB 4.42Å; F379-V415 HydrophobicContact CZ-CG1 3.97Å; F379-Q416 HydrophobicContact CE1-CG 3.81Å; F379-Q416 HydrophobicContact CZ-CG 3.61Å
380	N	90.8	Very high	91.9	Very high	24 Å²	24	50.1 Å²	50.1	13%	0.128	26%	0.263	C	S	.	.			trans	-82.7	169.4	167.4	68.1	13.1	0	0	0	111.1	P217 M344 A382 Q383 C384	P217-N380 PolarHBondContact O-ND2 3.22Å; P217-N380 VanDerWaalsContact O-ND2 3.09Å; M344-N380 HydrophobicContact SD-CB 4.16Å; N380-A382 PolarHBondContact O-N 3.11Å; N380-A382 PolarHBondContact OD1-N 3.1Å; N380-Q383 PolarHBondContact O-N 3.38Å; N380-Q383 VanDerWaalsContact O-N 3.11Å; N380-Q383 VanDerWaalsContact OD1-CB 3.25Å; N380-Q383 WeakPolarHBondContact OD1-CB 3.34Å; N380-Q383 WeakPolarHBondContact OD1-CG 3.45Å; N380-Q383 PolarHBondContact OD1-N 2.71Å; N380-Q383 PolarHBondContact OD1-OE1 3.02Å; N380-C384 PolarHBondContact O-N 3.01Å; N380-C384 PolarHBondContact O-SG 3.35Å; N380-C384 VanDerWaalsContact O-SG 3.32Å
381	G	88.9	Confident	91.9	Very high	16 Å²	16	44 Å²	44	17%	0.165	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-35	179.8	0	0	0	0	0	112.9	G218 C384 K385	G218-G381 PolarHBondContact O-N 3.24Å; G218-G381 VanDerWaalsContact O-N 3.14Å; G381-C384 PolarHBondContact O-N 2.8Å; G381-K385 PolarHBondContact O-N 3.34Å
382	A	90.1	Very high	91.9	Very high	52 Å²	52	40.8 Å²	40.8	43%	0.43	23%	0.226	S	C	.	.	H	α-helix	trans	-63.9	-38.6	174.9	0	0	0	0	0	112.9	G218 N380 K385 A386	G218-A382 PolarHBondContact O-N 3.09Å; G218-A382 VanDerWaalsContact O-N 3.14Å; N380-A382 PolarHBondContact O-N 3.11Å; N380-A382 PolarHBondContact OD1-N 3.1Å; A382-K385 WeakPolarHBondContact O-CB 3.44Å; A382-K385 PolarHBondContact O-N 3.11Å; A382-A386 PolarHBondContact O-N 3.11Å
383	Q	91.2	Very high	91.9	Very high	46 Å²	46	45 Å²	45	22%	0.215	25%	0.247	C	C	.	.	H	α-helix	trans	-71.4	-41.2	176.1	-76.3	164	-28.9	0	0	111.5	F379 N380 K385 A386 V387 V415	F379-Q383 HydrophobicContact CB-CB 4.2Å; F379-Q383 HydrophobicContact CD2-CB 3.8Å; F379-Q383 HydrophobicContact CE2-CB 4.33Å; F379-Q383 HydrophobicContact CG-CB 4.02Å; N380-Q383 PolarHBondContact O-N 3.38Å; N380-Q383 VanDerWaalsContact O-N 3.11Å; N380-Q383 VanDerWaalsContact OD1-CB 3.25Å; N380-Q383 WeakPolarHBondContact OD1-CB 3.34Å; N380-Q383 WeakPolarHBondContact OD1-CG 3.45Å; N380-Q383 PolarHBondContact OD1-N 2.71Å; N380-Q383 PolarHBondContact OD1-OE1 3.02Å; Q383-K385 PolarHBondContact O-N 3.31Å; Q383-A386 WeakPolarHBondContact O-CA 3.48Å; Q383-A386 WeakPolarHBondContact O-CB 3.49Å; Q383-A386 PolarHBondContact O-N 2.81Å; Q383-V387 WeakPolarHBondContact O-CG2 3.37Å; Q383-V387 PolarHBondContact O-N 3.39Å; Q383-V415 HydrophobicContact CB-CG1 4.37Å; Q383-V415 HydrophobicContact CG-CG1 4.33Å
384	C	92.5	Very high	91.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.6	-39.6	173.3	-63.2	0	0	0	0	111.4	I353 M354 N380 G381 C388	I353-C384 HydrophobicContact CB-CB 4.36Å; I353-C384 HydrophobicContact CG2-CB 3.67Å; M354-C384 HydrophobicContact CE-CB 4.26Å; M354-C384 HydrophobicContact CG-CB 4.05Å; N380-C384 PolarHBondContact O-N 3.01Å; N380-C384 PolarHBondContact O-SG 3.35Å; N380-C384 VanDerWaalsContact O-SG 3.32Å; G381-C384 PolarHBondContact O-N 2.8Å; C384-C388 PolarHBondContact O-N 3.14Å; C384-C388 PolarHBondContact O-SG 3Å; C384-C388 VanDerWaalsContact O-SG 3.36Å
385	K	92.2	Very high	91.9	Very high	111 Å²	111	38.5 Å²	38.5	48%	0.483	22%	0.224	S	C	.	.	H	α-helix	trans	-63.6	-43.9	171.3	-175.8	-178.6	177.2	-176.5	0	111.9	G381 A382 Q383 V387 C388 V389	G381-K385 PolarHBondContact O-N 3.34Å; A382-K385 WeakPolarHBondContact O-CB 3.44Å; A382-K385 PolarHBondContact O-N 3.11Å; Q383-K385 PolarHBondContact O-N 3.31Å; K385-V387 VanDerWaalsContact C-N 3.34Å; K385-V387 PolarHBondContact O-N 3.04Å; K385-C388 PolarHBondContact O-N 3.23Å; K385-V389 WeakPolarHBondContact O-CG2 3.47Å; K385-V389 PolarHBondContact O-N 3Å
386	A	93.1	Very high	92.1	Very high	35 Å²	35	42 Å²	42	29%	0.289	24%	0.239	S	C	.	.	H	α-helix	trans	-60.9	-41.9	178.6	0	0	0	0	0	111.9	A382 Q383 C388 V389 E390 V415	A382-A386 PolarHBondContact O-N 3.11Å; Q383-A386 WeakPolarHBondContact O-CA 3.48Å; Q383-A386 WeakPolarHBondContact O-CB 3.49Å; Q383-A386 PolarHBondContact O-N 2.81Å; A386-C388 VanDerWaalsContact C-N 3.3Å; A386-C388 PolarHBondContact O-N 3.44Å; A386-V389 PolarHBondContact O-N 3.45Å; A386-E390 WeakPolarHBondContact O-CG 3.48Å; A386-E390 PolarHBondContact O-N 3.18Å; A386-V415 HydrophobicContact CB-CG2 4.16Å
387	V	94.4	Very high	92.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.1	-45.8	174.8	171.2	0	0	0	0	111.4	M354 F379 Q383 K385 V389 E390 A391 Y408 I412 V415	M354-V387 HydrophobicContact CE-CB 4.37Å; M354-V387 HydrophobicContact CE-CG1 4.26Å; M354-V387 HydrophobicContact CE-CG2 4.49Å; F379-V387 HydrophobicContact CD2-CG2 4.09Å; F379-V387 HydrophobicContact CE2-CG2 3.55Å; Q383-V387 WeakPolarHBondContact O-CG2 3.37Å; Q383-V387 PolarHBondContact O-N 3.39Å; K385-V387 VanDerWaalsContact C-N 3.34Å; K385-V387 PolarHBondContact O-N 3.04Å; V387-V389 VanDerWaalsContact C-N 3.28Å; V387-V389 PolarHBondContact O-N 2.85Å; V387-E390 PolarHBondContact O-N 3.11Å; V387-A391 WeakPolarHBondContact O-CB 3.32Å; V387-A391 PolarHBondContact O-N 3.03Å; V387-Y408 HydrophobicContact CG1-CD1 4.12Å; V387-I412 HydrophobicContact CG1-CG1 3.7Å; V387-I412 HydrophobicContact CG2-CG1 4.03Å; V387-V415 HydrophobicContact CG2-CB 4.22Å; V387-V415 HydrophobicContact CG2-CG1 4.47Å; V387-V415 HydrophobicContact CG2-CG2 3.99Å
388	C	94.4	Very high	92.4	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-36.6	178.5	-61.1	0	0	0	0	112.2	H357 M361 C384 K385 A386 G392 Y408	H357-C388 HydrophobicContact CB-CB 4.22Å; M361-C388 HydrophobicContact CE-CB 4.28Å; C384-C388 PolarHBondContact O-N 3.14Å; C384-C388 PolarHBondContact O-SG 3Å; C384-C388 VanDerWaalsContact O-SG 3.36Å; K385-C388 PolarHBondContact O-N 3.23Å; A386-C388 VanDerWaalsContact C-N 3.3Å; A386-C388 PolarHBondContact O-N 3.44Å; C388-G392 PolarHBondContact O-N 2.92Å; C388-Y408 HydrophobicContact CB-CE1 4.45Å
389	V	94.4	Very high	92.7	Very high	75 Å²	75	46.8 Å²	46.8	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-70.7	-44.5	177.8	175.4	0	0	0	0	111.1	K385 A386 V387 G392 M393	K385-V389 WeakPolarHBondContact O-CG2 3.47Å; K385-V389 PolarHBondContact O-N 3Å; A386-V389 PolarHBondContact O-N 3.45Å; V387-V389 VanDerWaalsContact C-N 3.28Å; V387-V389 PolarHBondContact O-N 2.85Å; V389-G392 PolarHBondContact O-N 3.45Å; V389-M393 PolarHBondContact O-N 2.67Å
390	E	93.9	Very high	92.7	Very high	34 Å²	34	48.3 Å²	48.3	16%	0.159	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-41.3	179.1	-64.1	-63.2	-179.2	0	0	111.8	A386 V387 G392 M393 I394 V415 K418	A386-E390 WeakPolarHBondContact O-CG 3.48Å; A386-E390 PolarHBondContact O-N 3.18Å; V387-E390 PolarHBondContact O-N 3.11Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 3.17Å; E390-M393 WeakPolarHBondContact O-CA 3.3Å; E390-M393 WeakPolarHBondContact O-CB 3.42Å; E390-M393 PolarHBondContact O-N 3.42Å; E390-I394 WeakPolarHBondContact O-CG1 3.22Å; E390-I394 PolarHBondContact O-N 3.22Å; E390-V415 HydrophobicContact CG-CG2 3.99Å; E390-K418 IonicContact OE1-NZ 3.34Å; E390-K418 PolarHBondContact OE1-NZ 2.85Å
391	A	94.3	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-55.8	-43.8	172.6	0	0	0	0	0	111.1	V387 M393 I394 A395 L403 D407 Y408	V387-A391 WeakPolarHBondContact O-CB 3.32Å; V387-A391 PolarHBondContact O-N 3.03Å; A391-M393 VanDerWaalsContact C-N 3.34Å; A391-M393 PolarHBondContact O-N 3.32Å; A391-I394 PolarHBondContact O-N 3.43Å; A391-A395 WeakPolarHBondContact O-CB 3.45Å; A391-A395 PolarHBondContact O-N 3.48Å; A391-L403 HydrophobicContact CB-CD2 4.01Å; A391-L403 WeakPolarHBondContact O-CD2 3.31Å; A391-D407 HydrophobicContact CB-CB 4.17Å; A391-Y408 HydrophobicContact CB-CD1 3.84Å; A391-Y408 HydrophobicContact CB-CD2 4.47Å; A391-Y408 HydrophobicContact CB-CE1 4.04Å; A391-Y408 HydrophobicContact CB-CG 4.06Å
392	G	93.8	Very high	93	Very high	25 Å²	25	56.7 Å²	56.7	26%	0.258	32%	0.316	S	S	.	.	H	α-helix	trans	-56	-43.9	172	0	0	0	0	0	113.6	C388 V389 E390 L396	C388-G392 PolarHBondContact O-N 2.92Å; V389-G392 PolarHBondContact O-N 3.45Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 3.17Å; G392-L396 WeakPolarHBondContact O-CB 3.38Å; G392-L396 PolarHBondContact O-N 3.47Å
393	M	93.6	Very high	93.2	Very high	90 Å²	90	54.5 Å²	54.5	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-68.8	-37	178.8	-70.3	-62.3	-64.6	0	0	112.5	V389 E390 A391 L396 R397	V389-M393 PolarHBondContact O-N 2.67Å; E390-M393 WeakPolarHBondContact O-CA 3.3Å; E390-M393 WeakPolarHBondContact O-CB 3.42Å; E390-M393 PolarHBondContact O-N 3.42Å; A391-M393 VanDerWaalsContact C-N 3.34Å; A391-M393 PolarHBondContact O-N 3.32Å; M393-L396 PolarHBondContact O-N 2.92Å; M393-R397 WeakPolarHBondContact O-CG 3.22Å; M393-R397 PolarHBondContact O-N 3.2Å
394	I	93.6	Very high	93.3	Very high	14 Å²	14	54.9 Å²	54.9	7%	0.072	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-47	176.9	-66.8	166	0	0	0	110.1	E390 A391 L396 R397 R398 D407 E410	E390-I394 WeakPolarHBondContact O-CG1 3.22Å; E390-I394 PolarHBondContact O-N 3.22Å; A391-I394 PolarHBondContact O-N 3.43Å; I394-L396 PolarHBondContact O-N 2.68Å; I394-R397 WeakPolarHBondContact O-CB 3.21Å; I394-R397 PolarHBondContact O-N 3.42Å; I394-R397 VanDerWaalsContact O-N 3.08Å; I394-R398 PolarHBondContact O-N 2.85Å; I394-R398 VanDerWaalsContact O-N 3.16Å; I394-D407 HydrophobicContact CG2-CB 4.49Å; I394-E410 HydrophobicContact CD1-CB 3.65Å; I394-E410 WeakPolarHBondContact CG2-OE2 3.42Å
395	A	93.8	Very high	93.4	Very high	5 Å²	5	56.7 Å²	56.7	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-37	174.8	0	0	0	0	0	112.2	A391 R398 G399 A400 L403	A391-A395 WeakPolarHBondContact O-CB 3.45Å; A391-A395 PolarHBondContact O-N 3.48Å; A395-R398 WeakPolarHBondContact O-CG 3.47Å; A395-G399 PolarHBondContact O-N 2.82Å; A395-A400 PolarHBondContact O-N 3.37Å; A395-L403 HydrophobicContact CB-CD2 3.56Å; A395-L403 HydrophobicContact CB-CG 4.31Å
396	L	94.4	Very high	93.4	Very high	121 Å²	121	58 Å²	58	63%	0.634	32%	0.317	S	S	*	.	H	α-helix	trans	-68	-39.8	174.9	-171.2	66.5	0	0	0	112.4	G392 M393 I394 R398 G399	G392-L396 WeakPolarHBondContact O-CB 3.38Å; G392-L396 PolarHBondContact O-N 3.47Å; M393-L396 PolarHBondContact O-N 2.92Å; I394-L396 PolarHBondContact O-N 2.68Å; L396-R398 VanDerWaalsContact C-N 3.31Å; L396-R398 PolarHBondContact O-N 3.3Å; L396-G399 PolarHBondContact O-N 2.8Å
397	R	93.1	Very high	93.5	Very high	162 Å²	162	56.6 Å²	56.6	61%	0.611	31%	0.305	S	S	*	.	H	α-helix	trans	-62	-35.9	177.2	-74.9	179.2	-135.1	158.2	4.1	112.5	M393 I394 G399 E414	M393-R397 WeakPolarHBondContact O-CG 3.22Å; M393-R397 PolarHBondContact O-N 3.2Å; I394-R397 WeakPolarHBondContact O-CB 3.21Å; I394-R397 PolarHBondContact O-N 3.42Å; I394-R397 VanDerWaalsContact O-N 3.08Å; R397-G399 VanDerWaalsContact C-N 3.27Å; R397-E414 IonicContact NH2-OE2 2.8Å; R397-E414 PolarHBondContact NH2-OE2 3.45Å
398	R	91.7	Very high	93.5	Very high	102 Å²	102	56.6 Å²	56.6	39%	0.385	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-5.7	173.9	67.3	174	-174.8	-157.5	-1.7	113.9	I394 A395 L396 A400 E402 D407	I394-R398 PolarHBondContact O-N 2.85Å; I394-R398 VanDerWaalsContact O-N 3.16Å; A395-R398 WeakPolarHBondContact O-CG 3.47Å; L396-R398 VanDerWaalsContact C-N 3.31Å; L396-R398 PolarHBondContact O-N 3.3Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 HydrophobicContact CG-CB 3.81Å; R398-E402 PolarHBondContact NH2-O 2.72Å; R398-D407 VanDerWaalsContact CZ-CG 3.42Å; R398-D407 IonicContact CZ-OD1 3.24Å; R398-D407 IonicContact CZ-OD2 2.77Å; R398-D407 IonicContact NE-OD1 2.6Å; R398-D407 IonicContact NH1-OD1 3.48Å; R398-D407 PolarHBondContact NH1-OD1 3.09Å; R398-D407 IonicContact NH1-OD2 2.61Å; R398-D407 PolarHBondContact NH1-OD2 3.06Å; R398-D407 IonicContact NH2-OD1 3.25Å; R398-D407 PolarHBondContact NH2-OD1 2.8Å; R398-D407 IonicContact NH2-OD2 2.86Å; R398-D407 PolarHBondContact NH2-OD2 3.1Å
399	G	91.9	Very high	93.4	Very high	65 Å²	65	59.8 Å²	59.8	67%	0.67	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	21.5	-177.5	0	0	0	0	0	114.4	A395 L396 R397	A395-G399 PolarHBondContact O-N 2.82Å; L396-G399 PolarHBondContact O-N 2.8Å; R397-G399 VanDerWaalsContact C-N 3.27Å
400	A	91.6	Very high	93.4	Very high	37 Å²	37	61.5 Å²	61.5	31%	0.306	32%	0.323	S	S	.	.			trans	-86.9	154	177	0	0	0	0	0	111.8	A395 R398	A395-A400 PolarHBondContact O-N 3.37Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 HydrophobicContact CG-CB 3.81Å
401	T	91.6	Very high	93.3	Very high	123 Å²	123	59.9 Å²	59.9	76%	0.755	32%	0.316	S	S	*	.	S	Bend	trans	-97.3	-10.9	179.4	50.7	0	0	0	0	113.8	N362	N362-T401 WeakPolarHBondContact CB-O 3.37Å; N362-T401 PolarHBondContact ND2-O 3.44Å
402	E	93.8	Very high	93.3	Very high	92 Å²	92	60.1 Å²	60.1	43%	0.43	32%	0.317	S	S	.	.	S	Bend	trans	-126.2	151.8	-178.7	64.1	-170	173.1	0	0	110.6	N362 R398	N362-E402 WeakPolarHBondContact O-CA 3.49Å; R398-E402 PolarHBondContact NH2-O 2.72Å
403	L	93.9	Very high	93.1	Very high	7 Å²	7	64.3 Å²	64.3	4%	0.037	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-94.3	127.5	175.7	-74.1	159.1	0	0	0	110.4	M361 N362 V363 S364 A391 A395 D407 Y408	M361-L403 HydrophobicContact CB-CD1 3.75Å; M361-L403 HydrophobicContact CG-CD1 4.37Å; M361-L403 HydrophobicContact SD-CD1 3.83Å; N362-L403 PolarHBondContact O-N 2.85Å; V363-L403 HydrophobicContact CG1-CB 4.32Å; V363-L403 HydrophobicContact CG2-CB 4.36Å; V363-L403 HydrophobicContact CG2-CD1 4.04Å; S364-L403 VanDerWaalsContact CB-O 3.27Å; S364-L403 WeakPolarHBondContact CB-O 3.27Å; S364-L403 PolarHBondContact N-O 3Å; A391-L403 HydrophobicContact CB-CD2 4.01Å; A391-L403 WeakPolarHBondContact O-CD2 3.31Å; A395-L403 HydrophobicContact CB-CD2 3.56Å; A395-L403 HydrophobicContact CB-CG 4.31Å; L403-D407 HydrophobicContact CD2-CB 4.13Å; L403-Y408 HydrophobicContact CB-CE2 4.06Å
404	N	93.8	Very high	92.9	Very high	53 Å²	53	62.6 Å²	62.6	28%	0.283	32%	0.324	S	S	.	.			trans	-102.6	166	176.1	-66.9	-18.8	0	0	0	109.9	E406 D407	N404-E406 PolarHBondContact O-N 2.96Å; N404-D407 WeakPolarHBondContact CA-OD2 3.25Å; N404-D407 WeakPolarHBondContact CB-OD2 3.47Å; N404-D407 PolarHBondContact N-OD2 3.38Å; N404-D407 PolarHBondContact O-N 3.16Å
405	H	93.5	Very high	92.7	Very high	39 Å²	39	62.6 Å²	62.6	18%	0.181	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-35.9	178.9	-172.8	80.9	0	0	0	112.3	E371 D407 Y408 M409	E371-H405 IonicContact OE2-CE1 3.39Å; E371-H405 IonicContact OE2-NE2 2.73Å; H405-D407 VanDerWaalsContact C-N 3.33Å; H405-D407 PolarHBondContact O-N 3.09Å; H405-Y408 PolarHBondContact O-N 3.26Å; H405-M409 PolarHBondContact O-N 3.4Å; H405-M409 VanDerWaalsContact O-N 3.16Å
406	E	93.2	Very high	92.4	Very high	139 Å²	139	65.3 Å²	65.3	65%	0.65	34%	0.336	S	S	*	.	H	α-helix	trans	-61	-36.7	178.3	-63.2	-179.4	168.3	0	0	113	N404 Y408 M409 E410	N404-E406 PolarHBondContact O-N 2.96Å; E406-Y408 VanDerWaalsContact C-N 3.3Å; E406-Y408 PolarHBondContact O-N 2.97Å; E406-M409 WeakPolarHBondContact O-CB 3.3Å; E406-M409 PolarHBondContact O-N 3.4Å; E406-M409 VanDerWaalsContact O-N 3.16Å; E406-E410 PolarHBondContact O-N 3.3Å
407	D	94.3	Very high	91.6	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-66.1	-35.9	179.1	-54.8	-68.9	0	0	0	111.8	A391 I394 R398 L403 N404 H405 G411	A391-D407 HydrophobicContact CB-CB 4.17Å; I394-D407 HydrophobicContact CG2-CB 4.49Å; R398-D407 VanDerWaalsContact CZ-CG 3.42Å; R398-D407 IonicContact CZ-OD1 3.24Å; R398-D407 IonicContact CZ-OD2 2.77Å; R398-D407 IonicContact NE-OD1 2.6Å; R398-D407 IonicContact NH1-OD1 3.48Å; R398-D407 PolarHBondContact NH1-OD1 3.09Å; R398-D407 IonicContact NH1-OD2 2.61Å; R398-D407 PolarHBondContact NH1-OD2 3.06Å; R398-D407 IonicContact NH2-OD1 3.25Å; R398-D407 PolarHBondContact NH2-OD1 2.8Å; R398-D407 IonicContact NH2-OD2 2.86Å; R398-D407 PolarHBondContact NH2-OD2 3.1Å; L403-D407 HydrophobicContact CD2-CB 4.13Å; N404-D407 WeakPolarHBondContact CA-OD2 3.25Å; N404-D407 WeakPolarHBondContact CB-OD2 3.47Å; N404-D407 PolarHBondContact N-OD2 3.38Å; N404-D407 PolarHBondContact O-N 3.16Å; H405-D407 VanDerWaalsContact C-N 3.33Å; H405-D407 PolarHBondContact O-N 3.09Å; D407-G411 PolarHBondContact O-N 2.84Å
408	Y	94.5	Very high	90.5	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67.8	-40.4	174.4	-76.8	-80.8	0	0	0	111	S358 V363 V367 L372 V387 C388 A391 L403 H405 E406 G411 I412	S358-Y408 WeakPolarHBondContact CB-OH 3.31Å; V363-Y408 HydrophobicContact CG1-CE2 4.17Å; V367-Y408 HydrophobicContact CG1-CD2 3.98Å; V367-Y408 HydrophobicContact CG1-CE2 3.98Å; V367-Y408 HydrophobicContact CG2-CD2 4.28Å; V367-Y408 HydrophobicContact CG2-CE2 4.18Å; L372-Y408 HydrophobicContact CD1-CD1 3.97Å; L372-Y408 HydrophobicContact CD1-CD2 4.17Å; L372-Y408 HydrophobicContact CD1-CG 3.67Å; V387-Y408 HydrophobicContact CG1-CD1 4.12Å; C388-Y408 HydrophobicContact CB-CE1 4.45Å; A391-Y408 HydrophobicContact CB-CD1 3.84Å; A391-Y408 HydrophobicContact CB-CD2 4.47Å; A391-Y408 HydrophobicContact CB-CE1 4.04Å; A391-Y408 HydrophobicContact CB-CG 4.06Å; L403-Y408 HydrophobicContact CB-CE2 4.06Å; H405-Y408 PolarHBondContact O-N 3.26Å; E406-Y408 VanDerWaalsContact C-N 3.3Å; E406-Y408 PolarHBondContact O-N 2.97Å; Y408-G411 PolarHBondContact O-N 3.37Å; Y408-I412 VanDerWaalsContact O-CG1 3.22Å; Y408-I412 WeakPolarHBondContact O-CG1 3.21Å; Y408-I412 PolarHBondContact O-N 2.83Å
409	M	93.7	Very high	89.1	Confident	69 Å²	69	62.5 Å²	62.5	34%	0.34	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-45.4	176.5	-70.3	-62.9	-74.1	0	0	112	L372 C375 H405 E406 G411 I412 L413	L372-M409 HydrophobicContact CD2-CG 4.37Å; L372-M409 HydrophobicContact CD2-SD 4Å; C375-M409 HydrophobicContact CB-SD 4.34Å; H405-M409 PolarHBondContact O-N 3.4Å; H405-M409 VanDerWaalsContact O-N 3.16Å; E406-M409 WeakPolarHBondContact O-CB 3.3Å; E406-M409 PolarHBondContact O-N 3.4Å; E406-M409 VanDerWaalsContact O-N 3.16Å; M409-G411 VanDerWaalsContact C-N 3.34Å; M409-I412 PolarHBondContact O-N 3.43Å; M409-I412 HydrophobicContact SD-CD1 4.26Å; M409-L413 WeakPolarHBondContact O-CG 3.42Å; M409-L413 PolarHBondContact O-N 3.03Å; M409-L413 VanDerWaalsContact O-N 3.12Å
410	E	92.8	Very high	87.5	Confident	110 Å²	110	65.5 Å²	65.5	51%	0.514	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-39.6	173.3	-70.1	-169.8	178.3	0	0	112	I394 E406 I412 L413 E414	I394-E410 HydrophobicContact CD1-CB 3.65Å; I394-E410 WeakPolarHBondContact CG2-OE2 3.42Å; E406-E410 PolarHBondContact O-N 3.3Å; E410-I412 VanDerWaalsContact C-N 3.34Å; E410-I412 PolarHBondContact O-N 2.85Å; E410-L413 WeakPolarHBondContact O-CB 3.35Å; E410-L413 PolarHBondContact O-N 2.96Å; E410-E414 PolarHBondContact O-N 3.36Å
411	G	92.9	Very high	85.4	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-38.5	175.3	0	0	0	0	0	113	D407 Y408 M409 E414 V415	D407-G411 PolarHBondContact O-N 2.84Å; Y408-G411 PolarHBondContact O-N 3.37Å; M409-G411 VanDerWaalsContact C-N 3.34Å; G411-E414 PolarHBondContact O-N 3.12Å; G411-V415 VanDerWaalsContact O-CG2 3.3Å; G411-V415 WeakPolarHBondContact O-CG2 3.32Å; G411-V415 PolarHBondContact O-N 3.43Å
412	I	93.2	Very high	83.2	Confident	6 Å²	6	69.2 Å²	69.2	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-62	-47.5	173.3	-68.4	164.2	0	0	0	109.9	L372 C375 T376 F379 V387 Y408 M409 E410 E414 V415 Q416	L372-I412 HydrophobicContact CD2-CD1 3.95Å; C375-I412 HydrophobicContact CB-CD1 4.16Å; T376-I412 HydrophobicContact CG2-CB 4.45Å; T376-I412 HydrophobicContact CG2-CD1 3.54Å; T376-I412 HydrophobicContact CG2-CG1 3.56Å; T376-I412 HydrophobicContact CG2-CG2 4.01Å; F379-I412 HydrophobicContact CZ-CG2 4.36Å; V387-I412 HydrophobicContact CG1-CG1 3.7Å; V387-I412 HydrophobicContact CG2-CG1 4.03Å; Y408-I412 VanDerWaalsContact O-CG1 3.22Å; Y408-I412 WeakPolarHBondContact O-CG1 3.21Å; Y408-I412 PolarHBondContact O-N 2.83Å; M409-I412 PolarHBondContact O-N 3.43Å; M409-I412 HydrophobicContact SD-CD1 4.26Å; E410-I412 VanDerWaalsContact C-N 3.34Å; E410-I412 PolarHBondContact O-N 2.85Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 3Å; I412-V415 PolarHBondContact O-N 3.41Å; I412-Q416 HydrophobicContact CG2-CG 4.23Å; I412-Q416 WeakPolarHBondContact O-CB 3.49Å; I412-Q416 VanDerWaalsContact O-CG 3.3Å; I412-Q416 WeakPolarHBondContact O-CG 3.44Å; I412-Q416 PolarHBondContact O-N 3.34Å
413	L	90.9	Very high	81	Confident	113 Å²	113	71.1 Å²	71.1	59%	0.592	37%	0.368	S	S	*	.	H	α-helix	trans	-59.9	-42	177.8	-69.2	171.6	0	0	0	111.7	M409 E410 Q416 A417	M409-L413 WeakPolarHBondContact O-CG 3.42Å; M409-L413 PolarHBondContact O-N 3.03Å; M409-L413 VanDerWaalsContact O-N 3.12Å; E410-L413 WeakPolarHBondContact O-CB 3.35Å; E410-L413 PolarHBondContact O-N 2.96Å; L413-Q416 PolarHBondContact O-N 3.24Å; L413-A417 VanDerWaalsContact O-CB 3.22Å; L413-A417 WeakPolarHBondContact O-CB 3.43Å; L413-A417 PolarHBondContact O-N 3.01Å
414	E	89.9	Confident	78.7	Confident	54 Å²	54	78 Å²	78	25%	0.252	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-44.2	177.9	-172.1	169.9	167	0	0	111.6	R397 E410 G411 I412 A417 K418	R397-E414 IonicContact NH2-OE2 2.8Å; R397-E414 PolarHBondContact NH2-OE2 3.45Å; E410-E414 PolarHBondContact O-N 3.36Å; G411-E414 PolarHBondContact O-N 3.12Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 3Å; E414-A417 PolarHBondContact O-N 3.45Å; E414-K418 WeakPolarHBondContact O-CG 3.4Å; E414-K418 PolarHBondContact O-N 3.12Å; E414-K418 VanDerWaalsContact O-N 3.09Å; E414-K418 IonicContact OE1-NZ 3.58Å; E414-K418 PolarHBondContact OE1-NZ 3.02Å
415	V	89.1	Confident	76.7	Confident	13 Å²	13	84.7 Å²	84.7	8%	0.079	42%	0.422	C	S	.	.	H	α-helix	trans	-66.8	-37.5	177.1	174.7	0	0	0	0	111.6	F379 Q383 A386 V387 E390 G411 I412	F379-V415 HydrophobicContact CE2-CB 4.39Å; F379-V415 HydrophobicContact CE2-CG1 3.89Å; F379-V415 HydrophobicContact CZ-CB 4.42Å; F379-V415 HydrophobicContact CZ-CG1 3.97Å; Q383-V415 HydrophobicContact CB-CG1 4.37Å; Q383-V415 HydrophobicContact CG-CG1 4.33Å; A386-V415 HydrophobicContact CB-CG2 4.16Å; V387-V415 HydrophobicContact CG2-CB 4.22Å; V387-V415 HydrophobicContact CG2-CG1 4.47Å; V387-V415 HydrophobicContact CG2-CG2 3.99Å; E390-V415 HydrophobicContact CG-CG2 3.99Å; G411-V415 VanDerWaalsContact O-CG2 3.3Å; G411-V415 WeakPolarHBondContact O-CG2 3.32Å; G411-V415 PolarHBondContact O-N 3.43Å; I412-V415 PolarHBondContact O-N 3.41Å
416	Q	86.1	Confident	74.7	Confident	62 Å²	62	93.5 Å²	93.5	29%	0.29	46%	0.456	S	S	.	.	H	α-helix	trans	-69.5	-38.9	174.3	-72	-173.8	2.1	0	0	112.4	F379 I412 L413 K418 K419 K420	F379-Q416 HydrophobicContact CE1-CG 3.81Å; F379-Q416 HydrophobicContact CZ-CG 3.61Å; I412-Q416 HydrophobicContact CG2-CG 4.23Å; I412-Q416 WeakPolarHBondContact O-CB 3.49Å; I412-Q416 VanDerWaalsContact O-CG 3.3Å; I412-Q416 WeakPolarHBondContact O-CG 3.44Å; I412-Q416 PolarHBondContact O-N 3.34Å; L413-Q416 PolarHBondContact O-N 3.24Å; Q416-K418 VanDerWaalsContact C-N 3.31Å; Q416-K418 PolarHBondContact O-N 3.05Å; Q416-K419 WeakPolarHBondContact O-CA 3.13Å; Q416-K419 WeakPolarHBondContact O-CB 3.45Å; Q416-K419 PolarHBondContact O-N 2.77Å; Q416-K420 PolarHBondContact O-N 2.94Å; Q416-K420 VanDerWaalsContact O-N 3.12Å
417	A	77.9	Confident	72.3	Confident	62 Å²	62	95.3 Å²	95.3	51%	0.512	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-38.2	178.3	0	0	0	0	0	111.4	L413 E414 K419 K420	L413-A417 VanDerWaalsContact O-CB 3.22Å; L413-A417 WeakPolarHBondContact O-CB 3.43Å; L413-A417 PolarHBondContact O-N 3.01Å; E414-A417 PolarHBondContact O-N 3.45Å; A417-K419 PolarHBondContact O-N 3Å; A417-K419 VanDerWaalsContact O-N 3.16Å; A417-K420 CarbonylContact O-C 3.3Å; A417-K420 VanDerWaalsContact O-C 3.3Å; A417-K420 PolarHBondContact O-N 2.83Å
418	K	69.7	Low	71.2	Confident	132 Å²	132	99.9 Å²	99.9	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-58.9	-24.3	171	-71.7	174.4	-172.7	174	0	112.8	E390 E414 Q416	E390-K418 IonicContact OE1-NZ 3.34Å; E390-K418 PolarHBondContact OE1-NZ 2.85Å; E414-K418 WeakPolarHBondContact O-CG 3.4Å; E414-K418 PolarHBondContact O-N 3.12Å; E414-K418 VanDerWaalsContact O-N 3.09Å; E414-K418 IonicContact OE1-NZ 3.58Å; E414-K418 PolarHBondContact OE1-NZ 3.02Å; Q416-K418 VanDerWaalsContact C-N 3.31Å; Q416-K418 PolarHBondContact O-N 3.05Å
419	K	63.3	Low	70	Confident	133 Å²	133	105.2 Å²	105.2	58%	0.578	55%	0.546	S	S	*	.	H	α-helix	trans	-83.9	-29.7	174.2	-165.7	-179	179.5	-178.4	0	112.7	Q416 A417	Q416-K419 WeakPolarHBondContact O-CA 3.13Å; Q416-K419 WeakPolarHBondContact O-CB 3.45Å; Q416-K419 PolarHBondContact O-N 2.77Å; A417-K419 PolarHBondContact O-N 3Å; A417-K419 VanDerWaalsContact O-N 3.16Å
420	K	57.9	Low	68.7	Low	128 Å²	128	107.2 Å²	107.2	56%	0.557	56%	0.557	S	S	*	*			trans	-112.4	70.4	-176.7	-70.7	-177.1	179.5	175.5	0	111.4	Q416 A417 N422	Q416-K420 PolarHBondContact O-N 2.94Å; Q416-K420 VanDerWaalsContact O-N 3.12Å; A417-K420 CarbonylContact O-C 3.3Å; A417-K420 VanDerWaalsContact O-C 3.3Å; A417-K420 PolarHBondContact O-N 2.83Å; K420-N422 PolarHBondContact O-N 2.84Å
421	A	48.6	Very low	67.3	Low	93 Å²	93	107 Å²	107	77%	0.769	56%	0.56	S	S	*	*			trans	-76.1	30	167.2	0	0	0	0	0	113.3
422	N	43.9	Very low	65.7	Low	144 Å²	144	113.7 Å²	113.7	77%	0.77	60%	0.595	S	S	*	*	S	Bend	trans	-128.6	115.4	171.5	-79.6	-28.3	0	0	0	108.6	K420	K420-N422 PolarHBondContact O-N 2.84Å
423	L	48.1	Very low	63.9	Low	133 Å²	133	120.9 Å²	120.9	70%	0.696	63%	0.632	S	S	*	*			trans	-47.9	132.6	-176.1	-85.7	77.4	0	0	0	113.1	Y425	L423-Y425 HydrophobicContact CB-CD2 4.11Å; L423-Y425 HydrophobicContact CB-CE2 4.29Å; L423-Y425 HydrophobicContact CD2-CD2 3.77Å; L423-Y425 HydrophobicContact CD2-CE2 3.1Å; L423-Y425 HydrophobicContact CG-CE2 4.31Å
424	Q	45.8	Very low	61.9	Low	152 Å²	152	121.4 Å²	121.4	71%	0.71	64%	0.635	S	S	*	*			trans	-91	93.8	162.1	-70	-170.9	-32.8	0	0	108.9	Y426	Q424-Y426 VanDerWaalsContact C-N 3.35Å
425	Y	50.9	Low	59.8	Low	193 Å²	193	126.6 Å²	126.6	76%	0.757	66%	0.664	S	S	*	*			trans	-94.2	63.9	161.2	-77.8	-70.3	0	0	0	109.6	L423	L423-Y425 HydrophobicContact CB-CD2 4.11Å; L423-Y425 HydrophobicContact CB-CE2 4.29Å; L423-Y425 HydrophobicContact CD2-CD2 3.77Å; L423-Y425 HydrophobicContact CD2-CE2 3.1Å; L423-Y425 HydrophobicContact CG-CE2 4.31Å
426	Y	53.2	Low	57.3	Low	223 Å²	223	136.1 Å²	136.1	88%	0.875	71%	0.713	S	S	*	*			trans	-127.4	121.4	164.9	-71.4	-74.6	0	0	0	108	Q424	Q424-Y426 VanDerWaalsContact C-N 3.35Å
427	A	42.8	Very low	54.7	Low	178 Å²	178	142.8 Å²	142.8	100%	1.471	75%	0.752	S	S	*	*			trans	-71.3	0	-178.9	0	0	0	0	0	112

Retrieved 427 of 427 residues in 2511.7 ms (Link to these results)

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