A0A077ZD44_TRITR Loading...

dCMP cyt deam 1 and SpoU methylase domain contain ing protein

AlphaFold DB , UniProt , Accession A0A077ZD44, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 501 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	36.6	Very low	42.2	Very low	242 Å²	242	162.6 Å²	162.6	100%	1.192	81%	0.808	S	S	*	*				0	85.1	0	-71	-176.4	-157.1	0	0	106.5	E3	M1-E3 PolarHBondContact O-N 2.91Å
2	D	34.5	Very low	42.3	Very low	166 Å²	166	157 Å²	157	89%	0.888	78%	0.783	S	S	*	*			trans	-85.9	94.7	178.5	-81.4	-45.2	0	0	0	109	K4	D2-K4 PolarHBondContact O-N 3.44Å; D2-K4 VanDerWaalsContact O-N 3.12Å
3	E	39.1	Very low	43.5	Very low	173 Å²	173	154.9 Å²	154.9	81%	0.808	77%	0.774	S	S	*	*			trans	-75.2	97.1	164.4	-83	-171.5	162.8	0	0	109.1	M1 R5	M1-E3 PolarHBondContact O-N 2.91Å; E3-R5 VanDerWaalsContact C-N 3.29Å; E3-R5 PolarHBondContact O-N 3.02Å
4	K	37.4	Very low	43.8	Very low	195 Å²	195	157.6 Å²	157.6	85%	0.848	78%	0.778	S	S	*	*			trans	-56.6	94.9	156.8	-77.5	-179.8	175.4	177.1	0	108.4	D2 T6	D2-K4 PolarHBondContact O-N 3.44Å; D2-K4 VanDerWaalsContact O-N 3.12Å; K4-T6 PolarHBondContact O-N 3.46Å
5	R	39.4	Very low	44.5	Very low	213 Å²	213	155.5 Å²	155.5	80%	0.804	77%	0.77	S	S	*	*			trans	-62.6	104.5	164.6	-78.5	-174.6	-179.9	178.4	0.5	108.6	E3 F7	E3-R5 VanDerWaalsContact C-N 3.29Å; E3-R5 PolarHBondContact O-N 3.02Å; R5-F7 WeakPolarHBondContact O-CD2 3.31Å; R5-F7 PolarHBondContact O-N 3Å
6	T	39	Very low	45.3	Very low	124 Å²	124	152.1 Å²	152.1	76%	0.761	77%	0.774	S	S	*	*			trans	-64.2	108.3	165.2	41.6	0	0	0	0	109	K4 N8	K4-T6 PolarHBondContact O-N 3.46Å; T6-N8 PolarHBondContact O-N 3.22Å; T6-N8 VanDerWaalsContact O-N 3.15Å
7	F	45.1	Very low	46.4	Very low	155 Å²	155	151.4 Å²	151.4	68%	0.68	78%	0.778	S	S	*	*			trans	-76.1	91.5	173	-83.2	-93	0	0	0	109.6	R5 L12	R5-F7 WeakPolarHBondContact O-CD2 3.31Å; R5-F7 PolarHBondContact O-N 3Å; F7-L12 HydrophobicContact CD1-CD1 4.03Å; F7-L12 HydrophobicContact CE1-CD1 3.96Å
8	N	46.2	Very low	47.6	Very low	156 Å²	156	147.7 Å²	147.7	83%	0.834	77%	0.774	S	S	*	*			trans	-108.9	34.6	173.1	-97.6	-0.7	0	0	0	112.1	T6	T6-N8 PolarHBondContact O-N 3.22Å; T6-N8 VanDerWaalsContact O-N 3.15Å
9	D	46.3	Very low	49	Very low	99 Å²	99	152.5 Å²	152.5	53%	0.529	78%	0.78	S	S	.	*			trans	-100.3	112.6	175	-160.5	-17.2	0	0	0	110.2	L11	D9-L11 PolarHBondContact O-N 2.99Å
10	P	49.7	Very low	50.6	Low	124 Å²	124	149.4 Å²	149.4	81%	0.805	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	10.1	-175.3	29.1	-35.3	0	0	0	114.6
11	L	50.6	Low	51.8	Low	142 Å²	142	143.7 Å²	143.7	74%	0.743	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	1.5	-177.7	-75.8	163.7	0	0	0	114.9	D9 I13	D9-L11 PolarHBondContact O-N 2.99Å; L11-I13 PolarHBondContact O-N 3.41Å
12	L	43.1	Very low	53.9	Low	95 Å²	95	135.6 Å²	135.6	50%	0.497	70%	0.701	S	S	.	*			trans	-95.2	86.7	177.8	-116	146	0	0	0	110.9	F7 I15	F7-L12 HydrophobicContact CD1-CD1 4.03Å; F7-L12 HydrophobicContact CE1-CD1 3.96Å; L12-I15 HydrophobicContact CD2-CD1 4.24Å; L12-I15 HydrophobicContact CD2-CG1 3.86Å
13	I	58.9	Low	56	Low	130 Å²	130	130.6 Å²	130.6	67%	0.667	67%	0.674	S	S	*	*			trans	-82.7	-29.5	-168.7	-48.7	-178.4	0	0	0	112.5	L11	L11-I13 PolarHBondContact O-N 3.41Å
14	F	46.7	Very low	57.6	Low	192 Å²	192	129.7 Å²	129.7	84%	0.842	67%	0.668	S	S	*	*			trans	-153.7	141.4	174.1	-66.1	-78.3	0	0	0	112.8
15	I	54.5	Low	59.2	Low	127 Å²	127	122.4 Å²	122.4	65%	0.651	64%	0.644	S	S	*	*			trans	-110.6	119.8	166.4	-63.6	175	0	0	0	107.4	L12 V17	L12-I15 HydrophobicContact CD2-CD1 4.24Å; L12-I15 HydrophobicContact CD2-CG1 3.86Å; I15-V17 HydrophobicContact CG2-CG2 4.11Å
16	A	57.2	Low	60.7	Low	100 Å²	100	112.5 Å²	112.5	83%	0.826	61%	0.607	S	S	*	*			trans	-102.5	116.7	171.8	0	0	0	0	0	109.2
17	V	64.9	Low	62.2	Low	140 Å²	140	108.8 Å²	108.8	85%	0.848	59%	0.586	S	S	*	*			trans	-99.2	114.9	171.7	-176.5	0	0	0	0	107.6	I15	I15-V17 HydrophobicContact CG2-CG2 4.11Å
18	A	67.8	Low	63	Low	85 Å²	85	108.4 Å²	108.4	70%	0.702	59%	0.586	S	S	*	*			trans	-124	139.3	177.7	0	0	0	0	0	110
19	R	74.3	Confident	63.5	Low	239 Å²	239	103 Å²	103	90%	0.902	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-70.5	138.1	170.7	-170.2	179.5	-177.8	-179.6	2	108.7
20	K	79.7	Confident	64.2	Low	91 Å²	91	100.6 Å²	100.6	40%	0.396	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-51.8	124.2	169	175.3	173.8	169.8	167.1	0	109.4	W75 E94	K20-W75 HydrophobicContact CD-CD2 3.95Å; K20-W75 HydrophobicContact CD-CE3 4.45Å; K20-W75 HydrophobicContact CD-CG 4.09Å; K20-W75 VanDerWaalsContact CE-CE2 3.48Å; K20-W75 VanDerWaalsContact CE-NE1 3.32Å; K20-W75 HydrophobicContact CG-CD2 4.09Å; K20-W75 HydrophobicContact CG-CE3 4.13Å; K20-W75 HydrophobicContact CG-CH2 4.35Å; K20-W75 HydrophobicContact CG-CZ2 4.29Å; K20-W75 HydrophobicContact CG-CZ3 4.27Å; K20-E94 IonicContact NZ-OE1 2.74Å; K20-E94 PolarHBondContact NZ-OE1 3.14Å; K20-E94 IonicContact NZ-OE2 3.32Å; K20-E94 PolarHBondContact NZ-OE2 3.16Å
21	P	76	Confident	64.9	Low	29 Å²	29	97.3 Å²	97.3	19%	0.188	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-63	142.9	178.8	26.4	-34.9	0	0	0	110.4	I26 W75 F88	P21-I26 HydrophobicContact CB-CD1 4.35Å; P21-I26 HydrophobicContact CB-CG1 4.01Å; P21-I26 HydrophobicContact CG-CD1 3.98Å; P21-I26 HydrophobicContact CG-CG1 4.07Å; P21-W75 HydrophobicContact CG-CH2 3.66Å; P21-W75 HydrophobicContact CG-CZ3 4.05Å; P21-F88 HydrophobicContact CB-CD1 4.44Å; P21-F88 HydrophobicContact CG-CD1 3.77Å; P21-F88 HydrophobicContact CG-CE1 3.78Å
22	S	81.5	Confident	65.3	Low	72 Å²	72	97.4 Å²	97.4	50%	0.503	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-71.3	150.5	174.5	67.7	0	0	0	0	110.1	K24 A25 I26	S22-K24 PolarHBondContact O-N 2.96Å; S22-A25 WeakPolarHBondContact O-CB 3.26Å; S22-A25 PolarHBondContact O-N 3.03Å; S22-A25 PolarHBondContact OG-N 3.36Å; S22-I26 PolarHBondContact O-N 3.16Å; S22-I26 VanDerWaalsContact O-N 3.12Å
23	L	77.7	Confident	66.3	Low	62 Å²	62	97.6 Å²	97.6	33%	0.325	53%	0.534	S	S	.	.	H	α-helix	trans	-53.4	-40.1	175.3	-78.6	163.3	0	0	0	111.8	A25 I26 S27 P91 Y93	L23-A25 VanDerWaalsContact C-N 3.31Å; L23-A25 PolarHBondContact O-N 3.26Å; L23-I26 PolarHBondContact O-N 3.14Å; L23-S27 WeakPolarHBondContact O-CB 3.48Å; L23-S27 PolarHBondContact O-N 3.21Å; L23-S27 PolarHBondContact O-OG 3.07Å; L23-S27 VanDerWaalsContact O-OG 3.09Å; L23-P91 HydrophobicContact CD2-CB 4.06Å; L23-Y93 HydrophobicContact CD1-CD1 3.66Å; L23-Y93 HydrophobicContact CD1-CE1 3.39Å; L23-Y93 HydrophobicContact CD1-CG 4.41Å; L23-Y93 HydrophobicContact CD2-CD1 4.39Å; L23-Y93 HydrophobicContact CD2-CD2 4.21Å; L23-Y93 HydrophobicContact CD2-CE1 4.16Å; L23-Y93 HydrophobicContact CD2-CE2 3.94Å; L23-Y93 HydrophobicContact CD2-CG 4.42Å; L23-Y93 HydrophobicContact CG-CE1 4.36Å
24	K	73.6	Confident	67.1	Low	153 Å²	153	93.2 Å²	93.2	67%	0.665	51%	0.513	S	S	*	.	H	α-helix	trans	-57.2	-43.1	175.2	-172.7	177.4	-179.5	179.1	0	112.3	S22 Q28	S22-K24 PolarHBondContact O-N 2.96Å; K24-Q28 VanDerWaalsContact O-CG 3.28Å; K24-Q28 WeakPolarHBondContact O-CG 3.44Å; K24-Q28 PolarHBondContact O-N 3.46Å; K24-Q28 VanDerWaalsContact O-N 3.1Å
25	A	70.1	Confident	68.4	Low	43 Å²	43	84.4 Å²	84.4	36%	0.355	48%	0.475	S	S	.	.	H	α-helix	trans	-66.7	-38.2	178.5	0	0	0	0	0	111.9	S22 L23 A29	S22-A25 WeakPolarHBondContact O-CB 3.26Å; S22-A25 PolarHBondContact O-N 3.03Å; S22-A25 PolarHBondContact OG-N 3.36Å; L23-A25 VanDerWaalsContact C-N 3.31Å; L23-A25 PolarHBondContact O-N 3.26Å; A25-A29 PolarHBondContact O-N 3.3Å
26	I	70.9	Confident	69.5	Low	5 Å²	5	82.4 Å²	82.4	3%	0.026	47%	0.471	C	S	.	.	H	α-helix	trans	-71.7	-42.4	177.3	-53.4	167.9	0	0	0	110.9	P21 S22 L23 Q28 A29 W75 L90 P91	P21-I26 HydrophobicContact CB-CD1 4.35Å; P21-I26 HydrophobicContact CB-CG1 4.01Å; P21-I26 HydrophobicContact CG-CD1 3.98Å; P21-I26 HydrophobicContact CG-CG1 4.07Å; S22-I26 PolarHBondContact O-N 3.16Å; S22-I26 VanDerWaalsContact O-N 3.12Å; L23-I26 PolarHBondContact O-N 3.14Å; I26-Q28 PolarHBondContact O-N 2.95Å; I26-A29 WeakPolarHBondContact O-CA 3.4Å; I26-A29 WeakPolarHBondContact O-CB 3.09Å; I26-A29 PolarHBondContact O-N 2.94Å; I26-W75 HydrophobicContact CD1-CH2 4.38Å; I26-W75 HydrophobicContact CD1-CZ2 4.45Å; I26-L90 VanDerWaalsContact CG2-C 3.47Å; I26-P91 HydrophobicContact CB-CG 4.49Å; I26-P91 HydrophobicContact CG2-CB 4.48Å; I26-P91 HydrophobicContact CG2-CG 3.97Å
27	S	71	Confident	70.6	Confident	46 Å²	46	79.3 Å²	79.3	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-33.8	176.9	-63.6	0	0	0	0	112.3	L23 A29 Q30	L23-S27 WeakPolarHBondContact O-CB 3.48Å; L23-S27 PolarHBondContact O-N 3.21Å; L23-S27 PolarHBondContact O-OG 3.07Å; L23-S27 VanDerWaalsContact O-OG 3.09Å; S27-A29 PolarHBondContact O-N 3.45Å; S27-Q30 VanDerWaalsContact O-CB 3.29Å; S27-Q30 WeakPolarHBondContact O-CB 3.5Å; S27-Q30 WeakPolarHBondContact O-CG 3.4Å; S27-Q30 PolarHBondContact O-N 2.68Å
28	Q	62.8	Low	71.4	Confident	147 Å²	147	74.4 Å²	74.4	69%	0.687	41%	0.409	S	S	*	.	H	α-helix	trans	-68.8	-21.8	173.9	-75.4	174.7	-21.6	0	0	113.2	K24 I26 Q30	K24-Q28 VanDerWaalsContact O-CG 3.28Å; K24-Q28 WeakPolarHBondContact O-CG 3.44Å; K24-Q28 PolarHBondContact O-N 3.46Å; K24-Q28 VanDerWaalsContact O-N 3.1Å; I26-Q28 PolarHBondContact O-N 2.95Å; Q28-Q30 VanDerWaalsContact C-N 3.28Å
29	A	55.1	Low	72.2	Confident	43 Å²	43	71.7 Å²	71.7	36%	0.355	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.2	174.1	0	0	0	0	0	113	A25 I26 S27 T31	A25-A29 PolarHBondContact O-N 3.3Å; I26-A29 WeakPolarHBondContact O-CA 3.4Å; I26-A29 WeakPolarHBondContact O-CB 3.09Å; I26-A29 PolarHBondContact O-N 2.94Å; S27-A29 PolarHBondContact O-N 3.45Å; A29-T31 PolarHBondContact O-N 2.93Å
30	Q	62.8	Low	72.7	Confident	47 Å²	47	62.2 Å²	62.2	22%	0.22	35%	0.352	C	S	.	.			trans	-68.5	129.8	175.8	-66.2	-169.2	-51.9	0	0	110.6	S27 Q28 R63 P91	S27-Q30 VanDerWaalsContact O-CB 3.29Å; S27-Q30 WeakPolarHBondContact O-CB 3.5Å; S27-Q30 WeakPolarHBondContact O-CG 3.4Å; S27-Q30 PolarHBondContact O-N 2.68Å; Q28-Q30 VanDerWaalsContact C-N 3.28Å; Q30-R63 PolarHBondContact NE2-O 3.36Å; Q30-P91 HydrophobicContact CG-CG 4.42Å
31	T	63.1	Low	73	Confident	56 Å²	56	58.1 Å²	58.1	34%	0.344	33%	0.334	S	S	.	.			trans	-93.7	165.6	-177.2	64.7	0	0	0	0	110.9	A29 E33 T34	A29-T31 PolarHBondContact O-N 2.93Å; T31-E33 PolarHBondContact O-N 3.06Å; T31-E33 PolarHBondContact OG1-N 3.29Å; T31-T34 PolarHBondContact N-OG1 2.93Å; T31-T34 VanDerWaalsContact O-CB 3.31Å; T31-T34 WeakPolarHBondContact O-CB 3.43Å; T31-T34 PolarHBondContact O-N 3.38Å; T31-T34 PolarHBondContact O-OG1 2.86Å
32	P	60	Low	73.4	Confident	144 Å²	144	60.1 Å²	60.1	94%	0.935	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-16.6	171.2	-24.6	34.3	0	0	0	114	T34	P32-T34 VanDerWaalsContact C-N 3.26Å; P32-T34 PolarHBondContact O-N 2.78Å
33	E	64.5	Low	73.4	Confident	99 Å²	99	58.3 Å²	58.3	46%	0.463	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.5	176.8	-53.5	-169.7	178.9	0	0	113.9	T31 I35 R154	T31-E33 PolarHBondContact O-N 3.06Å; T31-E33 PolarHBondContact OG1-N 3.29Å; E33-I35 PolarHBondContact O-N 3.28Å; E33-R154 PolarHBondContact O-NH1 2.95Å; E33-R154 IonicContact OE2-NH2 3.54Å; E33-R154 PolarHBondContact OE2-NH2 3.49Å
34	T	74.6	Confident	73.8	Confident	37 Å²	37	56.7 Å²	56.7	23%	0.227	33%	0.328	C	S	.	.			trans	-71.5	123.1	178	-54.8	0	0	0	0	109.8	T31 P32 G61 R63	T31-T34 PolarHBondContact N-OG1 2.93Å; T31-T34 VanDerWaalsContact O-CB 3.31Å; T31-T34 WeakPolarHBondContact O-CB 3.43Å; T31-T34 PolarHBondContact O-N 3.38Å; T31-T34 PolarHBondContact O-OG1 2.86Å; P32-T34 VanDerWaalsContact C-N 3.26Å; P32-T34 PolarHBondContact O-N 2.78Å; T34-G61 CarbonylContact C-O 3.49Å; T34-G61 VanDerWaalsContact CA-O 3.26Å; T34-G61 WeakPolarHBondContact CA-O 3.41Å; T34-G61 VanDerWaalsContact CG2-O 3.32Å; T34-G61 WeakPolarHBondContact CG2-O 3.33Å; T34-R63 HydrophobicContact CG2-CB 4.17Å
35	I	74.4	Confident	74.4	Confident	7 Å²	7	57.3 Å²	57.3	4%	0.036	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	148.7	175.5	57.3	164.2	0	0	0	110.5	E33 L37 G61 R63 I153 R154 F157	E33-I35 PolarHBondContact O-N 3.28Å; I35-L37 HydrophobicContact CD1-CB 3.72Å; I35-L37 HydrophobicContact CD1-CD2 3.91Å; I35-L37 HydrophobicContact CD1-CG 4.48Å; I35-L37 HydrophobicContact CG1-CB 3.97Å; I35-L37 PolarHBondContact O-N 3.09Å; I35-G61 VanDerWaalsContact CG1-O 3.31Å; I35-G61 WeakPolarHBondContact CG1-O 3.44Å; I35-G61 PolarHBondContact N-O 3.08Å; I35-R63 PolarHBondContact O-N 3.33Å; I35-I153 HydrophobicContact CD1-CG2 4.17Å; I35-R154 HydrophobicContact CD1-CB 4.04Å; I35-R154 HydrophobicContact CG2-CB 4.3Å; I35-R154 HydrophobicContact CG2-CG 3.98Å; I35-F157 HydrophobicContact CG2-CB 4.25Å
36	P	78.2	Confident	75.2	Confident	86 Å²	86	58.3 Å²	58.3	56%	0.558	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	48.7	-179.3	34.4	-37.8	0	0	0	112.1	F157	P36-F157 HydrophobicContact CG-CD1 4.22Å; P36-F157 HydrophobicContact CG-CE1 3.51Å; P36-F157 HydrophobicContact CG-CE2 4.17Å; P36-F157 HydrophobicContact CG-CZ 3.48Å; P36-F157 VanDerWaalsContact CG-CZ 3.48Å
37	L	78.7	Confident	76	Confident	35 Å²	35	59.2 Å²	59.2	18%	0.183	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.1	179.3	-179.3	59.2	0	0	0	110.1	I35 V39 R63 A150 I153	I35-L37 HydrophobicContact CD1-CB 3.72Å; I35-L37 HydrophobicContact CD1-CD2 3.91Å; I35-L37 HydrophobicContact CD1-CG 4.48Å; I35-L37 HydrophobicContact CG1-CB 3.97Å; I35-L37 PolarHBondContact O-N 3.09Å; L37-V39 HydrophobicContact CD2-CG2 4.45Å; L37-V39 HydrophobicContact CG-CG2 4.17Å; L37-R63 PolarHBondContact O-N 3.37Å; L37-A150 HydrophobicContact CD2-CB 3.98Å; L37-I153 HydrophobicContact CD1-CD1 4.08Å; L37-I153 HydrophobicContact CD2-CB 4.43Å; L37-I153 HydrophobicContact CD2-CD1 3.89Å; L37-I153 HydrophobicContact CD2-CG2 4.26Å
38	I	81.9	Confident	76.6	Confident	37 Å²	37	60.8 Å²	60.8	19%	0.19	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.7	170.7	-59.9	175.5	0	0	0	108	R63 A64 L66 L105	I38-R63 HydrophobicContact CG1-CB 4.23Å; I38-R63 HydrophobicContact CG1-CG 4.48Å; I38-A64 WeakPolarHBondContact CA-O 3.43Å; I38-A64 HydrophobicContact CG1-CB 4.15Å; I38-A64 HydrophobicContact CG2-CB 4.11Å; I38-L66 HydrophobicContact CG2-CD1 3.97Å; I38-L66 HydrophobicContact CG2-CD2 4.36Å; I38-L66 HydrophobicContact CG2-CG 3.75Å; I38-L105 HydrophobicContact CB-CD2 3.98Å; I38-L105 HydrophobicContact CD1-CD2 3.66Å; I38-L105 HydrophobicContact CG1-CD2 4.42Å; I38-L105 HydrophobicContact CG2-CD2 3.7Å
39	V	84.6	Confident	77.7	Confident	28 Å²	28	56 Å²	56	17%	0.17	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.6	-179.3	-178.8	0	0	0	0	110.3	L37 L57 A64 M65 L66	L37-V39 HydrophobicContact CD2-CG2 4.45Å; L37-V39 HydrophobicContact CG-CG2 4.17Å; V39-L57 HydrophobicContact CB-CD1 3.65Å; V39-L57 HydrophobicContact CB-CD2 4.32Å; V39-L57 HydrophobicContact CG1-CD1 3.88Å; V39-L57 HydrophobicContact CG2-CD1 3.83Å; V39-L57 HydrophobicContact CG2-CD2 3.58Å; V39-L57 HydrophobicContact CG2-CG 4.32Å; V39-A64 PolarHBondContact N-O 2.8Å; V39-M65 CarbonylContact O-C 3.55Å; V39-M65 VanDerWaalsContact O-CA 3.29Å; V39-M65 WeakPolarHBondContact O-CA 3.46Å; V39-L66 PolarHBondContact O-N 3Å
40	V	85	Confident	79.3	Confident	40 Å²	40	54 Å²	54	24%	0.242	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.5	174.9	-171.8	0	0	0	0	109.4	L66 L68 I101 V111	V40-L66 CarbonylContact C-O 3.49Å; V40-L66 WeakPolarHBondContact CA-O 3.22Å; V40-L66 HydrophobicContact CG1-CB 4.42Å; V40-L66 HydrophobicContact CG2-CB 4.25Å; V40-L66 HydrophobicContact CG2-CD1 4.08Å; V40-L66 HydrophobicContact CG2-CG 4.43Å; V40-L68 HydrophobicContact CG1-CD1 4.28Å; V40-L68 HydrophobicContact CG1-CG 4.25Å; V40-I101 HydrophobicContact CG1-CD1 3.69Å; V40-V111 HydrophobicContact CG2-CG1 4.35Å
41	C	85.9	Confident	80.6	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.027	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.2	179.4	-61.1	0	0	0	0	109.4	I44 L53 M65 L66 T67 L68 C71	C41-I44 HydrophobicContact CB-CG1 3.91Å; C41-L53 WeakPolarHBondContact SG-CD2 3.48Å; C41-M65 HydrophobicContact CB-CE 4.47Å; C41-M65 WeakPolarHBondContact SG-CE 3.42Å; C41-L66 PolarHBondContact N-O 3.12Å; C41-T67 HydrophobicContact CB-CG2 4.17Å; C41-L68 WeakPolarHBondContact O-CB 3.4Å; C41-L68 PolarHBondContact O-N 3Å; C41-C71 PolarHBondContact O-SG 2.88Å
42	D	84.7	Confident	81.6	Confident	71 Å²	71	50.4 Å²	50.4	38%	0.38	29%	0.285	S	S	.	.			trans	-117.6	125.9	174.8	-167.5	2.2	0	0	0	109.5	I44 L68	D42-I44 VanDerWaalsContact C-N 3.3Å; D42-I44 PolarHBondContact O-N 3.4Å; D42-L68 HydrophobicContact CB-CD1 3.86Å
43	G	82.3	Confident	83	Confident	34 Å²	34	43.9 Å²	43.9	35%	0.351	24%	0.243	S	C	.	.	S	Bend	trans	62.6	24.2	175.1	0	0	0	0	0	116.7	K45 C71	G43-K45 PolarHBondContact O-N 3.36Å; G43-C71 PolarHBondContact N-SG 2.81Å
44	I	85.3	Confident	84.2	Confident	28 Å²	28	39.2 Å²	39.2	14%	0.144	22%	0.221	C	C	.	.			trans	-74.8	93.6	174.5	-55.1	-61.3	0	0	0	109.6	C41 D42 N49 M50 C71 C72	C41-I44 HydrophobicContact CB-CG1 3.91Å; D42-I44 VanDerWaalsContact C-N 3.3Å; D42-I44 PolarHBondContact O-N 3.4Å; I44-N49 HydrophobicContact CG2-CB 4.48Å; I44-M50 HydrophobicContact CB-CE 3.72Å; I44-M50 HydrophobicContact CB-SD 4.48Å; I44-M50 HydrophobicContact CG2-CB 4.05Å; I44-M50 HydrophobicContact CG2-CE 3.85Å; I44-M50 HydrophobicContact CG2-SD 4.17Å; I44-C71 PolarHBondContact N-SG 3.48Å; I44-C71 VanDerWaalsContact N-SG 3.36Å; I44-C71 WeakPolarHBondContact O-CA 3.25Å; I44-C72 PolarHBondContact O-N 3.24Å; I44-C72 PolarHBondContact O-SG 2.93Å; I44-C72 VanDerWaalsContact O-SG 3.34Å
45	K	85.9	Confident	84.6	Confident	166 Å²	166	40.4 Å²	40.4	72%	0.722	22%	0.221	S	C	*	.			trans	-87.6	-29.1	-174.6	-65.8	-177.9	-177.3	-176.2	0	114.4	G43 P47 C72	G43-K45 PolarHBondContact O-N 3.36Å; K45-P47 WeakPolarHBondContact O-CD 3.36Å; K45-C72 WeakPolarHBondContact O-CB 3.45Å
46	D	86.8	Confident	85.1	Confident	64 Å²	64	41.2 Å²	41.2	34%	0.342	23%	0.227	S	C	.	.			trans	-80.5	122.5	-177.2	179.2	-98.4	0	0	0	111.6	N48 N49 M50	D46-N48 VanDerWaalsContact C-N 3.3Å; D46-N48 PolarHBondContact O-N 3.46Å; D46-N48 WeakPolarHBondContact OD1-CA 3.46Å; D46-N48 VanDerWaalsContact OD1-CB 3.3Å; D46-N48 WeakPolarHBondContact OD1-CB 3.37Å; D46-N48 PolarHBondContact OD1-N 3.01Å; D46-N49 HydrophobicContact CB-CB 4.1Å; D46-N49 PolarHBondContact O-N 2.87Å; D46-N49 PolarHBondContact OD1-N 3.33Å; D46-M50 PolarHBondContact O-N 3.26Å
47	P	88.7	Confident	85.5	Confident	25 Å²	25	37.1 Å²	37.1	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-31.9	-178.9	-24.8	34.9	0	0	0	114.3	K45 G51 K78 V79	K45-P47 WeakPolarHBondContact O-CD 3.36Å; P47-G51 PolarHBondContact O-N 2.91Å; P47-K78 HydrophobicContact CB-CB 3.66Å; P47-K78 HydrophobicContact CB-CD 4.45Å; P47-K78 HydrophobicContact CG-CB 4.38Å; P47-K78 HydrophobicContact CG-CD 4.39Å; P47-V79 HydrophobicContact CB-CG2 3.73Å
48	N	83.5	Confident	85.8	Confident	78 Å²	78	35.7 Å²	35.7	42%	0.417	20%	0.195	S	C	.	.	H	α-helix	trans	-73.9	-38.6	-179.3	-61.8	-46.6	0	0	0	110.9	D46 G51 S52	D46-N48 VanDerWaalsContact C-N 3.3Å; D46-N48 PolarHBondContact O-N 3.46Å; D46-N48 WeakPolarHBondContact OD1-CA 3.46Å; D46-N48 VanDerWaalsContact OD1-CB 3.3Å; D46-N48 WeakPolarHBondContact OD1-CB 3.37Å; D46-N48 PolarHBondContact OD1-N 3.01Å; N48-G51 PolarHBondContact O-N 3.45Å; N48-S52 VanDerWaalsContact O-CB 3.27Å; N48-S52 WeakPolarHBondContact O-CB 3.36Å; N48-S52 PolarHBondContact O-N 3.46Å; N48-S52 PolarHBondContact O-OG 3.24Å
49	N	85.6	Confident	85.7	Confident	48 Å²	48	34.8 Å²	34.8	26%	0.257	19%	0.191	S	C	.	.	H	α-helix	trans	-63.7	-44.8	172.7	-73.1	-21.5	0	0	0	111	I44 D46 G51 S52 L53	I44-N49 HydrophobicContact CG2-CB 4.48Å; D46-N49 HydrophobicContact CB-CB 4.1Å; D46-N49 PolarHBondContact O-N 2.87Å; D46-N49 PolarHBondContact OD1-N 3.33Å; N49-G51 PolarHBondContact O-N 2.89Å; N49-S52 PolarHBondContact O-N 2.91Å; N49-L53 VanDerWaalsContact O-CB 3.28Å; N49-L53 WeakPolarHBondContact O-CB 3.48Å; N49-L53 PolarHBondContact O-N 3.31Å
50	M	89.6	Confident	85.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-48.8	176.1	-174.4	64.8	86.4	0	0	111.4	I44 D46 L53 I54 M65 T67 C71 C72 V79	I44-M50 HydrophobicContact CB-CE 3.72Å; I44-M50 HydrophobicContact CB-SD 4.48Å; I44-M50 HydrophobicContact CG2-CB 4.05Å; I44-M50 HydrophobicContact CG2-CE 3.85Å; I44-M50 HydrophobicContact CG2-SD 4.17Å; D46-M50 PolarHBondContact O-N 3.26Å; M50-L53 WeakPolarHBondContact O-CB 3.47Å; M50-L53 PolarHBondContact O-N 2.81Å; M50-I54 HydrophobicContact CG-CD1 4.1Å; M50-I54 WeakPolarHBondContact O-CG1 3.44Å; M50-I54 PolarHBondContact O-N 2.88Å; M50-M65 HydrophobicContact SD-CE 3.2Å; M50-M65 WeakPolarHBondContact SD-CE 3.33Å; M50-T67 HydrophobicContact CE-CG2 4.05Å; M50-T67 HydrophobicContact SD-CG2 4.27Å; M50-C71 HydrophobicContact CE-CB 3.67Å; M50-C72 VanDerWaalsContact CB-SG 3.58Å; M50-C72 WeakPolarHBondContact CE-O 3.36Å; M50-V79 HydrophobicContact CB-CG1 4.06Å; M50-V79 HydrophobicContact CB-CG2 4.06Å; M50-V79 HydrophobicContact CG-CG1 3.7Å; M50-V79 HydrophobicContact CG-CG2 4.14Å
51	G	89.6	Confident	85.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-41.8	179.4	0	0	0	0	0	112.4	P47 N48 N49 L53 I54 R55 G83	P47-G51 PolarHBondContact O-N 2.91Å; N48-G51 PolarHBondContact O-N 3.45Å; N49-G51 PolarHBondContact O-N 2.89Å; G51-L53 VanDerWaalsContact C-N 3.27Å; G51-L53 PolarHBondContact O-N 2.87Å; G51-I54 PolarHBondContact O-N 3.4Å; G51-R55 PolarHBondContact O-N 2.69Å; G51-G83 VanDerWaalsContact O-CA 3.22Å; G51-G83 WeakPolarHBondContact O-CA 3.4Å
52	S	84.7	Confident	85.1	Confident	27 Å²	27	32.1 Å²	32.1	19%	0.189	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-37.3	176.5	-60.8	0	0	0	0	112	N48 N49 S56	N48-S52 VanDerWaalsContact O-CB 3.27Å; N48-S52 WeakPolarHBondContact O-CB 3.36Å; N48-S52 PolarHBondContact O-N 3.46Å; N48-S52 PolarHBondContact O-OG 3.24Å; N49-S52 PolarHBondContact O-N 2.91Å; S52-S56 WeakPolarHBondContact O-CB 3.42Å; S52-S56 PolarHBondContact O-N 2.88Å; S52-S56 PolarHBondContact O-OG 3.16Å
53	L	88.2	Confident	85.1	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-64.7	-53.1	174.6	-175.5	63.9	0	0	0	110.7	C41 N49 M50 G51 R55 S56 L57 M65 A146	C41-L53 WeakPolarHBondContact SG-CD2 3.48Å; N49-L53 VanDerWaalsContact O-CB 3.28Å; N49-L53 WeakPolarHBondContact O-CB 3.48Å; N49-L53 PolarHBondContact O-N 3.31Å; M50-L53 WeakPolarHBondContact O-CB 3.47Å; M50-L53 PolarHBondContact O-N 2.81Å; G51-L53 VanDerWaalsContact C-N 3.27Å; G51-L53 PolarHBondContact O-N 2.87Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 3.18Å; L53-S56 PolarHBondContact O-N 3.21Å; L53-L57 HydrophobicContact CD1-CD1 4.03Å; L53-L57 HydrophobicContact CD1-CD2 4.25Å; L53-L57 HydrophobicContact CD1-CG 3.99Å; L53-L57 HydrophobicContact CG-CD1 3.84Å; L53-L57 HydrophobicContact CG-CG 4.17Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 2.86Å; L53-M65 HydrophobicContact CD2-CE 3.92Å; L53-M65 HydrophobicContact CG-CE 4.35Å; L53-A146 HydrophobicContact CD1-CB 3.26Å
54	I	89.4	Confident	85.4	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-51.6	-47.5	177.3	-70.5	165.4	0	0	0	111.2	M50 G51 S56 L57 A58 M65 P74 V79 H87 L90 I92	M50-I54 HydrophobicContact CG-CD1 4.1Å; M50-I54 WeakPolarHBondContact O-CG1 3.44Å; M50-I54 PolarHBondContact O-N 2.88Å; G51-I54 PolarHBondContact O-N 3.4Å; I54-S56 PolarHBondContact O-N 2.78Å; I54-L57 PolarHBondContact O-N 3.01Å; I54-A58 VanDerWaalsContact O-CB 3.24Å; I54-A58 WeakPolarHBondContact O-CB 3.37Å; I54-A58 PolarHBondContact O-N 3.29Å; I54-M65 HydrophobicContact CD1-CE 4.39Å; I54-M65 HydrophobicContact CD1-SD 4.44Å; I54-M65 HydrophobicContact CG1-CE 3.78Å; I54-M65 HydrophobicContact CG1-SD 3.47Å; I54-M65 WeakPolarHBondContact CG1-SD 3.48Å; I54-P74 HydrophobicContact CD1-CB 4Å; I54-V79 HydrophobicContact CD1-CG1 3.73Å; I54-H87 WeakPolarHBondContact CD1-NE2 3.36Å; I54-L90 HydrophobicContact CG2-CD2 4.33Å; I54-I92 HydrophobicContact CD1-CD1 3.84Å; I54-I92 HydrophobicContact CG1-CD1 4.01Å; I54-I92 HydrophobicContact CG2-CD1 4.03Å
55	R	84.7	Confident	85.5	Confident	62 Å²	62	32.7 Å²	32.7	23%	0.234	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-42.3	178.6	-173.7	171.3	65.3	-160.9	1.5	112.5	G51 L53 S59 A82 S84 H441	G51-R55 PolarHBondContact O-N 2.69Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 3.18Å; R55-S59 WeakPolarHBondContact O-CB 3.41Å; R55-S59 PolarHBondContact O-N 3.38Å; R55-S59 PolarHBondContact O-OG 2.92Å; R55-A82 PolarHBondContact NH1-O 3.41Å; R55-S84 PolarHBondContact NH1-OG 3.29Å; R55-H441 PolarHBondContact NH1-CE1 2.8Å; R55-H441 VanDerWaalsContact NH1-CE1 3.31Å
56	S	84.5	Confident	85.7	Confident	24 Å²	24	24.9 Å²	24.9	17%	0.168	13%	0.13	C	C	.	.	H	α-helix	trans	-69.6	-43.1	-178.5	-57	0	0	0	0	111.7	S52 L53 I54 S59 A60	S52-S56 WeakPolarHBondContact O-CB 3.42Å; S52-S56 PolarHBondContact O-N 2.88Å; S52-S56 PolarHBondContact O-OG 3.16Å; L53-S56 PolarHBondContact O-N 3.21Å; I54-S56 PolarHBondContact O-N 2.78Å; S56-S59 PolarHBondContact O-N 3.34Å; S56-A60 WeakPolarHBondContact O-CB 3.29Å; S56-A60 PolarHBondContact O-N 3.43Å
57	L	86.4	Confident	85.9	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67	-42.3	178	-63.4	-177.9	0	0	0	111.9	V39 L53 I54 S59 A60 G61 C62 M65 L90 A150	V39-L57 HydrophobicContact CB-CD1 3.65Å; V39-L57 HydrophobicContact CB-CD2 4.32Å; V39-L57 HydrophobicContact CG1-CD1 3.88Å; V39-L57 HydrophobicContact CG2-CD1 3.83Å; V39-L57 HydrophobicContact CG2-CD2 3.58Å; V39-L57 HydrophobicContact CG2-CG 4.32Å; L53-L57 HydrophobicContact CD1-CD1 4.03Å; L53-L57 HydrophobicContact CD1-CD2 4.25Å; L53-L57 HydrophobicContact CD1-CG 3.99Å; L53-L57 HydrophobicContact CG-CD1 3.84Å; L53-L57 HydrophobicContact CG-CG 4.17Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.32Å; L53-L57 PolarHBondContact O-N 2.86Å; I54-L57 PolarHBondContact O-N 3.01Å; L57-S59 VanDerWaalsContact C-N 3.3Å; L57-S59 PolarHBondContact O-N 3.48Å; L57-A60 PolarHBondContact O-N 2.94Å; L57-G61 PolarHBondContact O-N 3.31Å; L57-G61 VanDerWaalsContact O-N 3.15Å; L57-C62 HydrophobicContact CB-CB 4.13Å; L57-C62 WeakPolarHBondContact O-CB 3.28Å; L57-C62 PolarHBondContact O-N 2.94Å; L57-C62 PolarHBondContact O-SG 2.92Å; L57-M65 HydrophobicContact CD1-CB 4.33Å; L57-M65 HydrophobicContact CD1-CG 4.23Å; L57-M65 HydrophobicContact CD1-SD 3.9Å; L57-L90 HydrophobicContact CB-CD1 4.36Å; L57-L90 HydrophobicContact CB-CD2 3.67Å; L57-L90 HydrophobicContact CD1-CD2 4.24Å; L57-A150 HydrophobicContact CD2-CB 4.08Å
58	A	84.5	Confident	85.9	Confident	6 Å²	6	21.1 Å²	21.1	5%	0.05	11%	0.108	C	C	.	.	H	α-helix	trans	-58.6	-44.3	172.1	0	0	0	0	0	111.1	I54 A60 G61 L90 A469	I54-A58 VanDerWaalsContact O-CB 3.24Å; I54-A58 WeakPolarHBondContact O-CB 3.37Å; I54-A58 PolarHBondContact O-N 3.29Å; A58-A60 PolarHBondContact O-N 3.34Å; A58-G61 PolarHBondContact O-N 3.11Å; A58-L90 HydrophobicContact CB-CB 4.05Å; A58-A469 HydrophobicContact CB-CB 4.09Å; A58-A469 VanDerWaalsContact O-CB 3.25Å; A58-A469 WeakPolarHBondContact O-CB 3.16Å
59	S	80.6	Confident	86	Confident	17 Å²	17	19.6 Å²	19.6	12%	0.119	11%	0.107	C	C	.	.	H	α-helix	trans	-66.3	-34.1	178.5	-59.1	0	0	0	0	113.5	R55 S56 L57 G61	R55-S59 WeakPolarHBondContact O-CB 3.41Å; R55-S59 PolarHBondContact O-N 3.38Å; R55-S59 PolarHBondContact O-OG 2.92Å; S56-S59 PolarHBondContact O-N 3.34Å; L57-S59 VanDerWaalsContact C-N 3.3Å; L57-S59 PolarHBondContact O-N 3.48Å; S59-G61 PolarHBondContact O-N 3.22Å
60	A	79.2	Confident	85.9	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-74.9	-9.1	173.4	0	0	0	0	0	112.7	S56 L57 A58 A150 F151 R154	S56-A60 WeakPolarHBondContact O-CB 3.29Å; S56-A60 PolarHBondContact O-N 3.43Å; L57-A60 PolarHBondContact O-N 2.94Å; A58-A60 PolarHBondContact O-N 3.34Å; A60-A150 HydrophobicContact CB-CB 3.79Å; A60-F151 HydrophobicContact CB-CD2 4.47Å; A60-F151 HydrophobicContact CB-CE2 4.37Å; A60-F151 HydrophobicContact CB-CZ 4.45Å; A60-R154 VanDerWaalsContact O-CD 3.32Å; A60-R154 WeakPolarHBondContact O-CD 3.41Å; A60-R154 PolarHBondContact O-NH1 2.92Å
61	G	80.7	Confident	85.9	Confident	14 Å²	14	20.3 Å²	20.3	14%	0.144	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	36.9	-175.9	0	0	0	0	0	112.5	T34 I35 L57 A58 S59	T34-G61 CarbonylContact C-O 3.49Å; T34-G61 VanDerWaalsContact CA-O 3.26Å; T34-G61 WeakPolarHBondContact CA-O 3.41Å; T34-G61 VanDerWaalsContact CG2-O 3.32Å; T34-G61 WeakPolarHBondContact CG2-O 3.33Å; I35-G61 VanDerWaalsContact CG1-O 3.31Å; I35-G61 WeakPolarHBondContact CG1-O 3.44Å; I35-G61 PolarHBondContact N-O 3.08Å; L57-G61 PolarHBondContact O-N 3.31Å; L57-G61 VanDerWaalsContact O-N 3.15Å; A58-G61 PolarHBondContact O-N 3.11Å; S59-G61 PolarHBondContact O-N 3.22Å
62	C	82.9	Confident	86	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.014	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	147.4	176.1	-64.2	0	0	0	0	111.5	L57 L90	L57-C62 HydrophobicContact CB-CB 4.13Å; L57-C62 WeakPolarHBondContact O-CB 3.28Å; L57-C62 PolarHBondContact O-N 2.94Å; L57-C62 PolarHBondContact O-SG 2.92Å; C62-L90 HydrophobicContact CB-CD1 4.02Å; C62-L90 WeakPolarHBondContact O-CD1 3.16Å
63	R	84.1	Confident	86.4	Confident	139 Å²	139	22.8 Å²	22.8	53%	0.525	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	-39.2	-177.9	-177.5	164.8	-179.4	109.3	-2.9	113.2	Q30 T34 I35 L37 I38 P91	Q30-R63 PolarHBondContact NE2-O 3.36Å; T34-R63 HydrophobicContact CG2-CB 4.17Å; I35-R63 PolarHBondContact O-N 3.33Å; L37-R63 PolarHBondContact O-N 3.37Å; I38-R63 HydrophobicContact CG1-CB 4.23Å; I38-R63 HydrophobicContact CG1-CG 4.48Å; R63-P91 WeakPolarHBondContact O-CD 3.4Å
64	A	87.5	Confident	86.6	Confident	7 Å²	7	22.4 Å²	22.4	6%	0.058	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	164.7	177.1	0	0	0	0	0	111.6	I38 V39 P91 Y93	I38-A64 WeakPolarHBondContact CA-O 3.43Å; I38-A64 HydrophobicContact CG1-CB 4.15Å; I38-A64 HydrophobicContact CG2-CB 4.11Å; V39-A64 PolarHBondContact N-O 2.8Å; A64-P91 CarbonylContact C-O 3.58Å; A64-P91 WeakPolarHBondContact CA-O 3.42Å; A64-P91 HydrophobicContact CB-CB 4.4Å; A64-Y93 HydrophobicContact CB-CD2 4.42Å; A64-Y93 HydrophobicContact CB-CE2 4.17Å
65	M	89.2	Confident	86.7	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.1	168.2	178.3	175.2	172.2	0	0	109.1	V39 C41 M50 L53 I54 L57 T67 L90 P91 I92 Y93	V39-M65 CarbonylContact O-C 3.55Å; V39-M65 VanDerWaalsContact O-CA 3.29Å; V39-M65 WeakPolarHBondContact O-CA 3.46Å; C41-M65 HydrophobicContact CB-CE 4.47Å; C41-M65 WeakPolarHBondContact SG-CE 3.42Å; M50-M65 HydrophobicContact SD-CE 3.2Å; M50-M65 WeakPolarHBondContact SD-CE 3.33Å; L53-M65 HydrophobicContact CD2-CE 3.92Å; L53-M65 HydrophobicContact CG-CE 4.35Å; I54-M65 HydrophobicContact CD1-CE 4.39Å; I54-M65 HydrophobicContact CD1-SD 4.44Å; I54-M65 HydrophobicContact CG1-CE 3.78Å; I54-M65 HydrophobicContact CG1-SD 3.47Å; I54-M65 WeakPolarHBondContact CG1-SD 3.48Å; L57-M65 HydrophobicContact CD1-CB 4.33Å; L57-M65 HydrophobicContact CD1-CG 4.23Å; L57-M65 HydrophobicContact CD1-SD 3.9Å; M65-T67 HydrophobicContact CE-CG2 3.88Å; M65-T67 HydrophobicContact CG-CG2 4.4Å; M65-L90 HydrophobicContact CB-CD1 4.48Å; M65-L90 HydrophobicContact CB-CD2 3.8Å; M65-L90 HydrophobicContact CB-CG 4.13Å; M65-L90 HydrophobicContact SD-CD2 3.98Å; M65-P91 PolarHBondContact N-O 3.08Å; M65-I92 HydrophobicContact CB-CG1 4.23Å; M65-I92 CarbonylContact O-C 3.53Å; M65-I92 VanDerWaalsContact O-CA 3.32Å; M65-I92 WeakPolarHBondContact O-CA 3.31Å; M65-I92 HydrophobicContact SD-CG1 4.44Å; M65-Y93 PolarHBondContact O-N 3.33Å
66	L	89.2	Confident	87	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.2	177	-51.9	-172.9	0	0	0	107.6	I38 V39 V40 C41 Y93 L96 I101 L105	I38-L66 HydrophobicContact CG2-CD1 3.97Å; I38-L66 HydrophobicContact CG2-CD2 4.36Å; I38-L66 HydrophobicContact CG2-CG 3.75Å; V39-L66 PolarHBondContact O-N 3Å; V40-L66 CarbonylContact C-O 3.49Å; V40-L66 WeakPolarHBondContact CA-O 3.22Å; V40-L66 HydrophobicContact CG1-CB 4.42Å; V40-L66 HydrophobicContact CG2-CB 4.25Å; V40-L66 HydrophobicContact CG2-CD1 4.08Å; V40-L66 HydrophobicContact CG2-CG 4.43Å; C41-L66 PolarHBondContact N-O 3.12Å; L66-Y93 CarbonylContact C-O 3.51Å; L66-Y93 WeakPolarHBondContact CA-O 3.5Å; L66-Y93 HydrophobicContact CD2-CD2 3.42Å; L66-Y93 VanDerWaalsContact CD2-CD2 3.42Å; L66-Y93 HydrophobicContact CD2-CE2 4.3Å; L66-Y93 HydrophobicContact CD2-CG 3.69Å; L66-L96 HydrophobicContact CB-CD1 4.01Å; L66-L96 HydrophobicContact CD1-CD1 4.34Å; L66-L96 HydrophobicContact CD2-CD1 4.12Å; L66-L96 HydrophobicContact CG-CD1 4.37Å; L66-I101 HydrophobicContact CD1-CG2 4.18Å; L66-L105 HydrophobicContact CD1-CD2 3.92Å; L66-L105 HydrophobicContact CD1-CG 4.3Å
67	T	90.3	Very high	87.1	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.7	174.3	71.6	0	0	0	0	110.1	C41 M50 M65 Y93 E94 H95 L96	C41-T67 HydrophobicContact CB-CG2 4.17Å; M50-T67 HydrophobicContact CE-CG2 4.05Å; M50-T67 HydrophobicContact SD-CG2 4.27Å; M65-T67 HydrophobicContact CE-CG2 3.88Å; M65-T67 HydrophobicContact CG-CG2 4.4Å; T67-Y93 PolarHBondContact N-O 2.89Å; T67-E94 CarbonylContact O-C 3.48Å; T67-E94 VanDerWaalsContact OG1-CA 3.23Å; T67-E94 WeakPolarHBondContact OG1-CA 3.3Å; T67-H95 PolarHBondContact O-N 3.07Å; T67-L96 PolarHBondContact O-N 2.92Å
68	L	88.8	Confident	87.2	Confident	9 Å²	9	34.8 Å²	34.8	5%	0.047	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	154.2	176.4	-77.7	175.2	0	0	0	111.6	V40 C41 D42 G70 C71 L96 L98 I101	V40-L68 HydrophobicContact CG1-CD1 4.28Å; V40-L68 HydrophobicContact CG1-CG 4.25Å; C41-L68 WeakPolarHBondContact O-CB 3.4Å; C41-L68 PolarHBondContact O-N 3Å; D42-L68 HydrophobicContact CB-CD1 3.86Å; L68-G70 PolarHBondContact O-N 2.74Å; L68-C71 WeakPolarHBondContact O-CB 3.41Å; L68-C71 PolarHBondContact O-N 2.75Å; L68-L96 CarbonylContact C-O 3.59Å; L68-L96 VanDerWaalsContact CA-O 3.27Å; L68-L96 WeakPolarHBondContact CA-O 3.29Å; L68-L96 HydrophobicContact CD2-CB 4.39Å; L68-L96 WeakPolarHBondContact CD2-O 3.12Å; L68-L98 HydrophobicContact CD1-CD1 3.89Å; L68-L98 HydrophobicContact CD1-CG 4.37Å; L68-L98 HydrophobicContact CD2-CB 4.31Å; L68-I101 HydrophobicContact CD1-CD1 4.19Å; L68-I101 HydrophobicContact CD2-CD1 3.43Å; L68-I101 VanDerWaalsContact CD2-CD1 3.43Å; L68-I101 HydrophobicContact CD2-CG1 4.06Å; L68-I101 HydrophobicContact CG-CD1 3.96Å
69	A	85.8	Confident	87.5	Confident	46 Å²	46	34.5 Å²	34.5	38%	0.38	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	120.4	166.8	0	0	0	0	0	109.6	L96	A69-L96 PolarHBondContact N-O 3.25Å
70	G	84.9	Confident	87.9	Confident	51 Å²	51	36.8 Å²	36.8	53%	0.526	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	113.3	-13.3	-173.5	0	0	0	0	0	114.6	L68	L68-G70 PolarHBondContact O-N 2.74Å
71	C	88.8	Confident	88.1	Confident	13 Å²	13	45.5 Å²	45.5	9%	0.088	24%	0.237	C	C	.	.	S	Bend	trans	-72.5	155.9	163.6	-71.8	0	0	0	0	111.7	C41 G43 I44 M50 L68	C41-C71 PolarHBondContact O-SG 2.88Å; G43-C71 PolarHBondContact N-SG 2.81Å; I44-C71 PolarHBondContact N-SG 3.48Å; I44-C71 VanDerWaalsContact N-SG 3.36Å; I44-C71 WeakPolarHBondContact O-CA 3.25Å; M50-C71 HydrophobicContact CE-CB 3.67Å; L68-C71 WeakPolarHBondContact O-CB 3.41Å; L68-C71 PolarHBondContact O-N 2.75Å
72	C	91.1	Very high	88.1	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.135	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.8	151.3	165.9	69.4	0	0	0	0	110.8	I44 K45 M50 P74	I44-C72 PolarHBondContact O-N 3.24Å; I44-C72 PolarHBondContact O-SG 2.93Å; I44-C72 VanDerWaalsContact O-SG 3.34Å; K45-C72 WeakPolarHBondContact O-CB 3.45Å; M50-C72 VanDerWaalsContact CB-SG 3.58Å; M50-C72 WeakPolarHBondContact CE-O 3.36Å; C72-P74 WeakPolarHBondContact O-CD 3.35Å
73	D	92.7	Very high	88.3	Confident	59 Å²	59	45.4 Å²	45.4	32%	0.316	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-59.8	121	178.5	172.2	11.8	0	0	0	110.1	W75 Q76 V79	D73-W75 PolarHBondContact O-N 2.81Å; D73-W75 PolarHBondContact OD1-N 2.85Å; D73-Q76 HydrophobicContact CB-CB 4.29Å; D73-Q76 VanDerWaalsContact O-CG 3.28Å; D73-Q76 WeakPolarHBondContact O-CG 3.32Å; D73-Q76 PolarHBondContact O-N 3.16Å; D73-Q76 PolarHBondContact O-NE2 3.22Å; D73-Q76 PolarHBondContact OD2-N 3.2Å; D73-V79 WeakPolarHBondContact O-CG2 3.01Å
74	P	92.6	Very high	88.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.2	179	24.5	-30.1	0	0	0	113.4	I54 C72 V79 H87 I92 E94	I54-P74 HydrophobicContact CD1-CB 4Å; C72-P74 WeakPolarHBondContact O-CD 3.35Å; P74-V79 WeakPolarHBondContact O-CB 3.23Å; P74-V79 WeakPolarHBondContact O-CG1 3.49Å; P74-H87 PolarHBondContact O-CD2 3.3Å; P74-H87 PolarHBondContact O-NE2 2.87Å; P74-I92 HydrophobicContact CB-CG2 3.97Å; P74-I92 HydrophobicContact CG-CG2 3.74Å; P74-E94 HydrophobicContact CG-CB 3.92Å
75	W	91.6	Very high	88	Confident	34 Å²	34	41.5 Å²	41.5	13%	0.129	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	2	-178.1	-62	87.8	0	0	0	114.3	K20 P21 I26 D73 L80 H87 I92 E94	K20-W75 HydrophobicContact CD-CD2 3.95Å; K20-W75 HydrophobicContact CD-CE3 4.45Å; K20-W75 HydrophobicContact CD-CG 4.09Å; K20-W75 VanDerWaalsContact CE-CE2 3.48Å; K20-W75 VanDerWaalsContact CE-NE1 3.32Å; K20-W75 HydrophobicContact CG-CD2 4.09Å; K20-W75 HydrophobicContact CG-CE3 4.13Å; K20-W75 HydrophobicContact CG-CH2 4.35Å; K20-W75 HydrophobicContact CG-CZ2 4.29Å; K20-W75 HydrophobicContact CG-CZ3 4.27Å; P21-W75 HydrophobicContact CG-CH2 3.66Å; P21-W75 HydrophobicContact CG-CZ3 4.05Å; I26-W75 HydrophobicContact CD1-CH2 4.38Å; I26-W75 HydrophobicContact CD1-CZ2 4.45Å; D73-W75 PolarHBondContact O-N 2.81Å; D73-W75 PolarHBondContact OD1-N 2.85Å; W75-L80 HydrophobicContact CE3-CD2 3.84Å; W75-L80 HydrophobicContact CZ3-CD2 4.28Å; W75-L80 WeakPolarHBondContact O-CD1 3.46Å; W75-L80 WeakPolarHBondContact O-CG 3.01Å; W75-H87 HydrophobicContact CH2-CB 3.74Å; W75-H87 HydrophobicContact CZ2-CB 4.43Å; W75-H87 HydrophobicContact CZ3-CB 3.86Å; W75-I92 HydrophobicContact CZ2-CD1 4.47Å; W75-E94 PolarHBondContact NE1-OE2 2.81Å
76	Q	90.9	Very high	87.7	Confident	65 Å²	65	41.6 Å²	41.6	30%	0.304	23%	0.232	S	C	.	.	S	Bend	trans	-66.2	154	174	75.5	-174.4	-33.9	0	0	111.3	D73 K78 V79 L80	D73-Q76 HydrophobicContact CB-CB 4.29Å; D73-Q76 VanDerWaalsContact O-CG 3.28Å; D73-Q76 WeakPolarHBondContact O-CG 3.32Å; D73-Q76 PolarHBondContact O-N 3.16Å; D73-Q76 PolarHBondContact O-NE2 3.22Å; D73-Q76 PolarHBondContact OD2-N 3.2Å; Q76-K78 VanDerWaalsContact C-N 3.29Å; Q76-K78 PolarHBondContact O-N 2.8Å; Q76-K78 VanDerWaalsContact O-N 3.09Å; Q76-V79 HydrophobicContact CG-CB 4.15Å; Q76-V79 HydrophobicContact CG-CG2 3.6Å; Q76-V79 PolarHBondContact O-N 2.94Å; Q76-L80 PolarHBondContact O-N 3.49Å
77	V	87.4	Confident	87.6	Confident	121 Å²	121	41.6 Å²	41.6	73%	0.733	23%	0.232	S	C	*	.	H	α-helix	trans	-51.9	-42.2	-171.4	-179.6	0	0	0	0	113.7	R81	V77-R81 WeakPolarHBondContact O-CB 3.35Å; V77-R81 PolarHBondContact O-N 3.03Å; V77-R81 VanDerWaalsContact O-N 3.09Å
78	K	87.9	Confident	87.4	Confident	126 Å²	126	46.4 Å²	46.4	55%	0.548	25%	0.253	S	S	.	.	H	α-helix	trans	-66.1	-39.3	-179.8	-71.4	-177	-179.4	176.6	0	112.2	P47 Q76 A82	P47-K78 HydrophobicContact CB-CB 3.66Å; P47-K78 HydrophobicContact CB-CD 4.45Å; P47-K78 HydrophobicContact CG-CB 4.38Å; P47-K78 HydrophobicContact CG-CD 4.39Å; Q76-K78 VanDerWaalsContact C-N 3.29Å; Q76-K78 PolarHBondContact O-N 2.8Å; Q76-K78 VanDerWaalsContact O-N 3.09Å; K78-A82 WeakPolarHBondContact O-CB 3.24Å; K78-A82 PolarHBondContact O-N 2.57Å; K78-A82 VanDerWaalsContact O-N 3.07Å
79	V	91.8	Very high	86.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.6	-45.5	178.5	-176.3	0	0	0	0	110.1	P47 M50 I54 D73 P74 Q76 R81 A82 G83 H87	P47-V79 HydrophobicContact CB-CG2 3.73Å; M50-V79 HydrophobicContact CB-CG1 4.06Å; M50-V79 HydrophobicContact CB-CG2 4.06Å; M50-V79 HydrophobicContact CG-CG1 3.7Å; M50-V79 HydrophobicContact CG-CG2 4.14Å; I54-V79 HydrophobicContact CD1-CG1 3.73Å; D73-V79 WeakPolarHBondContact O-CG2 3.01Å; P74-V79 WeakPolarHBondContact O-CB 3.23Å; P74-V79 WeakPolarHBondContact O-CG1 3.49Å; Q76-V79 HydrophobicContact CG-CB 4.15Å; Q76-V79 HydrophobicContact CG-CG2 3.6Å; Q76-V79 PolarHBondContact O-N 2.94Å; V79-R81 VanDerWaalsContact C-N 3.28Å; V79-R81 PolarHBondContact O-N 2.78Å; V79-A82 CarbonylContact O-C 3.58Å; V79-A82 PolarHBondContact O-N 2.81Å; V79-A82 VanDerWaalsContact O-N 3.11Å; V79-G83 PolarHBondContact O-N 3.45Å; V79-H87 PolarHBondContact O-CE1 3.39Å
80	L	88.2	Confident	86.9	Confident	65 Å²	65	47.9 Å²	47.9	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-53.4	-46.8	175.8	-74.2	176.4	0	0	0	112.1	W75 Q76 G83 S84	W75-L80 HydrophobicContact CE3-CD2 3.84Å; W75-L80 HydrophobicContact CZ3-CD2 4.28Å; W75-L80 WeakPolarHBondContact O-CD1 3.46Å; W75-L80 WeakPolarHBondContact O-CG 3.01Å; Q76-L80 PolarHBondContact O-N 3.49Å; L80-G83 PolarHBondContact O-N 3.01Å; L80-S84 PolarHBondContact O-N 2.96Å; L80-S84 VanDerWaalsContact O-N 3.16Å
81	R	82.9	Confident	87	Confident	182 Å²	182	45.6 Å²	45.6	69%	0.687	22%	0.224	S	C	*	.	H	α-helix	trans	-61.2	-49.2	176.7	-172.5	179.1	66.2	165.4	3.1	111.6	V77 V79 S84	V77-R81 WeakPolarHBondContact O-CB 3.35Å; V77-R81 PolarHBondContact O-N 3.03Å; V77-R81 VanDerWaalsContact O-N 3.09Å; V79-R81 VanDerWaalsContact C-N 3.28Å; V79-R81 PolarHBondContact O-N 2.78Å; R81-S84 PolarHBondContact O-N 2.73Å; R81-S84 PolarHBondContact O-OG 2.84Å
82	A	82.5	Confident	87.1	Confident	14 Å²	14	45.2 Å²	45.2	12%	0.116	22%	0.221	C	C	.	.	H	α-helix	trans	-66.7	-36.9	-179.2	0	0	0	0	0	112.9	R55 K78 V79 S84	R55-A82 PolarHBondContact NH1-O 3.41Å; K78-A82 WeakPolarHBondContact O-CB 3.24Å; K78-A82 PolarHBondContact O-N 2.57Å; K78-A82 VanDerWaalsContact O-N 3.07Å; V79-A82 CarbonylContact O-C 3.58Å; V79-A82 PolarHBondContact O-N 2.81Å; V79-A82 VanDerWaalsContact O-N 3.11Å; A82-S84 VanDerWaalsContact C-N 3.26Å; A82-S84 PolarHBondContact O-N 2.85Å; A82-S84 PolarHBondContact O-OG 3.49Å
83	G	85.4	Confident	87	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-72.8	-16.2	177.8	0	0	0	0	0	114.1	G51 V79 L80 G85 G86	G51-G83 VanDerWaalsContact O-CA 3.22Å; G51-G83 WeakPolarHBondContact O-CA 3.4Å; V79-G83 PolarHBondContact O-N 3.45Å; L80-G83 PolarHBondContact O-N 3.01Å; G83-G85 VanDerWaalsContact C-N 3.27Å; G83-G85 PolarHBondContact O-N 3.29Å; G83-G85 VanDerWaalsContact O-N 3.14Å; G83-G86 PolarHBondContact O-N 2.8Å
84	S	84.7	Confident	86.9	Confident	51 Å²	51	47 Å²	47	36%	0.357	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	46.5	169.6	-50.9	0	0	0	0	113	R55 L80 R81 A82 N471	R55-S84 PolarHBondContact NH1-OG 3.29Å; L80-S84 PolarHBondContact O-N 2.96Å; L80-S84 VanDerWaalsContact O-N 3.16Å; R81-S84 PolarHBondContact O-N 2.73Å; R81-S84 PolarHBondContact O-OG 2.84Å; A82-S84 VanDerWaalsContact C-N 3.26Å; A82-S84 PolarHBondContact O-N 2.85Å; A82-S84 PolarHBondContact O-OG 3.49Å; S84-N471 PolarHBondContact O-ND2 2.81Å
85	G	81.9	Confident	86.6	Confident	14 Å²	14	51.6 Å²	51.6	14%	0.144	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-8.2	-179.8	0	0	0	0	0	116.3	G83 H87 F88 Y89	G83-G85 VanDerWaalsContact C-N 3.27Å; G83-G85 PolarHBondContact O-N 3.29Å; G83-G85 VanDerWaalsContact O-N 3.14Å; G85-H87 PolarHBondContact O-N 2.96Å; G85-F88 WeakPolarHBondContact O-CD2 3.49Å; G85-F88 PolarHBondContact O-N 3.3Å; G85-Y89 WeakPolarHBondContact O-CD2 3.36Å
86	G	82.6	Confident	86.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.01	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-55.8	-27.6	177.9	0	0	0	0	0	114.3	G83 F88 Y89 L90	G83-G86 PolarHBondContact O-N 2.8Å; G86-F88 PolarHBondContact O-N 3.13Å; G86-F88 VanDerWaalsContact O-N 3.13Å; G86-Y89 PolarHBondContact O-N 3.02Å; G86-L90 PolarHBondContact O-N 3.35Å
87	H	87.7	Confident	86.1	Confident	1 Å²	1	53 Å²	53	1%	0.005	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-56	-25.4	174.5	-57.7	79.1	0	0	0	114	I54 P74 W75 V79 G85 Y89 I92	I54-H87 WeakPolarHBondContact CD1-NE2 3.36Å; P74-H87 PolarHBondContact O-CD2 3.3Å; P74-H87 PolarHBondContact O-NE2 2.87Å; W75-H87 HydrophobicContact CH2-CB 3.74Å; W75-H87 HydrophobicContact CZ2-CB 4.43Å; W75-H87 HydrophobicContact CZ3-CB 3.86Å; V79-H87 PolarHBondContact O-CE1 3.39Å; G85-H87 PolarHBondContact O-N 2.96Å; H87-Y89 VanDerWaalsContact C-N 3.35Å; H87-I92 HydrophobicContact CB-CD1 4.37Å
88	F	84.5	Confident	85.6	Confident	103 Å²	103	50.4 Å²	50.4	45%	0.452	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-88	-5.5	-178.9	-60	-73.3	0	0	0	113.4	P21 G85 G86	P21-F88 HydrophobicContact CB-CD1 4.44Å; P21-F88 HydrophobicContact CG-CD1 3.77Å; P21-F88 HydrophobicContact CG-CE1 3.78Å; G85-F88 WeakPolarHBondContact O-CD2 3.49Å; G85-F88 PolarHBondContact O-N 3.3Å; G86-F88 PolarHBondContact O-N 3.13Å; G86-F88 VanDerWaalsContact O-N 3.13Å
89	Y	78.8	Confident	85.1	Confident	86 Å²	86	52.9 Å²	52.9	34%	0.337	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-6.2	-178.5	-58.1	-77.6	0	0	0	113	G85 G86 H87 A469	G85-Y89 WeakPolarHBondContact O-CD2 3.36Å; G86-Y89 PolarHBondContact O-N 3.02Å; H87-Y89 VanDerWaalsContact C-N 3.35Å; Y89-A469 HydrophobicContact CD2-CB 4.31Å; Y89-A469 HydrophobicContact CG-CB 4.17Å
90	L	85.3	Confident	84.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-126.2	114.8	-178.4	179.8	67.1	0	0	0	109.3	I26 I54 L57 A58 C62 M65 G86 I92	I26-L90 VanDerWaalsContact CG2-C 3.47Å; I54-L90 HydrophobicContact CG2-CD2 4.33Å; L57-L90 HydrophobicContact CB-CD1 4.36Å; L57-L90 HydrophobicContact CB-CD2 3.67Å; L57-L90 HydrophobicContact CD1-CD2 4.24Å; A58-L90 HydrophobicContact CB-CB 4.05Å; C62-L90 HydrophobicContact CB-CD1 4.02Å; C62-L90 WeakPolarHBondContact O-CD1 3.16Å; M65-L90 HydrophobicContact CB-CD1 4.48Å; M65-L90 HydrophobicContact CB-CD2 3.8Å; M65-L90 HydrophobicContact CB-CG 4.13Å; M65-L90 HydrophobicContact SD-CD2 3.98Å; G86-L90 PolarHBondContact O-N 3.35Å; L90-I92 HydrophobicContact CD2-CG1 4.38Å; L90-I92 HydrophobicContact CG-CG1 4.32Å; L90-I92 WeakPolarHBondContact O-CG1 3.49Å; L90-I92 PolarHBondContact O-N 3.44Å
91	P	88.7	Confident	84.1	Confident	2 Å²	2	54 Å²	54	1%	0.013	25%	0.254	C	S	.	.			trans	-59.6	120.2	170.9	-24.8	34.9	0	0	0	110.5	L23 I26 Q30 R63 A64 M65 Y93	L23-P91 HydrophobicContact CD2-CB 4.06Å; I26-P91 HydrophobicContact CB-CG 4.49Å; I26-P91 HydrophobicContact CG2-CB 4.48Å; I26-P91 HydrophobicContact CG2-CG 3.97Å; Q30-P91 HydrophobicContact CG-CG 4.42Å; R63-P91 WeakPolarHBondContact O-CD 3.4Å; A64-P91 CarbonylContact C-O 3.58Å; A64-P91 WeakPolarHBondContact CA-O 3.42Å; A64-P91 HydrophobicContact CB-CB 4.4Å; M65-P91 PolarHBondContact N-O 3.08Å; P91-Y93 HydrophobicContact CB-CE2 4.21Å
92	I	90.7	Very high	83.6	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	117	-179.8	-61.6	157.7	0	0	0	109.1	I54 M65 P74 W75 H87 L90	I54-I92 HydrophobicContact CD1-CD1 3.84Å; I54-I92 HydrophobicContact CG1-CD1 4.01Å; I54-I92 HydrophobicContact CG2-CD1 4.03Å; M65-I92 HydrophobicContact CB-CG1 4.23Å; M65-I92 CarbonylContact O-C 3.53Å; M65-I92 VanDerWaalsContact O-CA 3.32Å; M65-I92 WeakPolarHBondContact O-CA 3.31Å; M65-I92 HydrophobicContact SD-CG1 4.44Å; P74-I92 HydrophobicContact CB-CG2 3.97Å; P74-I92 HydrophobicContact CG-CG2 3.74Å; W75-I92 HydrophobicContact CZ2-CD1 4.47Å; H87-I92 HydrophobicContact CB-CD1 4.37Å; L90-I92 HydrophobicContact CD2-CG1 4.38Å; L90-I92 HydrophobicContact CG-CG1 4.32Å; L90-I92 WeakPolarHBondContact O-CG1 3.49Å; L90-I92 PolarHBondContact O-N 3.44Å
93	Y	89.4	Confident	83.4	Confident	60 Å²	60	56.2 Å²	56.2	24%	0.235	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.3	170.5	-59.4	-102.4	0	0	0	107.8	L23 A64 M65 L66 T67 P91 Y104	L23-Y93 HydrophobicContact CD1-CD1 3.66Å; L23-Y93 HydrophobicContact CD1-CE1 3.39Å; L23-Y93 HydrophobicContact CD1-CG 4.41Å; L23-Y93 HydrophobicContact CD2-CD1 4.39Å; L23-Y93 HydrophobicContact CD2-CD2 4.21Å; L23-Y93 HydrophobicContact CD2-CE1 4.16Å; L23-Y93 HydrophobicContact CD2-CE2 3.94Å; L23-Y93 HydrophobicContact CD2-CG 4.42Å; L23-Y93 HydrophobicContact CG-CE1 4.36Å; A64-Y93 HydrophobicContact CB-CD2 4.42Å; A64-Y93 HydrophobicContact CB-CE2 4.17Å; M65-Y93 PolarHBondContact O-N 3.33Å; L66-Y93 CarbonylContact C-O 3.51Å; L66-Y93 WeakPolarHBondContact CA-O 3.5Å; L66-Y93 HydrophobicContact CD2-CD2 3.42Å; L66-Y93 VanDerWaalsContact CD2-CD2 3.42Å; L66-Y93 HydrophobicContact CD2-CE2 4.3Å; L66-Y93 HydrophobicContact CD2-CG 3.69Å; T67-Y93 PolarHBondContact N-O 2.89Å; P91-Y93 HydrophobicContact CB-CE2 4.21Å; Y93-Y104 AromaticContact CD1-CD1 3.51Å; Y93-Y104 HydrophobicContact CD1-CD1 3.51Å; Y93-Y104 AromaticContact CD1-CE1 3.36Å; Y93-Y104 HydrophobicContact CD1-CE1 3.36Å; Y93-Y104 AromaticContact CE1-CD1 3.53Å; Y93-Y104 HydrophobicContact CE1-CD1 3.53Å; Y93-Y104 AromaticContact CE1-CE1 3.52Å; Y93-Y104 HydrophobicContact CE1-CE1 3.52Å; Y93-Y104 HydrophobicContact CG-CD1 4.16Å; Y93-Y104 HydrophobicContact CG-CE1 4.33Å
94	E	89.1	Confident	83	Confident	56 Å²	56	60.8 Å²	60.8	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	156.8	-167.8	65.8	-158.2	-158.3	0	0	112.9	K20 T67 P74 W75 L96	K20-E94 IonicContact NZ-OE1 2.74Å; K20-E94 PolarHBondContact NZ-OE1 3.14Å; K20-E94 IonicContact NZ-OE2 3.32Å; K20-E94 PolarHBondContact NZ-OE2 3.16Å; T67-E94 CarbonylContact O-C 3.48Å; T67-E94 VanDerWaalsContact OG1-CA 3.23Å; T67-E94 WeakPolarHBondContact OG1-CA 3.3Å; P74-E94 HydrophobicContact CG-CB 3.92Å; W75-E94 PolarHBondContact NE1-OE2 2.81Å; E94-L96 PolarHBondContact O-N 2.83Å
95	H	86.3	Confident	82.2	Confident	97 Å²	97	59.3 Å²	59.3	45%	0.449	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.7	34.3	177	-56.8	-61.6	0	0	0	113.5	T67	T67-H95 PolarHBondContact O-N 3.07Å
96	L	87.4	Confident	81.4	Confident	14 Å²	14	62 Å²	62	7%	0.073	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	145.4	177.9	-58.9	-175.1	0	0	0	110.7	L66 T67 L68 A69 E94 Y104	L66-L96 HydrophobicContact CB-CD1 4.01Å; L66-L96 HydrophobicContact CD1-CD1 4.34Å; L66-L96 HydrophobicContact CD2-CD1 4.12Å; L66-L96 HydrophobicContact CG-CD1 4.37Å; T67-L96 PolarHBondContact O-N 2.92Å; L68-L96 CarbonylContact C-O 3.59Å; L68-L96 VanDerWaalsContact CA-O 3.27Å; L68-L96 WeakPolarHBondContact CA-O 3.29Å; L68-L96 HydrophobicContact CD2-CB 4.39Å; L68-L96 WeakPolarHBondContact CD2-O 3.12Å; A69-L96 PolarHBondContact N-O 3.25Å; E94-L96 PolarHBondContact O-N 2.83Å; L96-Y104 HydrophobicContact CD1-CD2 3.97Å; L96-Y104 HydrophobicContact CD1-CE2 4.14Å; L96-Y104 HydrophobicContact CD1-CG 4.44Å; L96-Y104 HydrophobicContact CD2-CE2 3.85Å
97	H	85.5	Confident	80.2	Confident	115 Å²	115	67.8 Å²	67.8	53%	0.532	34%	0.335	S	S	.	.			trans	-87.1	155	162.8	-68.7	-90.2	0	0	0	110	E99 D100	H97-E99 PolarHBondContact O-N 3.38Å; H97-D100 WeakPolarHBondContact CB-OD2 3.36Å; H97-D100 PolarHBondContact N-OD2 2.86Å; H97-D100 PolarHBondContact O-N 3.46Å
98	L	76.6	Confident	78.4	Confident	67 Å²	67	75.8 Å²	75.8	35%	0.351	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.9	-174.7	-148.3	138.6	0	0	0	112	L68 A116	L68-L98 HydrophobicContact CD1-CD1 3.89Å; L68-L98 HydrophobicContact CD1-CG 4.37Å; L68-L98 HydrophobicContact CD2-CB 4.31Å; L98-A116 HydrophobicContact CD1-CB 4.42Å; L98-A116 HydrophobicContact CD2-CB 4.19Å
99	E	78.1	Confident	76.9	Confident	178 Å²	178	73 Å²	73	83%	0.832	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.9	175.9	-63.4	172.7	-166.5	0	0	112.6	H97	H97-E99 PolarHBondContact O-N 3.38Å
100	D	80.3	Confident	75.2	Confident	75 Å²	75	73.4 Å²	73.4	40%	0.401	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-81.9	-20.8	-175.1	-57.9	-42.5	0	0	0	112.9	H97 R102 S103 Y104	H97-D100 WeakPolarHBondContact CB-OD2 3.36Å; H97-D100 PolarHBondContact N-OD2 2.86Å; H97-D100 PolarHBondContact O-N 3.46Å; D100-R102 PolarHBondContact O-N 2.9Å; D100-R102 VanDerWaalsContact O-N 3.09Å; D100-S103 PolarHBondContact O-N 3.02Å; D100-S103 PolarHBondContact O-OG 2.82Å; D100-Y104 HydrophobicContact CB-CE2 4.47Å; D100-Y104 WeakPolarHBondContact O-CD2 3.3Å
101	I	77.2	Confident	73.5	Confident	12 Å²	12	74.9 Å²	74.9	6%	0.062	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-54.3	-36.1	-173.7	-74.6	179.2	0	0	0	111.9	V40 L66 L68 S103 Y104 L105	V40-I101 HydrophobicContact CG1-CD1 3.69Å; L66-I101 HydrophobicContact CD1-CG2 4.18Å; L68-I101 HydrophobicContact CD1-CD1 4.19Å; L68-I101 HydrophobicContact CD2-CD1 3.43Å; L68-I101 VanDerWaalsContact CD2-CD1 3.43Å; L68-I101 HydrophobicContact CD2-CG1 4.06Å; L68-I101 HydrophobicContact CG-CD1 3.96Å; I101-S103 PolarHBondContact O-N 3.04Å; I101-S103 VanDerWaalsContact O-N 3.13Å; I101-Y104 PolarHBondContact O-N 3.11Å; I101-L105 HydrophobicContact CG2-CD1 3.22Å; I101-L105 HydrophobicContact CG2-CG 3.85Å; I101-L105 PolarHBondContact O-N 3.39Å
102	R	72.2	Confident	71.1	Confident	149 Å²	149	76.8 Å²	76.8	56%	0.562	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-55.8	-32.6	-178.7	-75	-173.4	-179.3	-167.6	-1.6	112.7	D100 Y104 F120 E123	D100-R102 PolarHBondContact O-N 2.9Å; D100-R102 VanDerWaalsContact O-N 3.09Å; R102-Y104 PolarHBondContact O-N 3.17Å; R102-F120 HydrophobicContact CG-CE2 4.33Å; R102-F120 HydrophobicContact CG-CZ 4.26Å; R102-E123 IonicContact NH2-OE2 2.76Å; R102-E123 PolarHBondContact NH2-OE2 3.06Å
103	S	79.6	Confident	69.1	Low	94 Å²	94	84.4 Å²	84.4	66%	0.657	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-71	-16.4	179.2	67.5	0	0	0	0	113.8	D100 I101	D100-S103 PolarHBondContact O-N 3.02Å; D100-S103 PolarHBondContact O-OG 2.82Å; I101-S103 PolarHBondContact O-N 3.04Å; I101-S103 VanDerWaalsContact O-N 3.13Å
104	Y	76.4	Confident	67.5	Low	96 Å²	96	83 Å²	83	38%	0.376	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-104.7	-7	-177.7	-62.5	-83.4	0	0	0	113.6	Y93 L96 D100 I101 R102	Y93-Y104 AromaticContact CD1-CD1 3.51Å; Y93-Y104 HydrophobicContact CD1-CD1 3.51Å; Y93-Y104 AromaticContact CD1-CE1 3.36Å; Y93-Y104 HydrophobicContact CD1-CE1 3.36Å; Y93-Y104 AromaticContact CE1-CD1 3.53Å; Y93-Y104 HydrophobicContact CE1-CD1 3.53Å; Y93-Y104 AromaticContact CE1-CE1 3.52Å; Y93-Y104 HydrophobicContact CE1-CE1 3.52Å; Y93-Y104 HydrophobicContact CG-CD1 4.16Å; Y93-Y104 HydrophobicContact CG-CE1 4.33Å; L96-Y104 HydrophobicContact CD1-CD2 3.97Å; L96-Y104 HydrophobicContact CD1-CE2 4.14Å; L96-Y104 HydrophobicContact CD1-CG 4.44Å; L96-Y104 HydrophobicContact CD2-CE2 3.85Å; D100-Y104 HydrophobicContact CB-CE2 4.47Å; D100-Y104 WeakPolarHBondContact O-CD2 3.3Å; I101-Y104 PolarHBondContact O-N 3.11Å; R102-Y104 PolarHBondContact O-N 3.17Å
105	L	68.6	Low	66	Low	20 Å²	20	87 Å²	87	11%	0.105	46%	0.459	C	S	.	.	S	Bend	trans	-105	146.8	-177.6	-62.9	-179.5	0	0	0	110.4	I38 L66 I101 F109 V111	I38-L105 HydrophobicContact CB-CD2 3.98Å; I38-L105 HydrophobicContact CD1-CD2 3.66Å; I38-L105 HydrophobicContact CG1-CD2 4.42Å; I38-L105 HydrophobicContact CG2-CD2 3.7Å; L66-L105 HydrophobicContact CD1-CD2 3.92Å; L66-L105 HydrophobicContact CD1-CG 4.3Å; I101-L105 HydrophobicContact CG2-CD1 3.22Å; I101-L105 HydrophobicContact CG2-CG 3.85Å; I101-L105 PolarHBondContact O-N 3.39Å; L105-F109 HydrophobicContact CB-CD1 3.6Å; L105-F109 HydrophobicContact CB-CD2 3.98Å; L105-F109 HydrophobicContact CB-CE1 3.34Å; L105-F109 HydrophobicContact CB-CE2 3.8Å; L105-F109 HydrophobicContact CB-CG 3.86Å; L105-F109 HydrophobicContact CB-CZ 3.43Å; L105-F109 VanDerWaalsContact CB-CZ 3.43Å; L105-F109 HydrophobicContact CD1-CD2 3.39Å; L105-F109 HydrophobicContact CD1-CE1 4.19Å; L105-F109 HydrophobicContact CD1-CE2 2.97Å; L105-F109 HydrophobicContact CD1-CG 4.15Å; L105-F109 HydrophobicContact CD1-CZ 3.39Å; L105-F109 HydrophobicContact CG-CD2 4.18Å; L105-F109 HydrophobicContact CG-CE1 4.37Å; L105-F109 HydrophobicContact CG-CE2 3.95Å; L105-F109 HydrophobicContact CG-CG 4.49Å; L105-F109 HydrophobicContact CG-CZ 3.99Å; L105-V111 HydrophobicContact CD1-CG2 4.11Å
106	P	64.7	Low	65	Low	72 Å²	72	84.8 Å²	84.8	47%	0.468	46%	0.458	S	S	.	.			trans	-59.1	169.4	175.1	-1.5	7.4	0	0	0	111.2	E108 F109	P106-E108 PolarHBondContact O-N 3.08Å; P106-E108 VanDerWaalsContact O-N 3.15Å; P106-F109 WeakPolarHBondContact O-CD1 3.32Å; P106-F109 WeakPolarHBondContact O-CE1 3.44Å
107	S	57.7	Low	63.5	Low	121 Å²	121	84.8 Å²	84.8	85%	0.846	46%	0.458	S	S	*	.	S	Bend	trans	-63.8	-18.7	176.6	47.7	0	0	0	0	113.8
108	E	49.3	Very low	62.1	Low	169 Å²	169	82.7 Å²	82.7	79%	0.79	45%	0.453	S	S	*	.	S	Bend	trans	-127.1	106.3	-178.3	-60.9	-176.9	-169.5	0	0	110.2	P106	P106-E108 PolarHBondContact O-N 3.08Å; P106-E108 VanDerWaalsContact O-N 3.15Å
109	F	53.3	Low	61.7	Low	45 Å²	45	87.2 Å²	87.2	20%	0.197	47%	0.466	C	S	.	.			trans	-159.7	167	178	67.6	-80.7	0	0	0	112.6	L105 P106 V111 F120 L124	L105-F109 HydrophobicContact CB-CD1 3.6Å; L105-F109 HydrophobicContact CB-CD2 3.98Å; L105-F109 HydrophobicContact CB-CE1 3.34Å; L105-F109 HydrophobicContact CB-CE2 3.8Å; L105-F109 HydrophobicContact CB-CG 3.86Å; L105-F109 HydrophobicContact CB-CZ 3.43Å; L105-F109 VanDerWaalsContact CB-CZ 3.43Å; L105-F109 HydrophobicContact CD1-CD2 3.39Å; L105-F109 HydrophobicContact CD1-CE1 4.19Å; L105-F109 HydrophobicContact CD1-CE2 2.97Å; L105-F109 HydrophobicContact CD1-CG 4.15Å; L105-F109 HydrophobicContact CD1-CZ 3.39Å; L105-F109 HydrophobicContact CG-CD2 4.18Å; L105-F109 HydrophobicContact CG-CE1 4.37Å; L105-F109 HydrophobicContact CG-CE2 3.95Å; L105-F109 HydrophobicContact CG-CG 4.49Å; L105-F109 HydrophobicContact CG-CZ 3.99Å; P106-F109 WeakPolarHBondContact O-CD1 3.32Å; P106-F109 WeakPolarHBondContact O-CE1 3.44Å; F109-V111 HydrophobicContact CD2-CG2 3.4Å; F109-V111 VanDerWaalsContact CD2-CG2 3.4Å; F109-V111 HydrophobicContact CE2-CG2 3.48Å; F109-V111 VanDerWaalsContact CE2-CG2 3.48Å; F109-F120 AromaticContact CE2-CE1 3.63Å; F109-F120 HydrophobicContact CE2-CE1 3.63Å; F109-F120 AromaticContact CE2-CZ 3.73Å; F109-F120 HydrophobicContact CE2-CZ 3.73Å; F109-F120 HydrophobicContact CZ-CE1 4.04Å; F109-F120 AromaticContact CZ-CZ 3.64Å; F109-F120 HydrophobicContact CZ-CZ 3.64Å; F109-L124 HydrophobicContact CE2-CD1 4.28Å; F109-L124 HydrophobicContact CZ-CD1 4.22Å
110	T	43	Very low	61.1	Low	95 Å²	95	80 Å²	80	58%	0.583	43%	0.432	S	S	*	.			trans	-132.1	132.2	-175.3	-31.7	0	0	0	0	110.6
111	V	49.9	Very low	59.9	Low	31 Å²	31	77.3 Å²	77.3	19%	0.188	42%	0.419	C	S	.	.			trans	-139.6	149.1	-177.4	-162.4	0	0	0	0	110.9	V40 L105 F109 T117 F120 A121	V40-V111 HydrophobicContact CG2-CG1 4.35Å; L105-V111 HydrophobicContact CD1-CG2 4.11Å; F109-V111 HydrophobicContact CD2-CG2 3.4Å; F109-V111 VanDerWaalsContact CD2-CG2 3.4Å; F109-V111 HydrophobicContact CE2-CG2 3.48Å; F109-V111 VanDerWaalsContact CE2-CG2 3.48Å; V111-T117 HydrophobicContact CB-CG2 4.03Å; V111-T117 HydrophobicContact CG1-CG2 3.59Å; V111-F120 HydrophobicContact CB-CD1 4.46Å; V111-F120 HydrophobicContact CB-CE1 4.43Å; V111-F120 HydrophobicContact CG2-CE1 4.15Å; V111-A121 WeakPolarHBondContact O-CB 3.38Å
112	G	38.8	Very low	59.3	Low	42 Å²	42	80.3 Å²	80.3	43%	0.433	45%	0.446	S	S	.	.			trans	-157.8	139.6	166.8	0	0	0	0	0	111.4	T117	G112-T117 VanDerWaalsContact CA-CG2 3.44Å
113	L	47.5	Very low	59.1	Low	164 Å²	164	79.6 Å²	79.6	86%	0.859	45%	0.449	S	S	*	.	S	Bend	trans	173.1	5.6	145.5	-90	162	0	0	0	118.1
114	S	56.2	Low	58.1	Low	31 Å²	31	78.7 Å²	78.7	22%	0.217	44%	0.437	C	S	.	.	S	Bend	trans	-121.2	169.5	159.8	80.1	0	0	0	0	111.5	A116 T117 V118	S114-A116 PolarHBondContact O-N 3.27Å; S114-A116 PolarHBondContact OG-N 2.6Å; S114-T117 PolarHBondContact N-OG1 2.93Å; S114-T117 CarbonylContact O-C 3.45Å; S114-T117 WeakPolarHBondContact O-CA 3.34Å; S114-T117 WeakPolarHBondContact O-CB 3.39Å; S114-T117 PolarHBondContact O-N 3.42Å; S114-T117 PolarHBondContact OG-N 3.32Å; S114-T117 PolarHBondContact OG-OG1 3.4Å; S114-V118 WeakPolarHBondContact O-CG2 3.36Å; S114-V118 PolarHBondContact O-N 3.41Å
115	E	58.5	Low	57.3	Low	139 Å²	139	83.7 Å²	83.7	65%	0.65	46%	0.46	S	S	*	.	H	α-helix	trans	-56.9	-40.7	176.4	-168.7	-173.7	155.7	0	0	111.2	T117 V118 R119	E115-T117 VanDerWaalsContact C-N 3.34Å; E115-T117 PolarHBondContact O-N 2.92Å; E115-V118 PolarHBondContact O-N 2.87Å; E115-R119 WeakPolarHBondContact O-CG 3.28Å; E115-R119 PolarHBondContact O-N 3.26Å; E115-R119 IonicContact OE1-CZ 3.74Å; E115-R119 IonicContact OE1-NE 3.42Å; E115-R119 IonicContact OE1-NH2 3.99Å; E115-R119 PolarHBondContact OE1-NH2 3.41Å
116	A	65.1	Low	56.4	Low	52 Å²	52	83.9 Å²	83.9	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-60.6	-43.3	171.8	0	0	0	0	0	111.4	L98 S114 V118 R119 F120	L98-A116 HydrophobicContact CD1-CB 4.42Å; L98-A116 HydrophobicContact CD2-CB 4.19Å; S114-A116 PolarHBondContact O-N 3.27Å; S114-A116 PolarHBondContact OG-N 2.6Å; A116-V118 VanDerWaalsContact C-N 3.34Å; A116-V118 PolarHBondContact O-N 3.41Å; A116-R119 PolarHBondContact O-N 3.08Å; A116-F120 WeakPolarHBondContact O-CB 3.44Å; A116-F120 PolarHBondContact O-N 2.77Å
117	T	55.9	Low	55.3	Low	13 Å²	13	86.6 Å²	86.6	8%	0.08	49%	0.486	C	S	.	.	H	α-helix	trans	-68.7	-30.7	176.4	-34.7	0	0	0	0	112.9	V111 G112 S114 E115 F120 A121	V111-T117 HydrophobicContact CB-CG2 4.03Å; V111-T117 HydrophobicContact CG1-CG2 3.59Å; G112-T117 VanDerWaalsContact CA-CG2 3.44Å; S114-T117 PolarHBondContact N-OG1 2.93Å; S114-T117 CarbonylContact O-C 3.45Å; S114-T117 WeakPolarHBondContact O-CA 3.34Å; S114-T117 WeakPolarHBondContact O-CB 3.39Å; S114-T117 PolarHBondContact O-N 3.42Å; S114-T117 PolarHBondContact OG-N 3.32Å; S114-T117 PolarHBondContact OG-OG1 3.4Å; E115-T117 VanDerWaalsContact C-N 3.34Å; E115-T117 PolarHBondContact O-N 2.92Å; T117-F120 PolarHBondContact O-N 3.28Å; T117-A121 WeakPolarHBondContact O-CB 3.16Å; T117-A121 PolarHBondContact O-N 3.46Å
118	V	56	Low	54.6	Low	71 Å²	71	90.1 Å²	90.1	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-70.9	-42.6	177.9	173.6	0	0	0	0	110.2	S114 E115 A116 F120 A121 A122	S114-V118 WeakPolarHBondContact O-CG2 3.36Å; S114-V118 PolarHBondContact O-N 3.41Å; E115-V118 PolarHBondContact O-N 2.87Å; A116-V118 VanDerWaalsContact C-N 3.34Å; A116-V118 PolarHBondContact O-N 3.41Å; V118-F120 VanDerWaalsContact C-N 3.31Å; V118-A121 WeakPolarHBondContact O-CB 3.44Å; V118-A121 PolarHBondContact O-N 2.93Å; V118-A122 PolarHBondContact O-N 3.22Å
119	R	66.9	Low	54.3	Low	162 Å²	162	88.8 Å²	88.8	61%	0.611	48%	0.479	S	S	*	.	H	α-helix	trans	-59.2	-46.4	171.6	-69.8	-177.5	-170.1	-164.4	4.7	110.7	E115 A116 A121 A122 E123	E115-R119 WeakPolarHBondContact O-CG 3.28Å; E115-R119 PolarHBondContact O-N 3.26Å; E115-R119 IonicContact OE1-CZ 3.74Å; E115-R119 IonicContact OE1-NE 3.42Å; E115-R119 IonicContact OE1-NH2 3.99Å; E115-R119 PolarHBondContact OE1-NH2 3.41Å; A116-R119 PolarHBondContact O-N 3.08Å; R119-A121 VanDerWaalsContact C-N 3.34Å; R119-A121 PolarHBondContact O-N 3.08Å; R119-A122 WeakPolarHBondContact O-CB 3.45Å; R119-A122 PolarHBondContact O-N 3.21Å; R119-E123 PolarHBondContact O-N 3.16Å; R119-E123 VanDerWaalsContact O-N 3.14Å
120	F	65.5	Low	53.7	Low	28 Å²	28	93.4 Å²	93.4	12%	0.123	50%	0.501	C	S	.	.	H	α-helix	trans	-62.6	-37	176.5	-178.4	-114.2	0	0	0	113.4	R102 F109 V111 A116 T117 V118 A122 E123 L124	R102-F120 HydrophobicContact CG-CE2 4.33Å; R102-F120 HydrophobicContact CG-CZ 4.26Å; F109-F120 AromaticContact CE2-CE1 3.63Å; F109-F120 HydrophobicContact CE2-CE1 3.63Å; F109-F120 AromaticContact CE2-CZ 3.73Å; F109-F120 HydrophobicContact CE2-CZ 3.73Å; F109-F120 HydrophobicContact CZ-CE1 4.04Å; F109-F120 AromaticContact CZ-CZ 3.64Å; F109-F120 HydrophobicContact CZ-CZ 3.64Å; V111-F120 HydrophobicContact CB-CD1 4.46Å; V111-F120 HydrophobicContact CB-CE1 4.43Å; V111-F120 HydrophobicContact CG2-CE1 4.15Å; A116-F120 WeakPolarHBondContact O-CB 3.44Å; A116-F120 PolarHBondContact O-N 2.77Å; T117-F120 PolarHBondContact O-N 3.28Å; V118-F120 VanDerWaalsContact C-N 3.31Å; F120-A122 VanDerWaalsContact C-N 3.33Å; F120-A122 PolarHBondContact O-N 3.33Å; F120-E123 PolarHBondContact O-N 3.39Å; F120-L124 HydrophobicContact CE1-CD1 4.01Å; F120-L124 HydrophobicContact CE2-CD1 3.78Å; F120-L124 HydrophobicContact CE2-CG 4.47Å; F120-L124 HydrophobicContact CZ-CD1 3.48Å; F120-L124 VanDerWaalsContact CZ-CD1 3.48Å; F120-L124 PolarHBondContact O-N 3.3Å
121	A	56.2	Low	53.8	Low	17 Å²	17	92.5 Å²	92.5	14%	0.14	49%	0.492	C	S	.	.	H	α-helix	trans	-62.5	-40.2	173.9	0	0	0	0	0	112.2	V111 T117 V118 R119 L124 K125 G126	V111-A121 WeakPolarHBondContact O-CB 3.38Å; T117-A121 WeakPolarHBondContact O-CB 3.16Å; T117-A121 PolarHBondContact O-N 3.46Å; V118-A121 WeakPolarHBondContact O-CB 3.44Å; V118-A121 PolarHBondContact O-N 2.93Å; R119-A121 VanDerWaalsContact C-N 3.34Å; R119-A121 PolarHBondContact O-N 3.08Å; A121-L124 PolarHBondContact O-N 3.25Å; A121-K125 PolarHBondContact O-N 3Å; A121-G126 PolarHBondContact O-N 2.82Å
122	A	63.6	Low	53.3	Low	76 Å²	76	96.4 Å²	96.4	63%	0.628	52%	0.518	S	S	*	.	H	α-helix	trans	-66.7	-39.2	179.4	0	0	0	0	0	111.7	V118 R119 F120 L124 K125	V118-A122 PolarHBondContact O-N 3.22Å; R119-A122 WeakPolarHBondContact O-CB 3.45Å; R119-A122 PolarHBondContact O-N 3.21Å; F120-A122 VanDerWaalsContact C-N 3.33Å; F120-A122 PolarHBondContact O-N 3.33Å; A122-L124 PolarHBondContact O-N 3.4Å; A122-K125 PolarHBondContact O-N 3.14Å
123	E	68.3	Low	53.5	Low	133 Å²	133	100.4 Å²	100.4	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-59.3	-32.1	175.3	-72.2	175.5	-171.9	0	0	112.9	R102 R119 F120	R102-E123 IonicContact NH2-OE2 2.76Å; R102-E123 PolarHBondContact NH2-OE2 3.06Å; R119-E123 PolarHBondContact O-N 3.16Å; R119-E123 VanDerWaalsContact O-N 3.14Å; F120-E123 PolarHBondContact O-N 3.39Å
124	L	59.5	Low	53.4	Low	76 Å²	76	95.8 Å²	95.8	40%	0.398	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	16.9	-175.9	-64	176.8	0	0	0	114.4	F109 F120 A121 A122 G126	F109-L124 HydrophobicContact CE2-CD1 4.28Å; F109-L124 HydrophobicContact CZ-CD1 4.22Å; F120-L124 HydrophobicContact CE1-CD1 4.01Å; F120-L124 HydrophobicContact CE2-CD1 3.78Å; F120-L124 HydrophobicContact CE2-CG 4.47Å; F120-L124 HydrophobicContact CZ-CD1 3.48Å; F120-L124 VanDerWaalsContact CZ-CD1 3.48Å; F120-L124 PolarHBondContact O-N 3.3Å; A121-L124 PolarHBondContact O-N 3.25Å; A122-L124 PolarHBondContact O-N 3.4Å; L124-G126 VanDerWaalsContact C-N 3.32Å; L124-G126 PolarHBondContact O-N 2.87Å
125	K	59.5	Low	52.9	Low	200 Å²	200	103.8 Å²	103.8	87%	0.87	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	34.5	-178.5	-57.1	-177.5	179.3	178.2	0	114.8	A121 A122	A121-K125 PolarHBondContact O-N 3Å; A122-K125 PolarHBondContact O-N 3.14Å
126	G	48.3	Very low	52.2	Low	25 Å²	25	107.3 Å²	107.3	26%	0.258	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-74.3	147.4	-179.6	0	0	0	0	0	115.6	A121 L124	A121-G126 PolarHBondContact O-N 2.82Å; L124-G126 VanDerWaalsContact C-N 3.32Å; L124-G126 PolarHBondContact O-N 2.87Å
127	C	42.6	Very low	51.2	Low	128 Å²	128	107 Å²	107	87%	0.865	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-91.6	136.8	172.2	-70.2	0	0	0	0	112.1
128	R	43.7	Very low	50.4	Low	195 Å²	195	115.8 Å²	115.8	74%	0.736	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-88.9	122.5	178.1	-177.2	175.6	178.4	172.3	-3.9	111.1	H130	R128-H130 PolarHBondContact NH2-NE2 2.92Å
129	L	42.5	Very low	50	Low	142 Å²	142	115.2 Å²	115.2	74%	0.743	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-98.2	124.2	170.6	-135.7	106.1	0	0	0	110
130	H	40.7	Very low	49.3	Very low	141 Å²	141	112.3 Å²	112.3	65%	0.653	60%	0.599	S	S	*	*			trans	-97.5	108.7	-179.4	-136.1	-90	0	0	0	110	R128 P132	R128-H130 PolarHBondContact NH2-NE2 2.92Å; H130-P132 WeakPolarHBondContact O-CD 3.42Å
131	I	44.9	Very low	49.4	Very low	76 Å²	76	114.1 Å²	114.1	39%	0.39	61%	0.609	S	S	.	*			trans	-95	110.5	170.2	-55.2	-179.8	0	0	0	107.4	M133 A145 M149	I131-M133 PolarHBondContact O-N 2.81Å; I131-A145 HydrophobicContact CD1-CB 4.22Å; I131-M149 HydrophobicContact CD1-CE 3.8Å; I131-M149 HydrophobicContact CD1-CG 4.47Å; I131-M149 HydrophobicContact CD1-SD 3.72Å
132	P	39.2	Very low	49.9	Very low	114 Å²	114	116.2 Å²	116.2	74%	0.74	62%	0.623	S	S	*	*			trans	-67.9	103.3	-177.3	26.3	-32	0	0	0	110.2	H130 A134	H130-P132 WeakPolarHBondContact O-CD 3.42Å; P132-A134 PolarHBondContact O-N 3.5Å
133	M	43.5	Very low	50.1	Low	126 Å²	126	112.8 Å²	112.8	62%	0.621	60%	0.595	S	S	*	*			trans	-90.2	88.4	165.1	-69.3	-166.5	61.7	0	0	108.5	I131 Q135 C139	I131-M133 PolarHBondContact O-N 2.81Å; M133-Q135 PolarHBondContact O-N 2.99Å; M133-C139 HydrophobicContact CE-CB 3.93Å
134	A	44.8	Very low	50.3	Low	67 Å²	67	109.5 Å²	109.5	55%	0.554	58%	0.583	S	S	*	*			trans	-72.1	127.1	173.2	0	0	0	0	0	109.9	P132 K136 C139	P132-A134 PolarHBondContact O-N 3.5Å; A134-K136 PolarHBondContact O-N 2.61Å; A134-C139 PolarHBondContact O-SG 3.07Å; A134-C139 VanDerWaalsContact O-SG 3.39Å
135	Q	46.4	Very low	50.8	Low	199 Å²	199	106.7 Å²	106.7	93%	0.93	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-5.5	178.2	-78.9	-176.2	-20	0	0	115	M133	M133-Q135 PolarHBondContact O-N 2.99Å
136	K	42.9	Very low	51.6	Low	212 Å²	212	97.9 Å²	97.9	92%	0.922	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	18.5	-172.9	-70.3	-170.1	175.2	-178.5	0	115.2	A134	A134-K136 PolarHBondContact O-N 2.61Å
137	G	43.7	Very low	52.9	Low	47 Å²	47	97.4 Å²	97.4	49%	0.485	53%	0.529	S	S	.	.	S	Bend	trans	-139.8	165.9	173.2	0	0	0	0	0	111.7	C139	G137-C139 VanDerWaalsContact C-N 3.28Å; G137-C139 PolarHBondContact O-N 2.85Å
138	M	40.5	Very low	54.3	Low	196 Å²	196	95.6 Å²	95.6	97%	0.966	51%	0.514	S	S	*	.			trans	-58.1	93.2	168.4	-70.3	-91.2	-73.1	0	0	108.4
139	C	46.5	Very low	55.9	Low	59 Å²	59	89.8 Å²	89.8	40%	0.399	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-59.3	140.7	175.9	-68.2	0	0	0	0	109.2	M133 A134 G137 N141	M133-C139 HydrophobicContact CE-CB 3.93Å; A134-C139 PolarHBondContact O-SG 3.07Å; A134-C139 VanDerWaalsContact O-SG 3.39Å; G137-C139 VanDerWaalsContact C-N 3.28Å; G137-C139 PolarHBondContact O-N 2.85Å; C139-N141 PolarHBondContact O-N 3.04Å
140	L	52.9	Low	57.7	Low	102 Å²	102	83.1 Å²	83.1	53%	0.534	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-55.4	128	161	-99.3	75.3	0	0	0	107.3	V144	L140-V144 HydrophobicContact CD2-CB 4.16Å; L140-V144 HydrophobicContact CD2-CG1 3.46Å; L140-V144 VanDerWaalsContact CD2-CG1 3.46Å; L140-V144 HydrophobicContact CG-CB 4.27Å; L140-V144 HydrophobicContact CG-CG1 3.84Å
141	N	67	Low	59.3	Low	65 Å²	65	79.8 Å²	79.8	35%	0.348	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-60.1	152	171.6	71.9	18	0	0	0	108.9	C139 S143 V144 A145	C139-N141 PolarHBondContact O-N 3.04Å; N141-S143 PolarHBondContact ND2-OG 3.35Å; N141-S143 PolarHBondContact O-N 3.28Å; N141-S143 PolarHBondContact OD1-N 3.38Å; N141-S143 PolarHBondContact OD1-OG 3.18Å; N141-V144 PolarHBondContact O-N 2.65Å; N141-V144 VanDerWaalsContact OD1-CB 3.26Å; N141-V144 WeakPolarHBondContact OD1-CB 3.33Å; N141-V144 WeakPolarHBondContact OD1-CG2 3.44Å; N141-V144 PolarHBondContact OD1-N 3.07Å; N141-A145 PolarHBondContact O-N 2.85Å; N141-A145 VanDerWaalsContact O-N 3.15Å
142	S	66.6	Low	60.6	Low	61 Å²	61	79.5 Å²	79.5	43%	0.427	44%	0.442	S	S	.	.	H	α-helix	trans	-54.8	-32	-177	-45.5	0	0	0	0	112	A146	S142-A146 VanDerWaalsContact O-CB 3.27Å; S142-A146 WeakPolarHBondContact O-CB 3.36Å; S142-A146 PolarHBondContact O-N 3.08Å
143	S	69.1	Low	62.1	Low	4 Å²	4	76.7 Å²	76.7	3%	0.028	42%	0.42	C	S	.	.	H	α-helix	trans	-66.9	-38.7	176.8	52.4	0	0	0	0	114	N141 A147	N141-S143 PolarHBondContact ND2-OG 3.35Å; N141-S143 PolarHBondContact O-N 3.28Å; N141-S143 PolarHBondContact OD1-N 3.38Å; N141-S143 PolarHBondContact OD1-OG 3.18Å; S143-A147 VanDerWaalsContact O-CB 3.26Å; S143-A147 WeakPolarHBondContact O-CB 3.46Å; S143-A147 PolarHBondContact O-N 3.4Å
144	V	71.1	Confident	63.5	Low	64 Å²	64	71.9 Å²	71.9	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-73.9	-41.3	179.4	175.1	0	0	0	0	109.3	L140 N141 A146 A147 V148	L140-V144 HydrophobicContact CD2-CB 4.16Å; L140-V144 HydrophobicContact CD2-CG1 3.46Å; L140-V144 VanDerWaalsContact CD2-CG1 3.46Å; L140-V144 HydrophobicContact CG-CB 4.27Å; L140-V144 HydrophobicContact CG-CG1 3.84Å; N141-V144 PolarHBondContact O-N 2.65Å; N141-V144 VanDerWaalsContact OD1-CB 3.26Å; N141-V144 WeakPolarHBondContact OD1-CB 3.33Å; N141-V144 WeakPolarHBondContact OD1-CG2 3.44Å; N141-V144 PolarHBondContact OD1-N 3.07Å; V144-A146 PolarHBondContact O-N 3.11Å; V144-A147 PolarHBondContact O-N 3.34Å; V144-V148 HydrophobicContact CG1-CG2 4.44Å; V144-V148 WeakPolarHBondContact O-CG2 3.39Å; V144-V148 PolarHBondContact O-N 3.14Å
145	A	71	Confident	64.7	Low	17 Å²	17	73 Å²	73	14%	0.14	39%	0.386	C	S	.	.	H	α-helix	trans	-59.1	-48.2	174.3	0	0	0	0	0	111.2	I131 N141 A147 V148 M149	I131-A145 HydrophobicContact CD1-CB 4.22Å; N141-A145 PolarHBondContact O-N 2.85Å; N141-A145 VanDerWaalsContact O-N 3.15Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 2.96Å; A145-V148 PolarHBondContact O-N 2.94Å; A145-M149 WeakPolarHBondContact O-CG 3.41Å; A145-M149 PolarHBondContact O-N 3.2Å
146	A	75.5	Confident	65.6	Low	15 Å²	15	68.1 Å²	68.1	12%	0.124	36%	0.363	C	S	.	.	H	α-helix	trans	-62.7	-39.3	176.2	0	0	0	0	0	112.6	L53 S142 V144 M149 A150	L53-A146 HydrophobicContact CD1-CB 3.26Å; S142-A146 VanDerWaalsContact O-CB 3.27Å; S142-A146 WeakPolarHBondContact O-CB 3.36Å; S142-A146 PolarHBondContact O-N 3.08Å; V144-A146 PolarHBondContact O-N 3.11Å; A146-M149 PolarHBondContact O-N 2.94Å; A146-A150 VanDerWaalsContact O-CB 3.27Å; A146-A150 WeakPolarHBondContact O-CB 3.46Å; A146-A150 PolarHBondContact O-N 2.92Å
147	A	75	Confident	66.8	Low	15 Å²	15	62 Å²	62	12%	0.124	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-50	175.4	0	0	0	0	0	111.2	S143 V144 A145 M149 A150 F151	S143-A147 VanDerWaalsContact O-CB 3.26Å; S143-A147 WeakPolarHBondContact O-CB 3.46Å; S143-A147 PolarHBondContact O-N 3.4Å; V144-A147 PolarHBondContact O-N 3.34Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 2.96Å; A147-M149 VanDerWaalsContact C-N 3.31Å; A147-M149 PolarHBondContact O-N 3.5Å; A147-A150 PolarHBondContact O-N 3.34Å; A147-F151 WeakPolarHBondContact O-CB 3.12Å; A147-F151 VanDerWaalsContact O-CD2 3.28Å; A147-F151 WeakPolarHBondContact O-CD2 3.07Å; A147-F151 PolarHBondContact O-N 2.86Å
148	V	72.3	Confident	67.8	Low	90 Å²	90	62.6 Å²	62.6	55%	0.545	33%	0.328	S	S	.	.	H	α-helix	trans	-57.4	-46.4	178.4	172.2	0	0	0	0	110.6	V144 A145 E152	V144-V148 HydrophobicContact CG1-CG2 4.44Å; V144-V148 WeakPolarHBondContact O-CG2 3.39Å; V144-V148 PolarHBondContact O-N 3.14Å; A145-V148 PolarHBondContact O-N 2.94Å; V148-E152 VanDerWaalsContact O-CB 3.26Å; V148-E152 WeakPolarHBondContact O-CB 3.32Å; V148-E152 PolarHBondContact O-N 3.49Å
149	M	77.1	Confident	68.7	Low	74 Å²	74	58.5 Å²	58.5	37%	0.365	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-48	176.7	-71.8	-172.5	-70.6	0	0	112.2	I131 A145 A146 A147 F151 E152 I153	I131-M149 HydrophobicContact CD1-CE 3.8Å; I131-M149 HydrophobicContact CD1-CG 4.47Å; I131-M149 HydrophobicContact CD1-SD 3.72Å; A145-M149 WeakPolarHBondContact O-CG 3.41Å; A145-M149 PolarHBondContact O-N 3.2Å; A146-M149 PolarHBondContact O-N 2.94Å; A147-M149 VanDerWaalsContact C-N 3.31Å; A147-M149 PolarHBondContact O-N 3.5Å; M149-F151 PolarHBondContact O-N 3.23Å; M149-E152 PolarHBondContact O-N 2.78Å; M149-I153 WeakPolarHBondContact O-CB 3.47Å; M149-I153 VanDerWaalsContact O-CG1 3.23Å; M149-I153 WeakPolarHBondContact O-CG1 3.26Å; M149-I153 PolarHBondContact O-N 3.32Å
150	A	79.9	Confident	69	Low	2 Å²	2	62.3 Å²	62.3	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-42.1	-178.4	0	0	0	0	0	112.1	L37 L57 A60 A146 A147 R154	L37-A150 HydrophobicContact CD2-CB 3.98Å; L57-A150 HydrophobicContact CD2-CB 4.08Å; A60-A150 HydrophobicContact CB-CB 3.79Å; A146-A150 VanDerWaalsContact O-CB 3.27Å; A146-A150 WeakPolarHBondContact O-CB 3.46Å; A146-A150 PolarHBondContact O-N 2.92Å; A147-A150 PolarHBondContact O-N 3.34Å; A150-R154 WeakPolarHBondContact O-CB 3.35Å; A150-R154 PolarHBondContact O-N 3.08Å
151	F	74.2	Confident	68.9	Low	71 Å²	71	60.4 Å²	60.4	31%	0.311	32%	0.318	S	S	.	.	H	α-helix	trans	-69.3	-34.9	176.6	-85.1	-77	0	0	0	112.5	A60 A147 M149 R154 R155 L464	A60-F151 HydrophobicContact CB-CD2 4.47Å; A60-F151 HydrophobicContact CB-CE2 4.37Å; A60-F151 HydrophobicContact CB-CZ 4.45Å; A147-F151 WeakPolarHBondContact O-CB 3.12Å; A147-F151 VanDerWaalsContact O-CD2 3.28Å; A147-F151 WeakPolarHBondContact O-CD2 3.07Å; A147-F151 PolarHBondContact O-N 2.86Å; M149-F151 PolarHBondContact O-N 3.23Å; F151-R154 PolarHBondContact O-N 3.32Å; F151-R155 WeakPolarHBondContact O-CB 3.45Å; F151-R155 PolarHBondContact O-N 3.38Å; F151-L464 HydrophobicContact CE1-CD2 4.32Å
152	E	72.4	Confident	67.6	Low	69 Å²	69	66.5 Å²	66.5	32%	0.322	34%	0.344	S	S	.	.	H	α-helix	trans	-70	-42.9	175	-179	53.8	-152.5	0	0	111.7	V148 M149 R154 R155 Q156	V148-E152 VanDerWaalsContact O-CB 3.26Å; V148-E152 WeakPolarHBondContact O-CB 3.32Å; V148-E152 PolarHBondContact O-N 3.49Å; M149-E152 PolarHBondContact O-N 2.78Å; E152-R154 VanDerWaalsContact C-N 3.33Å; E152-R154 PolarHBondContact O-N 2.74Å; E152-R155 WeakPolarHBondContact O-CB 3.43Å; E152-R155 PolarHBondContact O-N 3.42Å; E152-R155 IonicContact OE1-CZ 3.56Å; E152-R155 IonicContact OE1-NE 3.56Å; E152-R155 PolarHBondContact OE1-NE 3.14Å; E152-R155 IonicContact OE1-NH2 2.85Å; E152-R155 PolarHBondContact OE1-NH2 2.65Å; E152-R155 IonicContact OE2-CZ 2.83Å; E152-R155 IonicContact OE2-NE 2.8Å; E152-R155 PolarHBondContact OE2-NE 3.24Å; E152-R155 IonicContact OE2-NH2 3.29Å; E152-Q156 WeakPolarHBondContact O-CG 3.28Å; E152-Q156 PolarHBondContact O-N 3.31Å; E152-Q156 PolarHBondContact OE1-NE2 2.64Å
153	I	71.3	Confident	66.3	Low	55 Å²	55	67.3 Å²	67.3	28%	0.282	35%	0.346	S	S	.	.	H	α-helix	trans	-58	-48.3	171.6	-70.8	166.3	0	0	0	109.7	I35 L37 M149 R155 Q156 F157	I35-I153 HydrophobicContact CD1-CG2 4.17Å; L37-I153 HydrophobicContact CD1-CD1 4.08Å; L37-I153 HydrophobicContact CD2-CB 4.43Å; L37-I153 HydrophobicContact CD2-CD1 3.89Å; L37-I153 HydrophobicContact CD2-CG2 4.26Å; M149-I153 WeakPolarHBondContact O-CB 3.47Å; M149-I153 VanDerWaalsContact O-CG1 3.23Å; M149-I153 WeakPolarHBondContact O-CG1 3.26Å; M149-I153 PolarHBondContact O-N 3.32Å; I153-R155 VanDerWaalsContact C-N 3.3Å; I153-R155 PolarHBondContact O-N 3.02Å; I153-Q156 PolarHBondContact O-N 3Å; I153-Q156 VanDerWaalsContact O-N 3.17Å; I153-F157 HydrophobicContact CG2-CD2 3.55Å; I153-F157 HydrophobicContact CG2-CE2 3.64Å; I153-F157 WeakPolarHBondContact O-CD2 3.33Å; I153-F157 PolarHBondContact O-N 3.21Å
154	R	73.5	Confident	64.5	Low	25 Å²	25	71.3 Å²	71.3	9%	0.094	37%	0.368	C	S	.	.	H	α-helix	trans	-55.4	-47.2	175.5	-174.5	-174.9	-179.8	79.1	1.5	111.3	E33 I35 A60 A150 F151 E152 Q156 F157 L158	E33-R154 PolarHBondContact O-NH1 2.95Å; E33-R154 IonicContact OE2-NH2 3.54Å; E33-R154 PolarHBondContact OE2-NH2 3.49Å; I35-R154 HydrophobicContact CD1-CB 4.04Å; I35-R154 HydrophobicContact CG2-CB 4.3Å; I35-R154 HydrophobicContact CG2-CG 3.98Å; A60-R154 VanDerWaalsContact O-CD 3.32Å; A60-R154 WeakPolarHBondContact O-CD 3.41Å; A60-R154 PolarHBondContact O-NH1 2.92Å; A150-R154 WeakPolarHBondContact O-CB 3.35Å; A150-R154 PolarHBondContact O-N 3.08Å; F151-R154 PolarHBondContact O-N 3.32Å; E152-R154 VanDerWaalsContact C-N 3.33Å; E152-R154 PolarHBondContact O-N 2.74Å; R154-Q156 VanDerWaalsContact C-N 3.3Å; R154-Q156 PolarHBondContact O-N 2.76Å; R154-F157 PolarHBondContact O-N 3.03Å; R154-L158 HydrophobicContact CG-CD1 3.84Å; R154-L158 HydrophobicContact CG-CG 4.23Å; R154-L158 WeakPolarHBondContact O-CB 3.35Å; R154-L158 VanDerWaalsContact O-CG 3.32Å; R154-L158 WeakPolarHBondContact O-CG 3.34Å; R154-L158 PolarHBondContact O-N 2.94Å
155	R	69.1	Low	62.8	Low	92 Å²	92	74.8 Å²	74.8	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-56.1	-46.1	178.6	-171.1	-173.5	74	76	-0.9	111.1	F151 E152 I153 Q159	F151-R155 WeakPolarHBondContact O-CB 3.45Å; F151-R155 PolarHBondContact O-N 3.38Å; E152-R155 WeakPolarHBondContact O-CB 3.43Å; E152-R155 PolarHBondContact O-N 3.42Å; E152-R155 IonicContact OE1-CZ 3.56Å; E152-R155 IonicContact OE1-NE 3.56Å; E152-R155 PolarHBondContact OE1-NE 3.14Å; E152-R155 IonicContact OE1-NH2 2.85Å; E152-R155 PolarHBondContact OE1-NH2 2.65Å; E152-R155 IonicContact OE2-CZ 2.83Å; E152-R155 IonicContact OE2-NE 2.8Å; E152-R155 PolarHBondContact OE2-NE 3.24Å; E152-R155 IonicContact OE2-NH2 3.29Å; I153-R155 VanDerWaalsContact C-N 3.3Å; I153-R155 PolarHBondContact O-N 3.02Å; R155-Q159 VanDerWaalsContact NH1-CD 3.29Å; R155-Q159 VanDerWaalsContact O-CG 3.31Å; R155-Q159 WeakPolarHBondContact O-CG 3.09Å; R155-Q159 PolarHBondContact O-N 3.5Å; R155-Q159 VanDerWaalsContact O-N 3.1Å
156	Q	66.4	Low	60.9	Low	96 Å²	96	80.9 Å²	80.9	45%	0.449	41%	0.409	S	S	.	.	H	α-helix	trans	-67.9	-41.4	179.6	-66.9	177.6	23.2	0	0	112.3	E152 I153 R154 L158 Q159 N160	E152-Q156 WeakPolarHBondContact O-CG 3.28Å; E152-Q156 PolarHBondContact O-N 3.31Å; E152-Q156 PolarHBondContact OE1-NE2 2.64Å; I153-Q156 PolarHBondContact O-N 3Å; I153-Q156 VanDerWaalsContact O-N 3.17Å; R154-Q156 VanDerWaalsContact C-N 3.3Å; R154-Q156 PolarHBondContact O-N 2.76Å; Q156-L158 PolarHBondContact O-N 3.04Å; Q156-Q159 PolarHBondContact O-N 2.92Å; Q156-N160 PolarHBondContact O-N 3.06Å
157	F	67.2	Low	58.9	Low	84 Å²	84	87.4 Å²	87.4	37%	0.368	44%	0.438	S	S	.	.	H	α-helix	trans	-61.9	-42.8	175.3	-92.7	-76	0	0	0	112.7	I35 P36 I153 R154 Q159 N160 S161	I35-F157 HydrophobicContact CG2-CB 4.25Å; P36-F157 HydrophobicContact CG-CD1 4.22Å; P36-F157 HydrophobicContact CG-CE1 3.51Å; P36-F157 HydrophobicContact CG-CE2 4.17Å; P36-F157 HydrophobicContact CG-CZ 3.48Å; P36-F157 VanDerWaalsContact CG-CZ 3.48Å; I153-F157 HydrophobicContact CG2-CD2 3.55Å; I153-F157 HydrophobicContact CG2-CE2 3.64Å; I153-F157 WeakPolarHBondContact O-CD2 3.33Å; I153-F157 PolarHBondContact O-N 3.21Å; R154-F157 PolarHBondContact O-N 3.03Å; F157-Q159 VanDerWaalsContact C-N 3.27Å; F157-Q159 PolarHBondContact O-N 3.27Å; F157-N160 PolarHBondContact O-N 2.7Å; F157-S161 WeakPolarHBondContact O-CB 3.04Å; F157-S161 PolarHBondContact O-N 2.92Å; F157-S161 PolarHBondContact O-OG 2.83Å
158	L	65	Low	57.1	Low	58 Å²	58	90.5 Å²	90.5	30%	0.304	46%	0.455	S	S	.	.	H	α-helix	trans	-71	-22.3	178.2	-68.3	178	0	0	0	113	R154 Q156 S161	R154-L158 HydrophobicContact CG-CD1 3.84Å; R154-L158 HydrophobicContact CG-CG 4.23Å; R154-L158 WeakPolarHBondContact O-CB 3.35Å; R154-L158 VanDerWaalsContact O-CG 3.32Å; R154-L158 WeakPolarHBondContact O-CG 3.34Å; R154-L158 PolarHBondContact O-N 2.94Å; Q156-L158 PolarHBondContact O-N 3.04Å; L158-S161 VanDerWaalsContact O-O 3.04Å
159	Q	58.8	Low	55.1	Low	110 Å²	110	92.2 Å²	92.2	51%	0.514	46%	0.461	S	S	.	.	H	α-helix	trans	-79.7	-36.8	173	-77.2	-177.9	-27.7	0	0	112.7	R155 Q156 F157	R155-Q159 VanDerWaalsContact NH1-CD 3.29Å; R155-Q159 VanDerWaalsContact O-CG 3.31Å; R155-Q159 WeakPolarHBondContact O-CG 3.09Å; R155-Q159 PolarHBondContact O-N 3.5Å; R155-Q159 VanDerWaalsContact O-N 3.1Å; Q156-Q159 PolarHBondContact O-N 2.92Å; F157-Q159 VanDerWaalsContact C-N 3.27Å; F157-Q159 PolarHBondContact O-N 3.27Å
160	N	52.8	Low	53.1	Low	140 Å²	140	97.9 Å²	97.9	75%	0.749	48%	0.484	S	S	*	.	H	α-helix	trans	-80.1	-30.6	-179.2	-75.4	-14.7	0	0	0	113	Q156 F157 Q162	Q156-N160 PolarHBondContact O-N 3.06Å; F157-N160 PolarHBondContact O-N 2.7Å; N160-Q162 PolarHBondContact O-N 2.85Å
161	S	50.5	Low	50.8	Low	61 Å²	61	103.3 Å²	103.3	43%	0.427	52%	0.517	S	S	.	.	S	Bend	trans	-71	123.1	164.3	-48.4	0	0	0	0	105.9	F157 L158 V163	F157-S161 WeakPolarHBondContact O-CB 3.04Å; F157-S161 PolarHBondContact O-N 2.92Å; F157-S161 PolarHBondContact O-OG 2.83Å; L158-S161 VanDerWaalsContact O-O 3.04Å; S161-V163 PolarHBondContact O-N 2.8Å
162	Q	40.8	Very low	49.2	Very low	194 Å²	194	104.9 Å²	104.9	91%	0.907	53%	0.528	S	S	*	.			trans	-65.8	44.6	176.5	-72.3	-176.7	-24.7	0	0	113.4	N160 N164	N160-Q162 PolarHBondContact O-N 2.85Å; Q162-N164 PolarHBondContact O-N 3.36Å
163	V	40	Very low	47.6	Very low	77 Å²	77	105.5 Å²	105.5	47%	0.467	54%	0.54	S	S	.	.			trans	-75.1	89.5	154.9	-175.6	0	0	0	0	104.4	S161 L165	S161-V163 PolarHBondContact O-N 2.8Å; V163-L165 VanDerWaalsContact C-N 3.25Å; V163-L165 PolarHBondContact O-N 2.94Å
164	N	31.1	Very low	46.5	Very low	89 Å²	89	107.2 Å²	107.2	48%	0.476	56%	0.556	S	S	.	*			trans	-44.7	95.2	166.9	-87.7	-40.6	0	0	0	109.3	Q162 H166	Q162-N164 PolarHBondContact O-N 3.36Å; N164-H166 HydrophobicContact CB-CB 4.19Å; N164-H166 VanDerWaalsContact CG-CD2 3.4Å; N164-H166 PolarHBondContact O-N 3.29Å; N164-H166 PolarHBondContact OD1-CD2 3.42Å
165	L	35.5	Very low	45.6	Very low	137 Å²	137	112.4 Å²	112.4	72%	0.717	59%	0.586	S	S	*	*			trans	-68.6	50.4	145.1	-74.8	159.8	0	0	0	106.8	V163 M167	V163-L165 VanDerWaalsContact C-N 3.25Å; V163-L165 PolarHBondContact O-N 2.94Å; L165-M167 VanDerWaalsContact C-N 3.29Å; L165-M167 PolarHBondContact O-N 3.38Å
166	H	30.8	Very low	46.1	Very low	145 Å²	145	114.6 Å²	114.6	67%	0.671	60%	0.6	S	S	*	*			trans	-62.9	109.7	158.9	-101.9	-64.8	0	0	0	104	N164 V168	N164-H166 HydrophobicContact CB-CB 4.19Å; N164-H166 VanDerWaalsContact CG-CD2 3.4Å; N164-H166 PolarHBondContact O-N 3.29Å; N164-H166 PolarHBondContact OD1-CD2 3.42Å; H166-V168 PolarHBondContact O-N 2.76Å
167	M	33.2	Very low	47.2	Very low	152 Å²	152	111.5 Å²	111.5	75%	0.749	59%	0.585	S	S	*	*			trans	-21.1	125.2	162.4	-66	-172	167	0	0	109.9	L165 D169	L165-M167 VanDerWaalsContact C-N 3.29Å; L165-M167 PolarHBondContact O-N 3.38Å; M167-D169 PolarHBondContact O-N 2.77Å
168	V	36.4	Very low	48.5	Very low	79 Å²	79	110.4 Å²	110.4	48%	0.479	58%	0.581	S	S	.	*			trans	-32.9	117.7	162.3	172.9	0	0	0	0	108	H166 K170	H166-V168 PolarHBondContact O-N 2.76Å; V168-K170 PolarHBondContact O-N 3.33Å
169	D	31.6	Very low	49.9	Very low	126 Å²	126	108.3 Å²	108.3	67%	0.674	57%	0.572	S	S	*	*			trans	-38.8	110.9	172.4	-96.3	-35.8	0	0	0	109.5	M167 T171	M167-D169 PolarHBondContact O-N 2.77Å; D169-T171 WeakPolarHBondContact CB-OG1 3.44Å; D169-T171 PolarHBondContact O-N 3.32Å
170	K	35	Very low	51.6	Low	193 Å²	193	103.5 Å²	103.5	84%	0.839	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	23.5	174.2	-78.8	-174.6	174.9	178.7	0	111.9	V168	V168-K170 PolarHBondContact O-N 3.33Å
171	T	31.5	Very low	53.4	Low	116 Å²	116	98 Å²	98	71%	0.712	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	13.6	-171.2	45.8	0	0	0	0	113.7	D169	D169-T171 WeakPolarHBondContact CB-OG1 3.44Å; D169-T171 PolarHBondContact O-N 3.32Å
172	I	39.5	Very low	55.2	Low	105 Å²	105	95.9 Å²	95.9	54%	0.538	51%	0.505	S	S	.	.	S	Bend	trans	-102.4	126.6	167.6	-54	175.7	0	0	0	107.2	S174	I172-S174 PolarHBondContact O-N 3.46Å
173	S	39.3	Very low	57.2	Low	82 Å²	82	92.2 Å²	92.2	57%	0.573	48%	0.484	S	S	*	.			trans	-43.8	133.6	-177.3	63.4	0	0	0	0	111.4	D175 Q176	S173-D175 PolarHBondContact O-N 3.19Å; S173-Q176 PolarHBondContact O-N 3.41Å
174	S	48.3	Very low	59.4	Low	90 Å²	90	92.6 Å²	92.6	63%	0.629	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-6.8	-170.6	57.2	0	0	0	0	116.5	I172	I172-S174 PolarHBondContact O-N 3.46Å
175	D	54	Low	62.3	Low	135 Å²	135	90.5 Å²	90.5	72%	0.722	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-1.6	-165.6	-61.8	-4.7	0	0	0	113.4	S173	S173-D175 PolarHBondContact O-N 3.19Å
176	Q	79.7	Confident	64.7	Low	138 Å²	138	87.8 Å²	87.8	65%	0.645	46%	0.456	S	S	*	.			trans	-110.4	122.2	174.6	-77.5	-168.2	-6	0	0	112.4	S173	S173-Q176 PolarHBondContact O-N 3.41Å
177	W	90.7	Very high	67.4	Low	31 Å²	31	82.4 Å²	82.4	12%	0.117	43%	0.43	C	S	.	.			trans	-65.3	159.8	168.3	58.1	-66.4	0	0	0	112.1	L316 F319 R324 I327 F448 F477 R478 I480	W177-L316 HydrophobicContact CD2-CD1 4.24Å; W177-L316 HydrophobicContact CE3-CD1 4.43Å; W177-L316 WeakPolarHBondContact O-CD1 3.36Å; W177-F319 HydrophobicContact CH2-CD1 4.28Å; W177-F319 AromaticContact CH2-CD2 3.61Å; W177-F319 HydrophobicContact CH2-CD2 3.61Å; W177-F319 HydrophobicContact CH2-CE1 4.25Å; W177-F319 AromaticContact CH2-CE2 3.6Å; W177-F319 HydrophobicContact CH2-CE2 3.6Å; W177-F319 AromaticContact CH2-CG 3.95Å; W177-F319 HydrophobicContact CH2-CG 3.95Å; W177-F319 AromaticContact CH2-CZ 3.92Å; W177-F319 HydrophobicContact CH2-CZ 3.92Å; W177-F319 HydrophobicContact CZ2-CD2 4.39Å; W177-F319 HydrophobicContact CZ3-CD2 4.16Å; W177-F319 AromaticContact CZ3-CE2 3.7Å; W177-F319 HydrophobicContact CZ3-CE2 3.7Å; W177-F319 AromaticContact CZ3-CZ 3.98Å; W177-F319 HydrophobicContact CZ3-CZ 3.98Å; W177-R324 HydrophobicContact CZ2-CG 4.19Å; W177-I327 HydrophobicContact CH2-CD1 3.39Å; W177-I327 HydrophobicContact CH2-CG2 4.27Å; W177-I327 HydrophobicContact CZ2-CD1 4.05Å; W177-I327 HydrophobicContact CZ2-CG2 4.38Å; W177-I327 HydrophobicContact CZ3-CD1 4.2Å; W177-F448 HydrophobicContact CH2-CE1 4.14Å; W177-F448 AromaticContact CZ3-CD1 3.92Å; W177-F448 HydrophobicContact CZ3-CD1 3.92Å; W177-F448 AromaticContact CZ3-CE1 3.66Å; W177-F448 HydrophobicContact CZ3-CE1 3.66Å; W177-F477 HydrophobicContact CE3-CB 3.89Å; W177-F477 HydrophobicContact CE3-CD1 4.14Å; W177-F477 HydrophobicContact CE3-CG 4.25Å; W177-F477 HydrophobicContact CZ3-CB 4Å; W177-F477 AromaticContact CZ3-CD1 3.86Å; W177-F477 HydrophobicContact CZ3-CD1 3.86Å; W177-F477 AromaticContact CZ3-CG 3.95Å; W177-F477 HydrophobicContact CZ3-CG 3.95Å; W177-R478 CarbonylContact C-O 3.58Å; W177-R478 WeakPolarHBondContact CA-O 3.37Å; W177-R478 WeakPolarHBondContact CB-O 3.46Å; W177-I480 HydrophobicContact CB-CD1 3.25Å; W177-I480 HydrophobicContact CD2-CD1 3.33Å; W177-I480 HydrophobicContact CE3-CD1 3.15Å; W177-I480 HydrophobicContact CG-CD1 3.45Å; W177-I480 VanDerWaalsContact CG-CD1 3.45Å; W177-I480 HydrophobicContact CZ3-CD1 4Å
178	Q	93.4	Very high	70.1	Confident	61 Å²	61	77.7 Å²	77.7	29%	0.285	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	153.3	-172.4	59.3	-172.6	-58.6	0	0	111.9	F477 R478	Q178-F477 CarbonylContact O-C 3.6Å; Q178-F477 WeakPolarHBondContact O-CA 3.33Å; Q178-R478 HydrophobicContact CG-CG 3.51Å; Q178-R478 PolarHBondContact N-O 2.99Å; Q178-R478 VanDerWaalsContact NE2-NH2 3.16Å; Q178-R478 PolarHBondContact O-N 3.48Å
179	A	94.6	Very high	72.8	Confident	14 Å²	14	80.1 Å²	80.1	12%	0.116	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.7	171.7	0	0	0	0	0	110.9	L181 L313 F477	A179-L181 HydrophobicContact CB-CD2 4.4Å; A179-L181 HydrophobicContact CB-CG 4.21Å; A179-L313 HydrophobicContact CB-CB 4.15Å; A179-L313 HydrophobicContact CB-CD2 4.34Å; A179-L313 WeakPolarHBondContact CB-O 3.43Å; A179-F477 HydrophobicContact CB-CD1 4Å; A179-F477 HydrophobicContact CB-CE1 3.87Å
180	V	94.1	Very high	75.7	Confident	9 Å²	9	74.4 Å²	74.4	6%	0.055	39%	0.391	C	S	.	.			trans	-95.2	102	176.4	-169.2	0	0	0	0	109.2	Y449 F458 L463 H465 V476 R478	V180-Y449 HydrophobicContact CG2-CE1 4.02Å; V180-F458 WeakPolarHBondContact CG1-O 3.12Å; V180-L463 HydrophobicContact CG1-CD1 4.17Å; V180-H465 PolarHBondContact O-NE2 3.15Å; V180-V476 HydrophobicContact CB-CB 4.19Å; V180-V476 HydrophobicContact CB-CG1 4.17Å; V180-V476 HydrophobicContact CG2-CB 4.45Å; V180-V476 HydrophobicContact CG2-CG1 3.95Å; V180-V476 PolarHBondContact N-O 2.97Å; V180-R478 HydrophobicContact CG2-CB 3.77Å; V180-R478 HydrophobicContact CG2-CG 3.79Å
181	L	91.5	Very high	78.5	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	37%	0.368	C	S	.	.			trans	-110.3	154.8	-173.1	-61.5	174.2	0	0	0	111.9	A179 Y185 L313 I314	A179-L181 HydrophobicContact CB-CD2 4.4Å; A179-L181 HydrophobicContact CB-CG 4.21Å; L181-Y185 HydrophobicContact CB-CD2 4.4Å; L181-L313 HydrophobicContact CD2-CB 4.36Å; L181-L313 HydrophobicContact CD2-CD1 4.1Å; L181-I314 HydrophobicContact CD1-CD1 4.21Å; L181-I314 HydrophobicContact CD1-CG1 3.47Å; L181-I314 VanDerWaalsContact CD1-CG1 3.47Å
182	P	87.3	Confident	81.4	Confident	17 Å²	17	66.2 Å²	66.2	11%	0.11	35%	0.354	C	S	.	.			trans	-54	146.7	169	-24.9	31.1	0	0	0	113.4	K184 Y185 L463 Q466	P182-K184 HydrophobicContact CB-CG 4.1Å; P182-K184 PolarHBondContact O-N 3.48Å; P182-Y185 HydrophobicContact CB-CD2 3.95Å; P182-Y185 HydrophobicContact CB-CE2 4.17Å; P182-Y185 HydrophobicContact CG-CD2 4.02Å; P182-Y185 HydrophobicContact CG-CE2 3.96Å; P182-Y185 PolarHBondContact O-N 3.17Å; P182-L463 VanDerWaalsContact CA-CD2 3.49Å; P182-L463 HydrophobicContact CB-CD2 3.8Å; P182-L463 HydrophobicContact CG-CD2 3.72Å; P182-Q466 HydrophobicContact CG-CB 3.99Å; P182-Q466 HydrophobicContact CG-CG 4.09Å
183	Y	83.8	Confident	84.1	Confident	117 Å²	117	64.1 Å²	64.1	46%	0.459	34%	0.34	S	S	.	.	H	α-helix	trans	-50.9	-36.8	-177.8	177	-104.5	0	0	0	113.6	Y185 C186 R187	Y183-Y185 PolarHBondContact O-N 3.32Å; Y183-C186 PolarHBondContact O-N 3.1Å; Y183-R187 HydrophobicContact CE2-CB 4.48Å; Y183-R187 PolarHBondContact O-N 2.82Å
184	K	86.6	Confident	86.7	Confident	85 Å²	85	62.6 Å²	62.6	37%	0.37	32%	0.324	S	S	.	.	H	α-helix	trans	-55.4	-24.2	177.3	67.5	-175.6	177.6	-171.1	0	114.2	P182 L288 Q292	P182-K184 HydrophobicContact CB-CG 4.1Å; P182-K184 PolarHBondContact O-N 3.48Å; K184-L288 HydrophobicContact CB-CD1 4.02Å; K184-L288 HydrophobicContact CD-CD1 4.04Å; K184-L288 HydrophobicContact CG-CD1 3.92Å; K184-Q292 PolarHBondContact O-NE2 3.12Å
185	Y	91.1	Very high	88.8	Confident	45 Å²	45	58.3 Å²	58.3	18%	0.176	29%	0.294	C	S	.	.	H	α-helix	trans	-93.9	-23.4	175.7	-58.5	-69.3	0	0	0	113.5	L181 P182 Y183 L288 T289 I310	L181-Y185 HydrophobicContact CB-CD2 4.4Å; P182-Y185 HydrophobicContact CB-CD2 3.95Å; P182-Y185 HydrophobicContact CB-CE2 4.17Å; P182-Y185 HydrophobicContact CG-CD2 4.02Å; P182-Y185 HydrophobicContact CG-CE2 3.96Å; P182-Y185 PolarHBondContact O-N 3.17Å; Y183-Y185 PolarHBondContact O-N 3.32Å; Y185-L288 HydrophobicContact CD1-CB 3.85Å; Y185-L288 HydrophobicContact CD1-CD1 4.1Å; Y185-L288 HydrophobicContact CE1-CB 3.92Å; Y185-L288 HydrophobicContact CE1-CD1 3.86Å; Y185-L288 HydrophobicContact CE1-CG 4.43Å; Y185-T289 HydrophobicContact CD1-CG2 4.16Å; Y185-T289 WeakPolarHBondContact O-CG2 3.36Å; Y185-I310 HydrophobicContact CD1-CG2 3.76Å; Y185-I310 HydrophobicContact CE1-CD1 4.28Å; Y185-I310 HydrophobicContact CE1-CG1 4.08Å; Y185-I310 HydrophobicContact CE1-CG2 4.11Å; Y185-I310 HydrophobicContact CE2-CD1 4.32Å; Y185-I310 HydrophobicContact CG-CG2 4.22Å
186	C	86.4	Confident	90.4	Very high	80 Å²	80	53.2 Å²	53.2	54%	0.541	26%	0.264	S	S	.	.	H	α-helix	trans	-86.2	-28.8	-171.9	-58.4	0	0	0	0	113.1	Y183 A188	Y183-C186 PolarHBondContact O-N 3.1Å; C186-A188 PolarHBondContact O-N 3.2Å
187	R	88	Confident	90.9	Very high	33 Å²	33	47.1 Å²	47.1	13%	0.125	24%	0.236	C	C	.	.			trans	-65.8	134.9	179.9	65.7	-176.8	179.3	-177.1	-1.7	111.4	Y183 Q189 P191 E285 Q292	Y183-R187 HydrophobicContact CE2-CB 4.48Å; Y183-R187 PolarHBondContact O-N 2.82Å; R187-Q189 WeakPolarHBondContact CD-O 3.28Å; R187-P191 VanDerWaalsContact NH1-CD 3.32Å; R187-E285 IonicContact CZ-OE1 2.57Å; R187-E285 IonicContact CZ-OE2 2.73Å; R187-E285 IonicContact NH1-OE1 3.04Å; R187-E285 PolarHBondContact NH1-OE1 3.37Å; R187-E285 IonicContact NH1-OE2 3.53Å; R187-E285 IonicContact NH2-OE1 2.84Å; R187-E285 PolarHBondContact NH2-OE1 3.41Å; R187-E285 IonicContact NH2-OE2 3.75Å; R187-E285 PolarHBondContact NH2-OE2 2.95Å; R187-Q292 WeakPolarHBondContact O-CG 3.32Å; R187-Q292 PolarHBondContact O-NE2 3.09Å
188	A	89.6	Confident	90.6	Very high	52 Å²	52	46 Å²	46	43%	0.43	23%	0.232	S	C	.	.	S	Bend	trans	-79.9	-33.2	175.9	0	0	0	0	0	112.4	C186 V291	C186-A188 PolarHBondContact O-N 3.2Å; A188-V291 HydrophobicContact CB-CG1 4.06Å
189	Q	92.7	Very high	90.3	Very high	130 Å²	130	45.5 Å²	45.5	61%	0.607	23%	0.227	S	C	*	.	S	Bend	trans	-110.4	144.3	-177.8	-54.4	-172.5	-3.7	0	0	110.2	R187 W295	R187-Q189 WeakPolarHBondContact CD-O 3.28Å; Q189-W295 HydrophobicContact CB-CD2 4.07Å; Q189-W295 HydrophobicContact CB-CE3 4.49Å; Q189-W295 HydrophobicContact CB-CH2 4.35Å; Q189-W295 HydrophobicContact CB-CZ2 3.88Å; Q189-W295 HydrophobicContact CG-CD2 4.14Å; Q189-W295 HydrophobicContact CG-CG 4.2Å; Q189-W295 HydrophobicContact CG-CZ2 4.24Å
190	L	92.7	Very high	89.8	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-99.7	151.4	176.1	-55	173.1	0	0	0	109.4	P283 E285 P287 Q292 W295 A296	L190-P283 HydrophobicContact CB-CB 4.49Å; L190-P283 HydrophobicContact CD1-CB 4.26Å; L190-E285 WeakPolarHBondContact CD1-O 3.18Å; L190-P287 HydrophobicContact CD1-CB 4.1Å; L190-Q292 HydrophobicContact CD1-CB 4.46Å; L190-Q292 HydrophobicContact CD2-CB 4.27Å; L190-Q292 HydrophobicContact CD2-CG 4.01Å; L190-Q292 HydrophobicContact CG-CB 4.4Å; L190-W295 HydrophobicContact CB-CE3 4.31Å; L190-W295 HydrophobicContact CB-CZ3 3.71Å; L190-W295 HydrophobicContact CG-CE3 4.37Å; L190-W295 HydrophobicContact CG-CZ3 4.24Å; L190-W295 WeakPolarHBondContact O-CH2 3.31Å; L190-W295 WeakPolarHBondContact O-CZ3 3.3Å; L190-A296 HydrophobicContact CD1-CB 4.12Å
191	P	92.7	Very high	89.4	Confident	56 Å²	56	49 Å²	49	36%	0.364	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-59.1	144.5	172.8	24.2	-31.7	0	0	0	110.2	R187 A284 E285	R187-P191 VanDerWaalsContact NH1-CD 3.32Å; P191-A284 HydrophobicContact CG-CB 4.35Å; P191-A284 WeakPolarHBondContact O-CB 3.44Å; P191-A284 PolarHBondContact O-N 2.83Å; P191-E285 HydrophobicContact CG-CG 4.08Å; P191-E285 WeakPolarHBondContact CG-OE1 3.38Å
192	L	94.2	Very high	89	Confident	81 Å²	81	50.2 Å²	50.2	42%	0.424	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	147.7	176.8	-66	175.7	0	0	0	110.2	F281 V282 W295 V299	L192-F281 HydrophobicContact CB-CB 4.15Å; L192-F281 HydrophobicContact CB-CD1 4.1Å; L192-F281 HydrophobicContact CD1-CB 4.12Å; L192-V282 CarbonylContact C-O 3.57Å; L192-V282 WeakPolarHBondContact CA-O 3.2Å; L192-W295 HydrophobicContact CD2-CH2 3.68Å; L192-W295 HydrophobicContact CD2-CZ2 4.5Å; L192-W295 HydrophobicContact CD2-CZ3 4.43Å; L192-W295 HydrophobicContact CG-CH2 4.1Å; L192-V299 HydrophobicContact CD2-CG1 3.88Å
193	R	94.5	Very high	88.8	Confident	60 Å²	60	54.1 Å²	54.1	23%	0.226	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.7	170.7	-172.3	170.9	-171.2	-177.3	0.8	109.4	F195 D247 F281 V282 A284	R193-F195 HydrophobicContact CB-CD2 4.37Å; R193-F195 HydrophobicContact CB-CE2 4.07Å; R193-F195 HydrophobicContact CG-CD2 4.3Å; R193-F195 HydrophobicContact CG-CE2 4Å; R193-D247 IonicContact CZ-OD1 3.12Å; R193-D247 IonicContact CZ-OD2 3.36Å; R193-D247 IonicContact NE-OD1 3.33Å; R193-D247 PolarHBondContact NE-OD1 3.05Å; R193-D247 VanDerWaalsContact NE-OD1 3.07Å; R193-D247 IonicContact NE-OD2 2.74Å; R193-D247 VanDerWaalsContact NH2-CG 3.28Å; R193-D247 IonicContact NH2-OD1 3.71Å; R193-D247 PolarHBondContact NH2-OD1 2.9Å; R193-D247 IonicContact NH2-OD2 2.68Å; R193-D247 PolarHBondContact NH2-OD2 2.98Å; R193-F281 WeakPolarHBondContact O-CA 3.46Å; R193-V282 PolarHBondContact N-O 2.99Å; R193-V282 PolarHBondContact O-N 3.44Å; R193-A284 HydrophobicContact CB-CB 3.8Å
194	E	94.5	Very high	88.7	Confident	51 Å²	51	57.6 Å²	57.6	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.6	177.6	-172.6	-179.6	-105.5	0	0	110.2	P245 S246 K279 T280 F281	E194-P245 WeakPolarHBondContact O-CA 3.45Å; E194-S246 WeakPolarHBondContact CB-OG 3.42Å; E194-S246 WeakPolarHBondContact CG-OG 3.15Å; E194-S246 PolarHBondContact O-N 3.29Å; E194-S246 PolarHBondContact O-OG 3.22Å; E194-S246 VanDerWaalsContact OE2-CB 3.26Å; E194-S246 WeakPolarHBondContact OE2-CB 3.41Å; E194-S246 PolarHBondContact OE2-OG 3.21Å; E194-K279 HydrophobicContact CG-CB 4.16Å; E194-K279 HydrophobicContact CG-CD 4.47Å; E194-K279 HydrophobicContact CG-CG 4.47Å; E194-K279 WeakPolarHBondContact OE2-CD 3.26Å; E194-K279 WeakPolarHBondContact OE2-CE 3.44Å; E194-K279 IonicContact OE2-NZ 3.71Å; E194-K279 PolarHBondContact OE2-NZ 3.46Å; E194-T280 CarbonylContact C-O 3.52Å; E194-T280 WeakPolarHBondContact CA-O 3.36Å; E194-F281 HydrophobicContact CB-CD1 4.12Å; E194-F281 HydrophobicContact CB-CE1 3.76Å; E194-F281 HydrophobicContact CB-CZ 4.06Å; E194-F281 HydrophobicContact CG-CZ 4.38Å
195	F	92.9	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.7	177.7	-87.2	-117.2	0	0	0	110.1	R193 F222 L225 L242 W244 P245 K279 T280 V282	R193-F195 HydrophobicContact CB-CD2 4.37Å; R193-F195 HydrophobicContact CB-CE2 4.07Å; R193-F195 HydrophobicContact CG-CD2 4.3Å; R193-F195 HydrophobicContact CG-CE2 4Å; F195-F222 HydrophobicContact CE1-CD2 4.33Å; F195-F222 HydrophobicContact CE1-CE2 4.41Å; F195-F222 HydrophobicContact CE1-CG 4.47Å; F195-F222 AromaticContact CZ-CD1 3.92Å; F195-F222 HydrophobicContact CZ-CD1 3.92Å; F195-F222 HydrophobicContact CZ-CD2 4.21Å; F195-F222 AromaticContact CZ-CE1 3.81Å; F195-F222 HydrophobicContact CZ-CE1 3.81Å; F195-F222 HydrophobicContact CZ-CE2 4.09Å; F195-F222 HydrophobicContact CZ-CG 4.14Å; F195-F222 AromaticContact CZ-CZ 3.89Å; F195-F222 HydrophobicContact CZ-CZ 3.89Å; F195-L225 HydrophobicContact CE1-CD1 4.26Å; F195-L225 HydrophobicContact CE2-CD1 4.5Å; F195-L225 HydrophobicContact CZ-CD1 4Å; F195-L242 HydrophobicContact CB-CD1 3.64Å; F195-L242 HydrophobicContact CB-CG 4.31Å; F195-L242 HydrophobicContact CD1-CD1 4.17Å; F195-L242 HydrophobicContact CD1-CD2 4.01Å; F195-L242 HydrophobicContact CD1-CG 3.88Å; F195-L242 HydrophobicContact CE1-CD2 4.39Å; F195-L242 HydrophobicContact CG-CD1 4.2Å; F195-L242 HydrophobicContact CG-CD2 4.49Å; F195-L242 HydrophobicContact CG-CG 4.4Å; F195-W244 CarbonylContact C-O 3.57Å; F195-W244 VanDerWaalsContact CA-O 3.32Å; F195-W244 WeakPolarHBondContact CA-O 3.46Å; F195-P245 HydrophobicContact CD1-CG 4.39Å; F195-P245 HydrophobicContact CD2-CB 4.46Å; F195-P245 HydrophobicContact CD2-CG 4.41Å; F195-P245 VanDerWaalsContact CE1-CD 3.47Å; F195-P245 HydrophobicContact CE1-CG 3.8Å; F195-P245 HydrophobicContact CE2-CB 4.24Å; F195-P245 HydrophobicContact CE2-CG 3.82Å; F195-P245 HydrophobicContact CZ-CB 4.36Å; F195-P245 HydrophobicContact CZ-CG 3.49Å; F195-P245 VanDerWaalsContact CZ-CG 3.49Å; F195-K279 CarbonylContact O-C 3.51Å; F195-K279 WeakPolarHBondContact O-CA 3.43Å; F195-T280 PolarHBondContact N-O 3.41Å; F195-T280 PolarHBondContact O-N 2.8Å; F195-V282 HydrophobicContact CB-CG2 4.31Å; F195-V282 HydrophobicContact CD2-CG2 3.32Å; F195-V282 HydrophobicContact CE2-CG2 3.6Å; F195-V282 HydrophobicContact CG-CG2 3.82Å; F195-V282 HydrophobicContact CZ-CG2 4.3Å
196	Y	88.3	Confident	88	Confident	28 Å²	28	52.2 Å²	52.2	11%	0.11	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	143.6	162.1	-69.4	-71.8	0	0	0	110.4	L243 W244 S246 L249 L254 L277 L278 K279	Y196-L243 VanDerWaalsContact O-CB 3.32Å; Y196-L243 WeakPolarHBondContact O-CB 3.23Å; Y196-L243 PolarHBondContact O-N 2.72Å; Y196-W244 PolarHBondContact N-O 2.96Å; Y196-S246 VanDerWaalsContact CE2-CA 3.42Å; Y196-S246 VanDerWaalsContact CE2-CB 3.5Å; Y196-L249 HydrophobicContact CD2-CD1 3.92Å; Y196-L249 HydrophobicContact CE2-CB 4.3Å; Y196-L249 HydrophobicContact CE2-CD1 4.49Å; Y196-L254 HydrophobicContact CD1-CD1 4.4Å; Y196-L254 HydrophobicContact CD2-CD1 3.69Å; Y196-L254 HydrophobicContact CE1-CD1 4.06Å; Y196-L254 HydrophobicContact CE2-CD1 3.26Å; Y196-L254 HydrophobicContact CG-CD1 4.24Å; Y196-L254 VanDerWaalsContact CZ-CD1 3.48Å; Y196-L277 HydrophobicContact CD1-CD2 4.39Å; Y196-L277 HydrophobicContact CD1-CG 4.25Å; Y196-L278 CarbonylContact C-O 3.58Å; Y196-L278 VanDerWaalsContact CA-O 3.3Å; Y196-L278 WeakPolarHBondContact CA-O 3.31Å; Y196-K279 HydrophobicContact CD1-CG 3.72Å; Y196-K279 HydrophobicContact CE1-CD 3.99Å; Y196-K279 HydrophobicContact CE1-CG 3.55Å; Y196-K279 WeakPolarHBondContact OH-CE 3.49Å
197	F	89.6	Confident	87.9	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.1	169.1	78.6	-84.3	0	0	0	110.7	R199 D240 I241 L242 L278 T280	F197-R199 HydrophobicContact CE2-CB 4.06Å; F197-D240 HydrophobicContact CD2-CB 3.61Å; F197-D240 HydrophobicContact CE2-CB 3.87Å; F197-D240 WeakPolarHBondContact CE2-OD1 3.47Å; F197-I241 CarbonylContact C-O 3.11Å; F197-I241 VanDerWaalsContact CA-O 3.23Å; F197-I241 WeakPolarHBondContact CA-O 3.46Å; F197-I241 WeakPolarHBondContact CB-O 3.23Å; F197-L242 HydrophobicContact CB-CD1 4.15Å; F197-L278 HydrophobicContact CD1-CB 3.9Å; F197-L278 WeakPolarHBondContact CD1-O 3.29Å; F197-L278 HydrophobicContact CE1-CB 3.29Å; F197-L278 HydrophobicContact CE1-CD1 4.32Å; F197-L278 HydrophobicContact CE1-CG 4.44Å; F197-L278 HydrophobicContact CE2-CB 4.13Å; F197-L278 HydrophobicContact CE2-CD1 4.06Å; F197-L278 HydrophobicContact CZ-CB 3.44Å; F197-L278 VanDerWaalsContact CZ-CB 3.44Å; F197-L278 HydrophobicContact CZ-CD1 3.59Å; F197-L278 HydrophobicContact CZ-CG 4.15Å; F197-L278 PolarHBondContact N-O 2.91Å; F197-L278 PolarHBondContact O-N 2.82Å; F197-T280 HydrophobicContact CD1-CG2 3.68Å; F197-T280 HydrophobicContact CE1-CG2 4.18Å; F197-T280 HydrophobicContact CG-CG2 4.43Å
198	F	84.1	Confident	87.6	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.3	177.3	170.8	-96.1	0	0	0	109.6	T200 I205 I241 L243 I261 L272 T275	F198-T200 HydrophobicContact CD1-CG2 4.45Å; F198-T200 HydrophobicContact CE1-CG2 3.96Å; F198-I205 HydrophobicContact CE1-CD1 3.88Å; F198-I205 HydrophobicContact CZ-CD1 4.04Å; F198-I241 HydrophobicContact CB-CB 4.42Å; F198-I241 HydrophobicContact CD1-CB 4.39Å; F198-I241 HydrophobicContact CD1-CD1 3.96Å; F198-I241 HydrophobicContact CD1-CG1 4.3Å; F198-I241 HydrophobicContact CE1-CD1 4.34Å; F198-I241 PolarHBondContact N-O 3.33Å; F198-I241 PolarHBondContact O-N 3.37Å; F198-L243 HydrophobicContact CB-CD1 4.17Å; F198-L243 HydrophobicContact CB-CD2 4.23Å; F198-L243 HydrophobicContact CB-CG 4.37Å; F198-I261 HydrophobicContact CD2-CD1 4.14Å; F198-I261 HydrophobicContact CD2-CG2 4.48Å; F198-I261 HydrophobicContact CE2-CD1 4.35Å; F198-I261 HydrophobicContact CE2-CG2 3.8Å; F198-I261 HydrophobicContact CG-CD1 4.37Å; F198-I261 HydrophobicContact CZ-CG2 4.11Å; F198-L272 HydrophobicContact CE2-CD2 4.18Å; F198-L272 HydrophobicContact CZ-CD2 3.91Å; F198-T275 HydrophobicContact CD2-CG2 4.1Å; F198-T275 HydrophobicContact CE1-CG2 4.15Å; F198-T275 VanDerWaalsContact CE2-CB 3.45Å; F198-T275 HydrophobicContact CE2-CG2 3.16Å; F198-T275 HydrophobicContact CZ-CG2 3.21Å
199	R	87.5	Confident	87.1	Confident	50 Å²	50	51 Å²	51	19%	0.189	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.4	177.3	178.1	167.5	-73.1	-171.7	-1.7	111.3	F197 E233 Y238 F239 D240 L276	F197-R199 HydrophobicContact CE2-CB 4.06Å; R199-E233 IonicContact NH1-OE1 3.23Å; R199-Y238 HydrophobicContact CG-CD1 3.79Å; R199-Y238 HydrophobicContact CG-CG 4.31Å; R199-F239 WeakPolarHBondContact CA-O 3.37Å; R199-D240 IonicContact CZ-OD1 3.12Å; R199-D240 IonicContact CZ-OD2 2.7Å; R199-D240 IonicContact NE-OD1 2.66Å; R199-D240 PolarHBondContact NE-OD1 3Å; R199-D240 IonicContact NH2-OD1 3.27Å; R199-D240 PolarHBondContact NH2-OD1 3.02Å; R199-D240 VanDerWaalsContact NH2-OD1 3.12Å; R199-D240 IonicContact NH2-OD2 2.6Å; R199-D240 PolarHBondContact NH2-OD2 3.15Å; R199-L276 PolarHBondContact N-O 3.39Å
200	T	83.4	Confident	86.6	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.055	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.7	173.1	-176.9	0	0	0	0	112.2	F198 E202 I205 V206 Y238 F239	F198-T200 HydrophobicContact CD1-CG2 4.45Å; F198-T200 HydrophobicContact CE1-CG2 3.96Å; T200-E202 PolarHBondContact OG1-N 2.96Å; T200-I205 HydrophobicContact CG2-CD1 3.93Å; T200-I205 HydrophobicContact CG2-CG1 3.98Å; T200-I205 WeakPolarHBondContact OG1-CD1 3.34Å; T200-V206 HydrophobicContact CG2-CG2 4.47Å; T200-Y238 CarbonylContact O-C 3.5Å; T200-Y238 WeakPolarHBondContact O-CA 3.47Å; T200-F239 HydrophobicContact CG2-CB 4.02Å; T200-F239 PolarHBondContact N-O 3.46Å; T200-F239 PolarHBondContact O-N 2.96Å
201	V	85.6	Confident	86.1	Confident	88 Å²	88	51.6 Å²	51.6	53%	0.533	26%	0.264	S	S	.	.	S	Bend	trans	-93.7	-15.3	168.6	-68	0	0	0	0	112.6	Y238	V201-Y238 HydrophobicContact CG1-CD1 3.46Å; V201-Y238 VanDerWaalsContact CG1-CD1 3.46Å; V201-Y238 HydrophobicContact CG1-CE1 3.29Å; V201-Y238 HydrophobicContact CG1-CG 4.4Å
202	E	82.8	Confident	85.4	Confident	48 Å²	48	51.2 Å²	51.2	22%	0.224	26%	0.258	C	S	.	.			trans	-90.3	112.4	-173.8	-178.2	51.5	-102.7	0	0	110.6	T200 R204 I205 I270	T200-E202 PolarHBondContact OG1-N 2.96Å; E202-R204 VanDerWaalsContact C-N 3.27Å; E202-R204 HydrophobicContact CG-CB 4.13Å; E202-R204 PolarHBondContact O-N 3.17Å; E202-R204 VanDerWaalsContact OE1-CB 3.26Å; E202-R204 WeakPolarHBondContact OE1-CB 3.47Å; E202-R204 VanDerWaalsContact OE1-CG 3.31Å; E202-R204 WeakPolarHBondContact OE1-CG 3.41Å; E202-R204 IonicContact OE1-CZ 3.79Å; E202-R204 PolarHBondContact OE1-N 3.41Å; E202-R204 IonicContact OE1-NE 2.91Å; E202-R204 PolarHBondContact OE1-NE 3.43Å; E202-R204 IonicContact OE1-NH2 3.79Å; E202-R204 IonicContact OE2-CZ 3.6Å; E202-R204 IonicContact OE2-NE 3.44Å; E202-R204 PolarHBondContact OE2-NE 2.99Å; E202-R204 IonicContact OE2-NH2 3.02Å; E202-R204 PolarHBondContact OE2-NH2 2.93Å; E202-I205 HydrophobicContact CB-CG1 4.39Å; E202-I205 HydrophobicContact CG-CG2 4.41Å; E202-I205 WeakPolarHBondContact O-CG1 3.48Å; E202-I270 HydrophobicContact CG-CD1 4.01Å; E202-I270 HydrophobicContact CG-CG2 4.2Å
203	N	84.5	Confident	84.5	Confident	100 Å²	100	47.4 Å²	47.4	54%	0.535	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-66.9	-30.9	179.7	-170	10.4	0	0	0	111.8	I205 V206 F239	N203-I205 PolarHBondContact O-N 2.92Å; N203-I205 VanDerWaalsContact O-N 3.16Å; N203-V206 WeakPolarHBondContact O-CB 3.46Å; N203-V206 WeakPolarHBondContact O-CG2 3.29Å; N203-V206 PolarHBondContact O-N 3.3Å; N203-V206 VanDerWaalsContact O-N 3.14Å; N203-F239 HydrophobicContact CB-CE2 3.72Å; N203-F239 HydrophobicContact CB-CZ 3.73Å
204	R	81	Confident	83.7	Confident	189 Å²	189	46.9 Å²	46.9	71%	0.713	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-62.4	-24.2	-176	-73.3	175.1	-89.6	-173.6	-3.2	114.2	E202 I270	E202-R204 VanDerWaalsContact C-N 3.27Å; E202-R204 HydrophobicContact CG-CB 4.13Å; E202-R204 PolarHBondContact O-N 3.17Å; E202-R204 VanDerWaalsContact OE1-CB 3.26Å; E202-R204 WeakPolarHBondContact OE1-CB 3.47Å; E202-R204 VanDerWaalsContact OE1-CG 3.31Å; E202-R204 WeakPolarHBondContact OE1-CG 3.41Å; E202-R204 IonicContact OE1-CZ 3.79Å; E202-R204 PolarHBondContact OE1-N 3.41Å; E202-R204 IonicContact OE1-NE 2.91Å; E202-R204 PolarHBondContact OE1-NE 3.43Å; E202-R204 IonicContact OE1-NH2 3.79Å; E202-R204 IonicContact OE2-CZ 3.6Å; E202-R204 IonicContact OE2-NE 3.44Å; E202-R204 PolarHBondContact OE2-NE 2.99Å; E202-R204 IonicContact OE2-NH2 3.02Å; E202-R204 PolarHBondContact OE2-NH2 2.93Å; R204-I270 HydrophobicContact CB-CD1 4.23Å
205	I	77.6	Confident	82.8	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-89.9	-13.7	178.4	62.8	174.5	0	0	0	114.3	F198 T200 E202 N203 S207 T208 C209 I270	F198-I205 HydrophobicContact CE1-CD1 3.88Å; F198-I205 HydrophobicContact CZ-CD1 4.04Å; T200-I205 HydrophobicContact CG2-CD1 3.93Å; T200-I205 HydrophobicContact CG2-CG1 3.98Å; T200-I205 WeakPolarHBondContact OG1-CD1 3.34Å; E202-I205 HydrophobicContact CB-CG1 4.39Å; E202-I205 HydrophobicContact CG-CG2 4.41Å; E202-I205 WeakPolarHBondContact O-CG1 3.48Å; N203-I205 PolarHBondContact O-N 2.92Å; N203-I205 VanDerWaalsContact O-N 3.16Å; I205-S207 VanDerWaalsContact C-N 3.33Å; I205-S207 PolarHBondContact O-N 2.86Å; I205-T208 PolarHBondContact O-N 3.36Å; I205-T208 VanDerWaalsContact O-N 3.09Å; I205-C209 PolarHBondContact O-N 2.91Å; I205-C209 PolarHBondContact O-SG 3.46Å; I205-C209 VanDerWaalsContact O-SG 3.38Å; I205-I270 HydrophobicContact CG2-CB 4.11Å; I205-I270 HydrophobicContact CG2-CD1 3.18Å; I205-I270 HydrophobicContact CG2-CG1 4.18Å; I205-I270 HydrophobicContact CG2-CG2 3.95Å
206	V	85.1	Confident	81.8	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-47.3	-169.4	174.6	0	0	0	0	111.1	T200 N203 C209 V210 V228 F239 I241	T200-V206 HydrophobicContact CG2-CG2 4.47Å; N203-V206 WeakPolarHBondContact O-CB 3.46Å; N203-V206 WeakPolarHBondContact O-CG2 3.29Å; N203-V206 PolarHBondContact O-N 3.3Å; N203-V206 VanDerWaalsContact O-N 3.14Å; V206-C209 PolarHBondContact O-N 2.99Å; V206-V210 HydrophobicContact CG1-CG2 4.46Å; V206-V210 WeakPolarHBondContact O-CB 3.5Å; V206-V210 WeakPolarHBondContact O-CG2 3.44Å; V206-V210 PolarHBondContact O-N 2.93Å; V206-V228 HydrophobicContact CG1-CB 4.45Å; V206-V228 HydrophobicContact CG1-CG1 3.96Å; V206-V228 HydrophobicContact CG1-CG2 3.69Å; V206-F239 HydrophobicContact CG2-CB 3.76Å; V206-F239 HydrophobicContact CG2-CD1 4.01Å; V206-F239 HydrophobicContact CG2-CD2 4.14Å; V206-F239 HydrophobicContact CG2-CG 3.7Å; V206-I241 HydrophobicContact CG1-CD1 4.38Å; V206-I241 HydrophobicContact CG2-CD1 4.46Å
207	S	85.4	Confident	81.1	Confident	88 Å²	88	53.5 Å²	53.5	62%	0.615	28%	0.284	S	S	*	.	H	α-helix	trans	-63.1	-43.2	177.9	-64.8	0	0	0	0	112.5	I205 V210 L211	I205-S207 VanDerWaalsContact C-N 3.33Å; I205-S207 PolarHBondContact O-N 2.86Å; S207-V210 PolarHBondContact O-N 2.87Å; S207-L211 WeakPolarHBondContact O-CG 3.44Å; S207-L211 PolarHBondContact O-N 3.22Å
208	T	81.2	Confident	80.5	Confident	48 Å²	48	57 Å²	57	29%	0.294	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-47.9	178.5	-52.2	0	0	0	0	111.4	I205 V210 L211 L212 V268	I205-T208 PolarHBondContact O-N 3.36Å; I205-T208 VanDerWaalsContact O-N 3.09Å; T208-V210 PolarHBondContact O-N 2.78Å; T208-L211 PolarHBondContact O-N 3.47Å; T208-L212 HydrophobicContact CG2-CD1 4.02Å; T208-L212 WeakPolarHBondContact O-CD1 3.48Å; T208-L212 WeakPolarHBondContact O-CG 3.33Å; T208-L212 PolarHBondContact O-N 3.31Å; T208-V268 HydrophobicContact CG2-CG2 4.41Å
209	C	78.6	Confident	80.4	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-43.3	176.5	-66.9	0	0	0	0	111.5	I205 V206 L211 L212 C213 I241	I205-C209 PolarHBondContact O-N 2.91Å; I205-C209 PolarHBondContact O-SG 3.46Å; I205-C209 VanDerWaalsContact O-SG 3.38Å; V206-C209 PolarHBondContact O-N 2.99Å; C209-L211 VanDerWaalsContact C-N 3.31Å; C209-L211 PolarHBondContact O-N 3.49Å; C209-L212 PolarHBondContact O-N 2.86Å; C209-C213 WeakPolarHBondContact O-CB 3.14Å; C209-C213 PolarHBondContact O-N 2.57Å; C209-C213 PolarHBondContact O-SG 2.82Å; C209-I241 HydrophobicContact CB-CD1 3.49Å; C209-I241 VanDerWaalsContact CB-CD1 3.49Å
210	V	83.4	Confident	80.1	Confident	36 Å²	36	62.4 Å²	62.4	22%	0.218	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-38.8	177.4	166.8	0	0	0	0	111.6	V206 S207 T208 A214 R227 V228 I241	V206-V210 HydrophobicContact CG1-CG2 4.46Å; V206-V210 WeakPolarHBondContact O-CB 3.5Å; V206-V210 WeakPolarHBondContact O-CG2 3.44Å; V206-V210 PolarHBondContact O-N 2.93Å; S207-V210 PolarHBondContact O-N 2.87Å; T208-V210 PolarHBondContact O-N 2.78Å; V210-A214 PolarHBondContact O-N 2.93Å; V210-R227 HydrophobicContact CG2-CB 4.4Å; V210-R227 PolarHBondContact O-NH1 3.38Å; V210-V228 HydrophobicContact CG2-CG2 3.52Å; V210-I241 HydrophobicContact CG2-CG2 4.11Å
211	L	82.2	Confident	80.1	Confident	115 Å²	115	68.6 Å²	68.6	60%	0.602	36%	0.362	S	S	*	.	H	α-helix	trans	-67.8	-46.7	176.7	-71.4	168.5	0	0	0	111.5	S207 T208 C209 C213 A214 D215	S207-L211 WeakPolarHBondContact O-CG 3.44Å; S207-L211 PolarHBondContact O-N 3.22Å; T208-L211 PolarHBondContact O-N 3.47Å; C209-L211 VanDerWaalsContact C-N 3.31Å; C209-L211 PolarHBondContact O-N 3.49Å; L211-C213 VanDerWaalsContact C-N 3.35Å; L211-C213 PolarHBondContact O-N 2.94Å; L211-A214 WeakPolarHBondContact O-CA 3.07Å; L211-A214 VanDerWaalsContact O-CB 3.28Å; L211-A214 WeakPolarHBondContact O-CB 2.91Å; L211-A214 PolarHBondContact O-N 2.99Å; L211-D215 PolarHBondContact O-N 2.66Å; L211-D215 VanDerWaalsContact O-N 3.11Å
212	L	76.1	Confident	80.3	Confident	47 Å²	47	64.8 Å²	64.8	25%	0.246	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-44.9	177.2	-70.7	159.6	0	0	0	112.3	T208 C209 A214 D215 I216 A264	T208-L212 HydrophobicContact CG2-CD1 4.02Å; T208-L212 WeakPolarHBondContact O-CD1 3.48Å; T208-L212 WeakPolarHBondContact O-CG 3.33Å; T208-L212 PolarHBondContact O-N 3.31Å; C209-L212 PolarHBondContact O-N 2.86Å; L212-A214 PolarHBondContact O-N 3.03Å; L212-D215 PolarHBondContact O-N 3.14Å; L212-I216 WeakPolarHBondContact O-CD1 3.47Å; L212-I216 VanDerWaalsContact O-CG1 3.29Å; L212-I216 WeakPolarHBondContact O-CG1 3.42Å; L212-I216 PolarHBondContact O-N 3.34Å; L212-I216 VanDerWaalsContact O-N 3.08Å; L212-A264 HydrophobicContact CD1-CB 3.18Å; L212-A264 HydrophobicContact CD2-CB 4.44Å; L212-A264 HydrophobicContact CG-CB 4.42Å
213	C	76.4	Confident	80.7	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.007	35%	0.353	C	S	.	.	H	α-helix	trans	-63.3	-22.5	174.2	-65.4	0	0	0	0	112.7	C209 L211 F217 R227 L243	C209-C213 WeakPolarHBondContact O-CB 3.14Å; C209-C213 PolarHBondContact O-N 2.57Å; C209-C213 PolarHBondContact O-SG 2.82Å; L211-C213 VanDerWaalsContact C-N 3.35Å; L211-C213 PolarHBondContact O-N 2.94Å; C213-F217 HydrophobicContact CB-CD2 4.32Å; C213-F217 WeakPolarHBondContact O-CB 3.11Å; C213-F217 PolarHBondContact O-N 2.76Å; C213-R227 PolarHBondContact O-NH2 3.25Å; C213-R227 VanDerWaalsContact O-NH2 3.16Å; C213-L243 WeakPolarHBondContact SG-CD2 3.27Å
214	A	78.2	Confident	81.1	Confident	49 Å²	49	64.2 Å²	64.2	41%	0.405	33%	0.331	S	S	.	.	H	α-helix	trans	-79	-35	177.8	0	0	0	0	0	111.3	V210 L211 L212 R227	V210-A214 PolarHBondContact O-N 2.93Å; L211-A214 WeakPolarHBondContact O-CA 3.07Å; L211-A214 VanDerWaalsContact O-CB 3.28Å; L211-A214 WeakPolarHBondContact O-CB 2.91Å; L211-A214 PolarHBondContact O-N 2.99Å; L212-A214 PolarHBondContact O-N 3.03Å; A214-R227 VanDerWaalsContact CA-NH1 3.32Å
215	D	74.7	Confident	81.8	Confident	141 Å²	141	55.4 Å²	55.4	75%	0.754	30%	0.298	S	S	*	.	H	α-helix	trans	-73.4	-37.1	177.9	-65.7	-24.3	0	0	0	112	L211 L212	L211-D215 PolarHBondContact O-N 2.66Å; L211-D215 VanDerWaalsContact O-N 3.11Å; L212-D215 PolarHBondContact O-N 3.14Å
216	I	72.2	Confident	82.6	Confident	64 Å²	64	60.7 Å²	60.7	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-82	-40.2	-177.1	-59.9	163.2	0	0	0	111.3	L212 F257	L212-I216 WeakPolarHBondContact O-CD1 3.47Å; L212-I216 VanDerWaalsContact O-CG1 3.29Å; L212-I216 WeakPolarHBondContact O-CG1 3.42Å; L212-I216 PolarHBondContact O-N 3.34Å; L212-I216 VanDerWaalsContact O-N 3.08Å; I216-F257 HydrophobicContact CD1-CD2 3.78Å; I216-F257 HydrophobicContact CD1-CE2 3.79Å; I216-F257 HydrophobicContact CG2-CD2 4.39Å
217	F	74.5	Confident	82.8	Confident	13 Å²	13	61.4 Å²	61.4	6%	0.057	32%	0.322	C	S	.	.	S	Bend	trans	-115.4	122.7	-170.5	-58.8	-59.8	0	0	0	112.7	C213 W219 L243 W244 L249 F257	C213-F217 HydrophobicContact CB-CD2 4.32Å; C213-F217 WeakPolarHBondContact O-CB 3.11Å; C213-F217 PolarHBondContact O-N 2.76Å; F217-W219 PolarHBondContact O-N 3.02Å; F217-L243 HydrophobicContact CE2-CB 4.39Å; F217-W244 HydrophobicContact CB-CD2 3.91Å; F217-W244 HydrophobicContact CB-CE3 3.39Å; F217-W244 HydrophobicContact CB-CH2 4.24Å; F217-W244 HydrophobicContact CB-CZ3 3.57Å; F217-W244 HydrophobicContact CD1-CB 3.98Å; F217-W244 AromaticContact CD1-CD2 3.65Å; F217-W244 HydrophobicContact CD1-CD2 3.65Å; F217-W244 HydrophobicContact CD1-CE3 4.04Å; F217-W244 AromaticContact CD1-CG 3.62Å; F217-W244 HydrophobicContact CD1-CG 3.62Å; F217-W244 HydrophobicContact CD2-CB 4.42Å; F217-W244 HydrophobicContact CE1-CB 3.9Å; F217-W244 HydrophobicContact CE1-CD2 4.38Å; F217-W244 AromaticContact CE1-CG 3.87Å; F217-W244 HydrophobicContact CE1-CG 3.87Å; F217-W244 HydrophobicContact CE2-CB 4.33Å; F217-W244 HydrophobicContact CG-CB 4.26Å; F217-W244 AromaticContact CG-CD2 3.89Å; F217-W244 HydrophobicContact CG-CD2 3.89Å; F217-W244 AromaticContact CG-CE3 3.78Å; F217-W244 HydrophobicContact CG-CE3 3.78Å; F217-W244 HydrophobicContact CG-CG 4.12Å; F217-W244 HydrophobicContact CG-CZ3 4.43Å; F217-W244 HydrophobicContact CZ-CB 4.09Å; F217-L249 HydrophobicContact CE1-CD1 4.31Å; F217-L249 HydrophobicContact CE1-CD2 4.1Å; F217-L249 HydrophobicContact CE1-CG 4.5Å; F217-L249 HydrophobicContact CZ-CD1 4.25Å; F217-L249 HydrophobicContact CZ-CD2 4.38Å; F217-F257 HydrophobicContact CD2-CE2 4.35Å; F217-F257 AromaticContact CE2-CD2 3.64Å; F217-F257 HydrophobicContact CE2-CD2 3.64Å; F217-F257 AromaticContact CE2-CE2 3.39Å; F217-F257 HydrophobicContact CE2-CE2 3.39Å; F217-F257 HydrophobicContact CE2-CG 4.4Å; F217-F257 AromaticContact CE2-CZ 3.97Å; F217-F257 HydrophobicContact CE2-CZ 3.97Å; F217-F257 AromaticContact CZ-CD2 3.67Å; F217-F257 HydrophobicContact CZ-CD2 3.67Å; F217-F257 AromaticContact CZ-CE2 3.94Å; F217-F257 HydrophobicContact CZ-CE2 3.94Å; F217-F257 HydrophobicContact CZ-CG 4.18Å
218	P	75.7	Confident	83.1	Confident	82 Å²	82	59.3 Å²	59.3	53%	0.532	31%	0.305	S	S	.	.			trans	-71.8	85.1	-177.7	28	-33.3	0	0	0	112.1	E220 W244	P218-E220 PolarHBondContact O-N 2.96Å; P218-W244 HydrophobicContact CG-CH2 3.88Å; P218-W244 HydrophobicContact CG-CZ2 4.09Å; P218-W244 WeakPolarHBondContact O-CH2 2.99Å
219	W	81.8	Confident	83.7	Confident	40 Å²	40	59.6 Å²	59.6	15%	0.152	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-66.5	-8.3	-172.1	-157.7	-107.2	0	0	0	116.1	F217 Q221 F222 K223 L225 R227 L242 L243 W244	F217-W219 PolarHBondContact O-N 3.02Å; W219-Q221 PolarHBondContact O-N 3.09Å; W219-F222 HydrophobicContact CD2-CB 4.33Å; W219-F222 HydrophobicContact CH2-CB 4.45Å; W219-F222 HydrophobicContact CZ2-CB 4.25Å; W219-F222 PolarHBondContact NE1-O 3.42Å; W219-F222 CarbonylContact O-C 3.37Å; W219-F222 PolarHBondContact O-N 3.4Å; W219-K223 PolarHBondContact O-N 3.48Å; W219-L225 HydrophobicContact CZ2-CB 3.93Å; W219-R227 VanDerWaalsContact CB-NH2 3.31Å; W219-R227 HydrophobicContact CD2-CG 4.3Å; W219-R227 VanDerWaalsContact CE3-NH2 3.34Å; W219-R227 HydrophobicContact CH2-CG 4.07Å; W219-R227 HydrophobicContact CZ2-CG 3.56Å; W219-L242 HydrophobicContact CH2-CB 4.3Å; W219-L242 HydrophobicContact CH2-CD2 3.96Å; W219-L242 HydrophobicContact CH2-CG 4.27Å; W219-L243 WeakPolarHBondContact CZ3-O 3.37Å; W219-W244 HydrophobicContact CE3-CE3 4.32Å; W219-W244 HydrophobicContact CE3-CZ3 4.02Å; W219-W244 HydrophobicContact CZ3-CE3 4.34Å; W219-W244 HydrophobicContact CZ3-CZ3 4.43Å
220	E	81.7	Confident	84.4	Confident	133 Å²	133	63.1 Å²	63.1	62%	0.621	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-50.5	-35	-178.2	-80.9	-66.2	143.7	0	0	113.1	P218 F222 K223	P218-E220 PolarHBondContact O-N 2.96Å; E220-F222 VanDerWaalsContact C-N 3.32Å; E220-F222 PolarHBondContact O-N 3.14Å; E220-K223 WeakPolarHBondContact OE1-CE 3.34Å; E220-K223 IonicContact OE1-NZ 3.37Å; E220-K223 PolarHBondContact OE1-NZ 3.26Å; E220-K223 WeakPolarHBondContact OE2-CE 3.49Å; E220-K223 IonicContact OE2-NZ 3.54Å; E220-K223 PolarHBondContact OE2-NZ 3.08Å
221	Q	83.6	Confident	84.7	Confident	139 Å²	139	63 Å²	63	65%	0.65	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-75.2	-18.4	-179.9	-59.7	-177.5	11.1	0	0	114	W219	W219-Q221 PolarHBondContact O-N 3.09Å
222	F	90	Very high	85	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.035	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-123.9	29.1	-172.6	-57.6	-62.2	0	0	0	112.6	F195 W219 E220 H224 L225 W244 P245	F195-F222 HydrophobicContact CE1-CD2 4.33Å; F195-F222 HydrophobicContact CE1-CE2 4.41Å; F195-F222 HydrophobicContact CE1-CG 4.47Å; F195-F222 AromaticContact CZ-CD1 3.92Å; F195-F222 HydrophobicContact CZ-CD1 3.92Å; F195-F222 HydrophobicContact CZ-CD2 4.21Å; F195-F222 AromaticContact CZ-CE1 3.81Å; F195-F222 HydrophobicContact CZ-CE1 3.81Å; F195-F222 HydrophobicContact CZ-CE2 4.09Å; F195-F222 HydrophobicContact CZ-CG 4.14Å; F195-F222 AromaticContact CZ-CZ 3.89Å; F195-F222 HydrophobicContact CZ-CZ 3.89Å; W219-F222 HydrophobicContact CD2-CB 4.33Å; W219-F222 HydrophobicContact CH2-CB 4.45Å; W219-F222 HydrophobicContact CZ2-CB 4.25Å; W219-F222 PolarHBondContact NE1-O 3.42Å; W219-F222 CarbonylContact O-C 3.37Å; W219-F222 PolarHBondContact O-N 3.4Å; E220-F222 VanDerWaalsContact C-N 3.32Å; E220-F222 PolarHBondContact O-N 3.14Å; F222-H224 PolarHBondContact O-N 3.16Å; F222-L225 HydrophobicContact CB-CD1 4.16Å; F222-L225 HydrophobicContact CD1-CD1 4.36Å; F222-L225 HydrophobicContact CG-CD1 4.49Å; F222-L225 PolarHBondContact O-N 3.24Å; F222-W244 HydrophobicContact CD2-CE3 4.41Å; F222-W244 HydrophobicContact CD2-CH2 4.02Å; F222-W244 AromaticContact CD2-CZ3 3.78Å; F222-W244 HydrophobicContact CD2-CZ3 3.78Å; F222-W244 HydrophobicContact CE2-CE3 4.41Å; F222-W244 AromaticContact CE2-CH2 3.84Å; F222-W244 HydrophobicContact CE2-CH2 3.84Å; F222-W244 HydrophobicContact CE2-CZ2 4.22Å; F222-W244 AromaticContact CE2-CZ3 3.93Å; F222-W244 HydrophobicContact CE2-CZ3 3.93Å; F222-P245 HydrophobicContact CE2-CG 3.87Å; F222-P245 HydrophobicContact CZ-CG 3.71Å
223	K	91	Very high	85.4	Confident	122 Å²	122	64 Å²	64	53%	0.53	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.8	179.1	-78.4	179.9	162.9	171.2	0	114.2	W219 E220 L225	W219-K223 PolarHBondContact O-N 3.48Å; E220-K223 WeakPolarHBondContact OE1-CE 3.34Å; E220-K223 IonicContact OE1-NZ 3.37Å; E220-K223 PolarHBondContact OE1-NZ 3.26Å; E220-K223 WeakPolarHBondContact OE2-CE 3.49Å; E220-K223 IonicContact OE2-NZ 3.54Å; E220-K223 PolarHBondContact OE2-NZ 3.08Å; K223-L225 VanDerWaalsContact C-N 3.3Å
224	H	93.7	Very high	85.7	Confident	14 Å²	14	69.3 Å²	69.3	7%	0.065	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-22.3	175.7	66.7	-71	0	0	0	112.9	F222 P283 E285 E286 V302 A303	F222-H224 PolarHBondContact O-N 3.16Å; H224-P283 PolarHBondContact NE2-O 3.44Å; H224-E285 PolarHBondContact CD2-O 2.81Å; H224-E285 VanDerWaalsContact CD2-O 3.25Å; H224-E285 PolarHBondContact NE2-O 3.37Å; H224-E286 HydrophobicContact CB-CB 3.52Å; H224-V302 CarbonylContact O-C 3.18Å; H224-V302 WeakPolarHBondContact O-CA 3.23Å; H224-V302 VanDerWaalsContact O-CB 3.29Å; H224-V302 WeakPolarHBondContact O-CB 3.41Å; H224-V302 WeakPolarHBondContact O-CG1 3.48Å; H224-A303 PolarHBondContact O-N 3.45Å
225	L	95.2	Very high	85.9	Confident	4 Å²	4	73.4 Å²	73.4	2%	0.021	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-85.8	129	177.1	-62.4	175.2	0	0	0	109.8	F195 W219 F222 K223 L242 V282 V302	F195-L225 HydrophobicContact CE1-CD1 4.26Å; F195-L225 HydrophobicContact CE2-CD1 4.5Å; F195-L225 HydrophobicContact CZ-CD1 4Å; W219-L225 HydrophobicContact CZ2-CB 3.93Å; F222-L225 HydrophobicContact CB-CD1 4.16Å; F222-L225 HydrophobicContact CD1-CD1 4.36Å; F222-L225 HydrophobicContact CG-CD1 4.49Å; F222-L225 PolarHBondContact O-N 3.24Å; K223-L225 VanDerWaalsContact C-N 3.3Å; L225-L242 HydrophobicContact CB-CD2 4.22Å; L225-L242 HydrophobicContact CD1-CD2 3.84Å; L225-V282 HydrophobicContact CD1-CB 4.47Å; L225-V282 HydrophobicContact CD1-CG2 3.75Å; L225-V282 HydrophobicContact CD2-CB 4.14Å; L225-V282 HydrophobicContact CD2-CG2 4.26Å; L225-V302 HydrophobicContact CD2-CG1 3.94Å
226	K	93.1	Very high	86.4	Confident	113 Å²	113	69.2 Å²	69.2	49%	0.491	38%	0.382	S	S	.	.			trans	-78	133.1	167.3	-61.1	-174	177.7	-175.9	0	108.6	V228 W300 P301	K226-V228 VanDerWaalsContact C-N 3.34Å; K226-V228 PolarHBondContact O-N 2.96Å; K226-W300 PolarHBondContact O-NE1 3.24Å; K226-P301 HydrophobicContact CB-CB 4Å; K226-P301 VanDerWaalsContact CB-O 3.3Å; K226-P301 WeakPolarHBondContact CB-O 3.12Å; K226-P301 HydrophobicContact CD-CB 3.96Å; K226-P301 HydrophobicContact CG-CB 4.32Å; K226-P301 PolarHBondContact N-O 3.14Å
227	R	90.3	Very high	87.2	Confident	29 Å²	29	71.8 Å²	71.8	11%	0.109	39%	0.391	C	S	.	.	S	Bend	trans	-66	-33.1	-175.6	-77.4	179.5	168.1	-133.9	-13.9	114.3	V210 C213 A214 W219 I241 L242	V210-R227 HydrophobicContact CG2-CB 4.4Å; V210-R227 PolarHBondContact O-NH1 3.38Å; C213-R227 PolarHBondContact O-NH2 3.25Å; C213-R227 VanDerWaalsContact O-NH2 3.16Å; A214-R227 VanDerWaalsContact CA-NH1 3.32Å; W219-R227 VanDerWaalsContact CB-NH2 3.31Å; W219-R227 HydrophobicContact CD2-CG 4.3Å; W219-R227 VanDerWaalsContact CE3-NH2 3.34Å; W219-R227 HydrophobicContact CH2-CG 4.07Å; W219-R227 HydrophobicContact CZ2-CG 3.56Å; R227-I241 CarbonylContact O-C 3.58Å; R227-I241 WeakPolarHBondContact O-CA 3.28Å; R227-L242 PolarHBondContact O-N 3.22Å
228	V	92.4	Very high	87.9	Confident	44 Å²	44	73.9 Å²	73.9	27%	0.267	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.4	-174	-174	0	0	0	0	110	V206 V210 K226 F239 D240 I241	V206-V228 HydrophobicContact CG1-CB 4.45Å; V206-V228 HydrophobicContact CG1-CG1 3.96Å; V206-V228 HydrophobicContact CG1-CG2 3.69Å; V210-V228 HydrophobicContact CG2-CG2 3.52Å; K226-V228 VanDerWaalsContact C-N 3.34Å; K226-V228 PolarHBondContact O-N 2.96Å; V228-F239 HydrophobicContact CG1-CB 4.44Å; V228-F239 HydrophobicContact CG1-CD1 4.36Å; V228-D240 WeakPolarHBondContact CA-O 3.18Å; V228-I241 HydrophobicContact CG2-CG1 4.5Å
229	R	93.5	Very high	88.6	Confident	55 Å²	55	70.6 Å²	70.6	21%	0.208	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.1	166	178.4	177	67.6	-168.3	-1.8	108.9	V231 D240 V299 W300 P301	R229-V231 HydrophobicContact CG-CG2 4.07Å; R229-D240 HydrophobicContact CB-CB 4.28Å; R229-D240 IonicContact CZ-OD2 2.76Å; R229-D240 PolarHBondContact N-O 3.34Å; R229-D240 IonicContact NE-OD2 3.87Å; R229-D240 PolarHBondContact NE-OD2 2.84Å; R229-D240 IonicContact NH2-OD2 3.04Å; R229-D240 PolarHBondContact NH2-OD2 2.69Å; R229-D240 PolarHBondContact O-N 3.21Å; R229-V299 PolarHBondContact NH1-O 3.33Å; R229-W300 HydrophobicContact CB-CH2 4Å; R229-W300 HydrophobicContact CB-CZ2 3.94Å; R229-W300 HydrophobicContact CB-CZ3 4.47Å; R229-W300 VanDerWaalsContact NH1-CE3 3.25Å; R229-W300 VanDerWaalsContact NH2-CZ3 3.33Å; R229-P301 HydrophobicContact CB-CG 3.85Å; R229-P301 HydrophobicContact CG-CG 3.82Å
230	T	93	Very high	89.1	Confident	76 Å²	76	68.7 Å²	68.7	47%	0.466	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.7	169.5	-63.2	0	0	0	0	109.2	K237 Y238	T230-K237 HydrophobicContact CG2-CD 4.07Å; T230-K237 HydrophobicContact CG2-CG 3.83Å; T230-Y238 WeakPolarHBondContact CA-O 3.33Å
231	V	90.4	Very high	89.5	Confident	33 Å²	33	62.4 Å²	62.4	20%	0.2	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.6	175.6	-176	0	0	0	0	107.7	R229 E233 Y238 D240	R229-V231 HydrophobicContact CG-CG2 4.07Å; V231-E233 HydrophobicContact CG1-CG 4.41Å; V231-Y238 PolarHBondContact N-O 3.04Å; V231-Y238 PolarHBondContact O-N 2.79Å; V231-D240 WeakPolarHBondContact CG2-OD2 3.19Å
232	A	87.8	Confident	89.8	Confident	87 Å²	87	55.8 Å²	55.8	72%	0.719	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	117	172.7	0	0	0	0	0	108.6
233	E	85.2	Confident	89.6	Confident	97 Å²	97	55.5 Å²	55.5	45%	0.453	31%	0.307	S	S	.	.			trans	-103.3	168.2	166.6	-70.5	-179.1	-172.3	0	0	109	R199 V231 T235 C236 Y238	R199-E233 IonicContact NH1-OE1 3.23Å; V231-E233 HydrophobicContact CG1-CG 4.41Å; E233-T235 PolarHBondContact O-N 3.43Å; E233-C236 PolarHBondContact N-O 2.98Å; E233-C236 PolarHBondContact O-N 3.47Å; E233-Y238 HydrophobicContact CB-CD2 4.45Å; E233-Y238 HydrophobicContact CB-CE2 4.16Å; E233-Y238 HydrophobicContact CG-CD2 4.23Å; E233-Y238 HydrophobicContact CG-CE2 4.19Å; E233-Y238 WeakPolarHBondContact OE2-CE2 3.35Å
234	A	81.6	Confident	89.4	Confident	113 Å²	113	50.6 Å²	50.6	93%	0.934	29%	0.286	S	S	*	.	S	Bend	trans	-51.4	-30	-167.8	0	0	0	0	0	115.3
235	T	83.3	Confident	89.2	Confident	135 Å²	135	50 Å²	50	83%	0.828	28%	0.283	S	S	*	.	S	Bend	trans	-124	-14.1	-175.8	53	0	0	0	0	114.3	E233	E233-T235 PolarHBondContact O-N 3.43Å
236	C	83.9	Confident	88.8	Confident	52 Å²	52	50.8 Å²	50.8	35%	0.351	29%	0.289	S	S	.	.			trans	-142.1	149.3	-170.4	-78.6	0	0	0	0	111.9	E233 Y238	E233-C236 PolarHBondContact N-O 2.98Å; E233-C236 PolarHBondContact O-N 3.47Å; C236-Y238 HydrophobicContact CB-CD2 4.44Å; C236-Y238 HydrophobicContact CB-CE2 3.74Å
237	K	88.7	Confident	88.5	Confident	119 Å²	119	50.5 Å²	50.5	52%	0.517	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	120.6	172.9	-169.1	178.2	-176.4	179.6	0	108.6	T230 F239	T230-K237 HydrophobicContact CG2-CD 4.07Å; T230-K237 HydrophobicContact CG2-CG 3.83Å; K237-F239 HydrophobicContact CD-CZ 4.12Å; K237-F239 HydrophobicContact CG-CZ 4.34Å
238	Y	89.7	Confident	88	Confident	56 Å²	56	53.1 Å²	53.1	22%	0.22	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	148.5	176.6	-62.6	-84.1	0	0	0	110.6	R199 T200 V201 T230 V231 E233 C236	R199-Y238 HydrophobicContact CG-CD1 3.79Å; R199-Y238 HydrophobicContact CG-CG 4.31Å; T200-Y238 CarbonylContact O-C 3.5Å; T200-Y238 WeakPolarHBondContact O-CA 3.47Å; V201-Y238 HydrophobicContact CG1-CD1 3.46Å; V201-Y238 VanDerWaalsContact CG1-CD1 3.46Å; V201-Y238 HydrophobicContact CG1-CE1 3.29Å; V201-Y238 HydrophobicContact CG1-CG 4.4Å; T230-Y238 WeakPolarHBondContact CA-O 3.33Å; V231-Y238 PolarHBondContact N-O 3.04Å; V231-Y238 PolarHBondContact O-N 2.79Å; E233-Y238 HydrophobicContact CB-CD2 4.45Å; E233-Y238 HydrophobicContact CB-CE2 4.16Å; E233-Y238 HydrophobicContact CG-CD2 4.23Å; E233-Y238 HydrophobicContact CG-CE2 4.19Å; E233-Y238 WeakPolarHBondContact OE2-CE2 3.35Å; C236-Y238 HydrophobicContact CB-CD2 4.44Å; C236-Y238 HydrophobicContact CB-CE2 3.74Å
239	F	90.6	Very high	87.2	Confident	14 Å²	14	52.1 Å²	52.1	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111.1	171.9	-57	-87	0	0	0	107.7	R199 T200 N203 V206 V228 K237	R199-F239 WeakPolarHBondContact CA-O 3.37Å; T200-F239 HydrophobicContact CG2-CB 4.02Å; T200-F239 PolarHBondContact N-O 3.46Å; T200-F239 PolarHBondContact O-N 2.96Å; N203-F239 HydrophobicContact CB-CE2 3.72Å; N203-F239 HydrophobicContact CB-CZ 3.73Å; V206-F239 HydrophobicContact CG2-CB 3.76Å; V206-F239 HydrophobicContact CG2-CD1 4.01Å; V206-F239 HydrophobicContact CG2-CD2 4.14Å; V206-F239 HydrophobicContact CG2-CG 3.7Å; V228-F239 HydrophobicContact CG1-CB 4.44Å; V228-F239 HydrophobicContact CG1-CD1 4.36Å; K237-F239 HydrophobicContact CD-CZ 4.12Å; K237-F239 HydrophobicContact CG-CZ 4.34Å
240	D	91.8	Very high	86.1	Confident	0 Å²	0	51 Å²	51	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	114.9	173.3	-66.7	-11.1	0	0	0	107.9	F197 R199 V228 R229 V231 W300	F197-D240 HydrophobicContact CD2-CB 3.61Å; F197-D240 HydrophobicContact CE2-CB 3.87Å; F197-D240 WeakPolarHBondContact CE2-OD1 3.47Å; R199-D240 IonicContact CZ-OD1 3.12Å; R199-D240 IonicContact CZ-OD2 2.7Å; R199-D240 IonicContact NE-OD1 2.66Å; R199-D240 PolarHBondContact NE-OD1 3Å; R199-D240 IonicContact NH2-OD1 3.27Å; R199-D240 PolarHBondContact NH2-OD1 3.02Å; R199-D240 VanDerWaalsContact NH2-OD1 3.12Å; R199-D240 IonicContact NH2-OD2 2.6Å; R199-D240 PolarHBondContact NH2-OD2 3.15Å; V228-D240 WeakPolarHBondContact CA-O 3.18Å; R229-D240 HydrophobicContact CB-CB 4.28Å; R229-D240 IonicContact CZ-OD2 2.76Å; R229-D240 PolarHBondContact N-O 3.34Å; R229-D240 IonicContact NE-OD2 3.87Å; R229-D240 PolarHBondContact NE-OD2 2.84Å; R229-D240 IonicContact NH2-OD2 3.04Å; R229-D240 PolarHBondContact NH2-OD2 2.69Å; R229-D240 PolarHBondContact O-N 3.21Å; V231-D240 WeakPolarHBondContact CG2-OD2 3.19Å; D240-W300 HydrophobicContact CB-CH2 3.97Å
241	I	90	Very high	85	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	110.5	179.8	-50.5	-177.8	0	0	0	108.1	F197 F198 V206 C209 V210 R227 V228	F197-I241 CarbonylContact C-O 3.11Å; F197-I241 VanDerWaalsContact CA-O 3.23Å; F197-I241 WeakPolarHBondContact CA-O 3.46Å; F197-I241 WeakPolarHBondContact CB-O 3.23Å; F198-I241 HydrophobicContact CB-CB 4.42Å; F198-I241 HydrophobicContact CD1-CB 4.39Å; F198-I241 HydrophobicContact CD1-CD1 3.96Å; F198-I241 HydrophobicContact CD1-CG1 4.3Å; F198-I241 HydrophobicContact CE1-CD1 4.34Å; F198-I241 PolarHBondContact N-O 3.33Å; F198-I241 PolarHBondContact O-N 3.37Å; V206-I241 HydrophobicContact CG1-CD1 4.38Å; V206-I241 HydrophobicContact CG2-CD1 4.46Å; C209-I241 HydrophobicContact CB-CD1 3.49Å; C209-I241 VanDerWaalsContact CB-CD1 3.49Å; V210-I241 HydrophobicContact CG2-CG2 4.11Å; R227-I241 CarbonylContact O-C 3.58Å; R227-I241 WeakPolarHBondContact O-CA 3.28Å; V228-I241 HydrophobicContact CG2-CG1 4.5Å
242	L	90.7	Very high	84.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	134.6	179.9	-158.7	65.6	0	0	0	110.3	F195 F197 W219 L225 R227 T280 V282 W300	F195-L242 HydrophobicContact CB-CD1 3.64Å; F195-L242 HydrophobicContact CB-CG 4.31Å; F195-L242 HydrophobicContact CD1-CD1 4.17Å; F195-L242 HydrophobicContact CD1-CD2 4.01Å; F195-L242 HydrophobicContact CD1-CG 3.88Å; F195-L242 HydrophobicContact CE1-CD2 4.39Å; F195-L242 HydrophobicContact CG-CD1 4.2Å; F195-L242 HydrophobicContact CG-CD2 4.49Å; F195-L242 HydrophobicContact CG-CG 4.4Å; F197-L242 HydrophobicContact CB-CD1 4.15Å; W219-L242 HydrophobicContact CH2-CB 4.3Å; W219-L242 HydrophobicContact CH2-CD2 3.96Å; W219-L242 HydrophobicContact CH2-CG 4.27Å; L225-L242 HydrophobicContact CB-CD2 4.22Å; L225-L242 HydrophobicContact CD1-CD2 3.84Å; R227-L242 PolarHBondContact O-N 3.22Å; L242-T280 HydrophobicContact CD1-CG2 4.14Å; L242-V282 HydrophobicContact CD1-CG1 3.99Å; L242-V282 HydrophobicContact CD2-CG1 4.19Å; L242-V282 HydrophobicContact CD2-CG2 4.37Å; L242-W300 HydrophobicContact CB-CH2 4.39Å; L242-W300 HydrophobicContact CB-CZ2 3.76Å; L242-W300 HydrophobicContact CD1-CH2 3.98Å; L242-W300 HydrophobicContact CD1-CZ2 3.94Å; L242-W300 HydrophobicContact CD1-CZ3 4.36Å; L242-W300 HydrophobicContact CD2-CZ2 4.28Å; L242-W300 HydrophobicContact CG-CZ2 4.22Å
243	L	85.2	Confident	83.3	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-80.8	-173.8	-58	176	0	0	0	111	Y196 F198 C213 F217 W219 F257 L277	Y196-L243 VanDerWaalsContact O-CB 3.32Å; Y196-L243 WeakPolarHBondContact O-CB 3.23Å; Y196-L243 PolarHBondContact O-N 2.72Å; F198-L243 HydrophobicContact CB-CD1 4.17Å; F198-L243 HydrophobicContact CB-CD2 4.23Å; F198-L243 HydrophobicContact CB-CG 4.37Å; C213-L243 WeakPolarHBondContact SG-CD2 3.27Å; F217-L243 HydrophobicContact CE2-CB 4.39Å; W219-L243 WeakPolarHBondContact CZ3-O 3.37Å; L243-F257 HydrophobicContact CD1-CD1 4.2Å; L243-F257 HydrophobicContact CD1-CE1 3.46Å; L243-F257 VanDerWaalsContact CD1-CE1 3.46Å; L243-F257 HydrophobicContact CD1-CZ 4.15Å; L243-F257 HydrophobicContact CD2-CE1 3.6Å; L243-F257 HydrophobicContact CD2-CE2 4.49Å; L243-F257 HydrophobicContact CD2-CZ 3.38Å; L243-F257 HydrophobicContact CG-CE1 4.07Å; L243-F257 HydrophobicContact CG-CZ 4.26Å; L243-L277 HydrophobicContact CD1-CD1 3.24Å
244	W	86.8	Confident	82.6	Confident	19 Å²	19	54 Å²	54	7%	0.072	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	160.1	-172.1	-153.5	-117.1	0	0	0	111.8	F195 Y196 F217 P218 W219 F222 L249	F195-W244 CarbonylContact C-O 3.57Å; F195-W244 VanDerWaalsContact CA-O 3.32Å; F195-W244 WeakPolarHBondContact CA-O 3.46Å; Y196-W244 PolarHBondContact N-O 2.96Å; F217-W244 HydrophobicContact CB-CD2 3.91Å; F217-W244 HydrophobicContact CB-CE3 3.39Å; F217-W244 HydrophobicContact CB-CH2 4.24Å; F217-W244 HydrophobicContact CB-CZ3 3.57Å; F217-W244 HydrophobicContact CD1-CB 3.98Å; F217-W244 AromaticContact CD1-CD2 3.65Å; F217-W244 HydrophobicContact CD1-CD2 3.65Å; F217-W244 HydrophobicContact CD1-CE3 4.04Å; F217-W244 AromaticContact CD1-CG 3.62Å; F217-W244 HydrophobicContact CD1-CG 3.62Å; F217-W244 HydrophobicContact CD2-CB 4.42Å; F217-W244 HydrophobicContact CE1-CB 3.9Å; F217-W244 HydrophobicContact CE1-CD2 4.38Å; F217-W244 AromaticContact CE1-CG 3.87Å; F217-W244 HydrophobicContact CE1-CG 3.87Å; F217-W244 HydrophobicContact CE2-CB 4.33Å; F217-W244 HydrophobicContact CG-CB 4.26Å; F217-W244 AromaticContact CG-CD2 3.89Å; F217-W244 HydrophobicContact CG-CD2 3.89Å; F217-W244 AromaticContact CG-CE3 3.78Å; F217-W244 HydrophobicContact CG-CE3 3.78Å; F217-W244 HydrophobicContact CG-CG 4.12Å; F217-W244 HydrophobicContact CG-CZ3 4.43Å; F217-W244 HydrophobicContact CZ-CB 4.09Å; P218-W244 HydrophobicContact CG-CH2 3.88Å; P218-W244 HydrophobicContact CG-CZ2 4.09Å; P218-W244 WeakPolarHBondContact O-CH2 2.99Å; W219-W244 HydrophobicContact CE3-CE3 4.32Å; W219-W244 HydrophobicContact CE3-CZ3 4.02Å; W219-W244 HydrophobicContact CZ3-CE3 4.34Å; W219-W244 HydrophobicContact CZ3-CZ3 4.43Å; F222-W244 HydrophobicContact CD2-CE3 4.41Å; F222-W244 HydrophobicContact CD2-CH2 4.02Å; F222-W244 AromaticContact CD2-CZ3 3.78Å; F222-W244 HydrophobicContact CD2-CZ3 3.78Å; F222-W244 HydrophobicContact CE2-CE3 4.41Å; F222-W244 AromaticContact CE2-CH2 3.84Å; F222-W244 HydrophobicContact CE2-CH2 3.84Å; F222-W244 HydrophobicContact CE2-CZ2 4.22Å; F222-W244 AromaticContact CE2-CZ3 3.93Å; F222-W244 HydrophobicContact CE2-CZ3 3.93Å; W244-L249 HydrophobicContact CB-CD1 3.56Å; W244-L249 HydrophobicContact CB-CG 4.39Å; W244-L249 HydrophobicContact CG-CD1 4.21Å
245	P	89.7	Confident	82.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	138	174.5	-22.9	31.4	0	0	0	112.8	E194 F195 F222 D247 Q248	E194-P245 WeakPolarHBondContact O-CA 3.45Å; F195-P245 HydrophobicContact CD1-CG 4.39Å; F195-P245 HydrophobicContact CD2-CB 4.46Å; F195-P245 HydrophobicContact CD2-CG 4.41Å; F195-P245 VanDerWaalsContact CE1-CD 3.47Å; F195-P245 HydrophobicContact CE1-CG 3.8Å; F195-P245 HydrophobicContact CE2-CB 4.24Å; F195-P245 HydrophobicContact CE2-CG 3.82Å; F195-P245 HydrophobicContact CZ-CB 4.36Å; F195-P245 HydrophobicContact CZ-CG 3.49Å; F195-P245 VanDerWaalsContact CZ-CG 3.49Å; F222-P245 HydrophobicContact CE2-CG 3.87Å; F222-P245 HydrophobicContact CZ-CG 3.71Å; P245-D247 VanDerWaalsContact C-N 3.26Å; P245-D247 WeakPolarHBondContact CB-OD1 3.37Å; P245-D247 PolarHBondContact O-N 2.75Å; P245-Q248 HydrophobicContact CB-CB 4.35Å; P245-Q248 HydrophobicContact CB-CG 4.28Å; P245-Q248 PolarHBondContact O-N 3.13Å
246	S	87.9	Confident	81.7	Confident	21 Å²	21	48.3 Å²	48.3	15%	0.147	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-72.2	-21.8	-176.8	63.6	0	0	0	0	114	E194 Y196 Q248	E194-S246 WeakPolarHBondContact CB-OG 3.42Å; E194-S246 WeakPolarHBondContact CG-OG 3.15Å; E194-S246 PolarHBondContact O-N 3.29Å; E194-S246 PolarHBondContact O-OG 3.22Å; E194-S246 VanDerWaalsContact OE2-CB 3.26Å; E194-S246 WeakPolarHBondContact OE2-CB 3.41Å; E194-S246 PolarHBondContact OE2-OG 3.21Å; Y196-S246 VanDerWaalsContact CE2-CA 3.42Å; Y196-S246 VanDerWaalsContact CE2-CB 3.5Å; S246-Q248 VanDerWaalsContact C-N 3.3Å
247	D	85.8	Confident	81	Confident	107 Å²	107	46.3 Å²	46.3	57%	0.572	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-81.4	-8.3	177.1	63.6	-46.9	0	0	0	113.4	R193 P245	R193-D247 IonicContact CZ-OD1 3.12Å; R193-D247 IonicContact CZ-OD2 3.36Å; R193-D247 IonicContact NE-OD1 3.33Å; R193-D247 PolarHBondContact NE-OD1 3.05Å; R193-D247 VanDerWaalsContact NE-OD1 3.07Å; R193-D247 IonicContact NE-OD2 2.74Å; R193-D247 VanDerWaalsContact NH2-CG 3.28Å; R193-D247 IonicContact NH2-OD1 3.71Å; R193-D247 PolarHBondContact NH2-OD1 2.9Å; R193-D247 IonicContact NH2-OD2 2.68Å; R193-D247 PolarHBondContact NH2-OD2 2.98Å; P245-D247 VanDerWaalsContact C-N 3.26Å; P245-D247 WeakPolarHBondContact CB-OD1 3.37Å; P245-D247 PolarHBondContact O-N 2.75Å
248	Q	80.4	Confident	80.3	Confident	84 Å²	84	43.2 Å²	43.2	39%	0.393	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-112.5	3.2	-178.9	-67.2	-170.8	-14.6	0	0	113.8	P245 S246	P245-Q248 HydrophobicContact CB-CB 4.35Å; P245-Q248 HydrophobicContact CB-CG 4.28Å; P245-Q248 PolarHBondContact O-N 3.13Å; S246-Q248 VanDerWaalsContact C-N 3.3Å
249	L	74.9	Confident	79.5	Confident	23 Å²	23	46.7 Å²	46.7	12%	0.12	27%	0.267	C	S	.	.			trans	-119.8	118.1	177.7	-89.9	163	0	0	0	109.3	Y196 F217 W244 E253 L254	Y196-L249 HydrophobicContact CD2-CD1 3.92Å; Y196-L249 HydrophobicContact CE2-CB 4.3Å; Y196-L249 HydrophobicContact CE2-CD1 4.49Å; F217-L249 HydrophobicContact CE1-CD1 4.31Å; F217-L249 HydrophobicContact CE1-CD2 4.1Å; F217-L249 HydrophobicContact CE1-CG 4.5Å; F217-L249 HydrophobicContact CZ-CD1 4.25Å; F217-L249 HydrophobicContact CZ-CD2 4.38Å; W244-L249 HydrophobicContact CB-CD1 3.56Å; W244-L249 HydrophobicContact CB-CG 4.39Å; W244-L249 HydrophobicContact CG-CD1 4.21Å; L249-E253 WeakPolarHBondContact CA-OE2 3.17Å; L249-E253 HydrophobicContact CD2-CB 3.49Å; L249-E253 VanDerWaalsContact CD2-CB 3.49Å; L249-L254 HydrophobicContact CB-CD1 4Å; L249-L254 HydrophobicContact CD1-CD1 4.3Å
250	G	70.1	Confident	78.6	Confident	32 Å²	32	50.1 Å²	50.1	33%	0.33	28%	0.284	S	S	.	.			trans	-76.9	162.6	166.5	0	0	0	0	0	112.2	S252 E253 L254	G250-S252 PolarHBondContact O-N 3.05Å; G250-E253 PolarHBondContact N-OE2 3.2Å; G250-E253 PolarHBondContact O-N 2.7Å; G250-E253 VanDerWaalsContact O-N 3.11Å; G250-L254 PolarHBondContact O-N 2.97Å
251	D	71	Confident	77.5	Confident	133 Å²	133	50.6 Å²	50.6	71%	0.711	29%	0.286	S	S	*	.	H	α-helix	trans	-57.3	-32.6	-179.5	-69.6	-31	0	0	0	113.2	S255	D251-S255 WeakPolarHBondContact O-CB 3.32Å; D251-S255 PolarHBondContact O-N 2.7Å; D251-S255 PolarHBondContact O-OG 3.01Å
252	S	73.3	Confident	76.7	Confident	91 Å²	91	55.3 Å²	55.3	64%	0.636	31%	0.307	S	S	*	.	H	α-helix	trans	-67.2	-43.4	176.9	52.5	0	0	0	0	112.6	G250 L254 S255 S256	G250-S252 PolarHBondContact O-N 3.05Å; S252-L254 VanDerWaalsContact C-N 3.34Å; S252-S255 PolarHBondContact O-N 2.6Å; S252-S256 WeakPolarHBondContact O-CB 3.15Å; S252-S256 PolarHBondContact O-N 2.89Å
253	E	69.7	Low	75.8	Confident	102 Å²	102	59.7 Å²	59.7	48%	0.477	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-36.8	178.4	-65.5	163	146.8	0	0	110.6	L249 G250 S255 S256 F257	L249-E253 WeakPolarHBondContact CA-OE2 3.17Å; L249-E253 HydrophobicContact CD2-CB 3.49Å; L249-E253 VanDerWaalsContact CD2-CB 3.49Å; G250-E253 PolarHBondContact N-OE2 3.2Å; G250-E253 PolarHBondContact O-N 2.7Å; G250-E253 VanDerWaalsContact O-N 3.11Å; E253-S255 VanDerWaalsContact C-N 3.33Å; E253-S255 PolarHBondContact O-N 3.15Å; E253-S256 PolarHBondContact O-N 3.12Å; E253-F257 VanDerWaalsContact O-CB 3.24Å; E253-F257 WeakPolarHBondContact O-CB 3.19Å; E253-F257 PolarHBondContact O-N 3.38Å
254	L	69.3	Low	74.9	Confident	29 Å²	29	60.3 Å²	60.3	15%	0.152	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-41.4	174.6	-138.4	106.9	0	0	0	112.3	Y196 L249 G250 S252 S258 L277	Y196-L254 HydrophobicContact CD1-CD1 4.4Å; Y196-L254 HydrophobicContact CD2-CD1 3.69Å; Y196-L254 HydrophobicContact CE1-CD1 4.06Å; Y196-L254 HydrophobicContact CE2-CD1 3.26Å; Y196-L254 HydrophobicContact CG-CD1 4.24Å; Y196-L254 VanDerWaalsContact CZ-CD1 3.48Å; L249-L254 HydrophobicContact CB-CD1 4Å; L249-L254 HydrophobicContact CD1-CD1 4.3Å; G250-L254 PolarHBondContact O-N 2.97Å; S252-L254 VanDerWaalsContact C-N 3.34Å; L254-S258 WeakPolarHBondContact O-CB 3.27Å; L254-S258 PolarHBondContact O-N 3.3Å; L254-S258 PolarHBondContact O-OG 2.83Å; L254-L277 HydrophobicContact CD1-CD2 4.48Å; L254-L277 HydrophobicContact CD2-CD2 3.22Å; L254-L277 HydrophobicContact CG-CD2 3.76Å
255	S	73.7	Confident	73.9	Confident	75 Å²	75	59.5 Å²	59.5	52%	0.524	33%	0.333	S	S	.	.	H	α-helix	trans	-67.8	-47.6	177.9	-58.6	0	0	0	0	111	D251 S252 E253 F257 S258 E259	D251-S255 WeakPolarHBondContact O-CB 3.32Å; D251-S255 PolarHBondContact O-N 2.7Å; D251-S255 PolarHBondContact O-OG 3.01Å; S252-S255 PolarHBondContact O-N 2.6Å; E253-S255 VanDerWaalsContact C-N 3.33Å; E253-S255 PolarHBondContact O-N 3.15Å; S255-F257 VanDerWaalsContact C-N 3.32Å; S255-F257 PolarHBondContact O-N 2.91Å; S255-S258 PolarHBondContact O-N 3.45Å; S255-E259 WeakPolarHBondContact O-CB 3.32Å; S255-E259 PolarHBondContact O-N 3.39Å
256	S	73.1	Confident	72.9	Confident	54 Å²	54	63.1 Å²	63.1	38%	0.378	35%	0.352	S	S	.	.	H	α-helix	trans	-57.8	-43.8	174.2	174.7	0	0	0	0	112	S252 E253 E259 Q260	S252-S256 WeakPolarHBondContact O-CB 3.15Å; S252-S256 PolarHBondContact O-N 2.89Å; E253-S256 PolarHBondContact O-N 3.12Å; S256-E259 PolarHBondContact O-N 3.46Å; S256-Q260 WeakPolarHBondContact O-CG 3.46Å; S256-Q260 PolarHBondContact O-N 3.08Å
257	F	69.6	Low	71.8	Confident	11 Å²	11	68 Å²	68	5%	0.048	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-44.5	176.9	-179.3	-98.8	0	0	0	112.1	I216 F217 L243 E253 S255 E259 Q260 I261	I216-F257 HydrophobicContact CD1-CD2 3.78Å; I216-F257 HydrophobicContact CD1-CE2 3.79Å; I216-F257 HydrophobicContact CG2-CD2 4.39Å; F217-F257 HydrophobicContact CD2-CE2 4.35Å; F217-F257 AromaticContact CE2-CD2 3.64Å; F217-F257 HydrophobicContact CE2-CD2 3.64Å; F217-F257 AromaticContact CE2-CE2 3.39Å; F217-F257 HydrophobicContact CE2-CE2 3.39Å; F217-F257 HydrophobicContact CE2-CG 4.4Å; F217-F257 AromaticContact CE2-CZ 3.97Å; F217-F257 HydrophobicContact CE2-CZ 3.97Å; F217-F257 AromaticContact CZ-CD2 3.67Å; F217-F257 HydrophobicContact CZ-CD2 3.67Å; F217-F257 AromaticContact CZ-CE2 3.94Å; F217-F257 HydrophobicContact CZ-CE2 3.94Å; F217-F257 HydrophobicContact CZ-CG 4.18Å; L243-F257 HydrophobicContact CD1-CD1 4.2Å; L243-F257 HydrophobicContact CD1-CE1 3.46Å; L243-F257 VanDerWaalsContact CD1-CE1 3.46Å; L243-F257 HydrophobicContact CD1-CZ 4.15Å; L243-F257 HydrophobicContact CD2-CE1 3.6Å; L243-F257 HydrophobicContact CD2-CE2 4.49Å; L243-F257 HydrophobicContact CD2-CZ 3.38Å; L243-F257 HydrophobicContact CG-CE1 4.07Å; L243-F257 HydrophobicContact CG-CZ 4.26Å; E253-F257 VanDerWaalsContact O-CB 3.24Å; E253-F257 WeakPolarHBondContact O-CB 3.19Å; E253-F257 PolarHBondContact O-N 3.38Å; S255-F257 VanDerWaalsContact C-N 3.32Å; S255-F257 PolarHBondContact O-N 2.91Å; F257-E259 VanDerWaalsContact C-N 3.29Å; F257-E259 PolarHBondContact O-N 2.95Å; F257-Q260 PolarHBondContact O-N 3.38Å; F257-I261 HydrophobicContact CD1-CD1 4.25Å; F257-I261 HydrophobicContact CD1-CG1 4.44Å; F257-I261 HydrophobicContact CE1-CD1 3.27Å; F257-I261 HydrophobicContact CE1-CG1 3.81Å; F257-I261 HydrophobicContact CE2-CD1 4.33Å; F257-I261 HydrophobicContact CE2-CG1 4.27Å; F257-I261 HydrophobicContact CZ-CD1 3.32Å; F257-I261 HydrophobicContact CZ-CG1 3.7Å; F257-I261 PolarHBondContact O-N 3.3Å
258	S	72.3	Confident	70.7	Confident	53 Å²	53	66 Å²	66	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-60.8	-40.9	177	-61.1	0	0	0	0	111.4	L254 S255 I261 F262	L254-S258 WeakPolarHBondContact O-CB 3.27Å; L254-S258 PolarHBondContact O-N 3.3Å; L254-S258 PolarHBondContact O-OG 2.83Å; S255-S258 PolarHBondContact O-N 3.45Å; S258-I261 PolarHBondContact O-N 3.21Å; S258-F262 WeakPolarHBondContact O-CB 3.46Å; S258-F262 PolarHBondContact O-N 2.97Å
259	E	74.7	Confident	69.9	Low	130 Å²	130	69.4 Å²	69.4	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-67.2	-41	177.8	-156	175.5	-150.7	0	0	112	S255 S256 F257 F262 N263	S255-E259 WeakPolarHBondContact O-CB 3.32Å; S255-E259 PolarHBondContact O-N 3.39Å; S256-E259 PolarHBondContact O-N 3.46Å; F257-E259 VanDerWaalsContact C-N 3.29Å; F257-E259 PolarHBondContact O-N 2.95Å; E259-F262 WeakPolarHBondContact O-CB 3.43Å; E259-F262 PolarHBondContact O-N 3Å; E259-N263 WeakPolarHBondContact O-CB 3.16Å; E259-N263 VanDerWaalsContact O-CG 3.31Å; E259-N263 PolarHBondContact O-N 3.11Å; E259-N263 PolarHBondContact O-ND2 2.88Å
260	Q	71.1	Confident	69.2	Low	86 Å²	86	69.6 Å²	69.6	40%	0.402	39%	0.394	S	S	.	.	H	α-helix	trans	-66.4	-41	174.9	-73.7	-178.5	16.4	0	0	112.8	S256 F257 F262 N263 A264	S256-Q260 WeakPolarHBondContact O-CG 3.46Å; S256-Q260 PolarHBondContact O-N 3.08Å; F257-Q260 PolarHBondContact O-N 3.38Å; Q260-F262 VanDerWaalsContact C-N 3.3Å; Q260-N263 PolarHBondContact O-N 2.9Å; Q260-A264 WeakPolarHBondContact O-CB 3.35Å; Q260-A264 PolarHBondContact O-N 3.21Å
261	I	69.2	Low	68.5	Low	10 Å²	10	72 Å²	72	5%	0.051	41%	0.406	C	S	.	.	H	α-helix	trans	-60.3	-44.8	171	-78.8	-161	0	0	0	110.1	F198 F257 S258 N263 A264 C265 L272	F198-I261 HydrophobicContact CD2-CD1 4.14Å; F198-I261 HydrophobicContact CD2-CG2 4.48Å; F198-I261 HydrophobicContact CE2-CD1 4.35Å; F198-I261 HydrophobicContact CE2-CG2 3.8Å; F198-I261 HydrophobicContact CG-CD1 4.37Å; F198-I261 HydrophobicContact CZ-CG2 4.11Å; F257-I261 HydrophobicContact CD1-CD1 4.25Å; F257-I261 HydrophobicContact CD1-CG1 4.44Å; F257-I261 HydrophobicContact CE1-CD1 3.27Å; F257-I261 HydrophobicContact CE1-CG1 3.81Å; F257-I261 HydrophobicContact CE2-CD1 4.33Å; F257-I261 HydrophobicContact CE2-CG1 4.27Å; F257-I261 HydrophobicContact CZ-CD1 3.32Å; F257-I261 HydrophobicContact CZ-CG1 3.7Å; F257-I261 PolarHBondContact O-N 3.3Å; S258-I261 PolarHBondContact O-N 3.21Å; I261-N263 VanDerWaalsContact C-N 3.35Å; I261-N263 PolarHBondContact O-N 3.11Å; I261-A264 PolarHBondContact O-N 3.35Å; I261-C265 WeakPolarHBondContact O-CB 3.42Å; I261-C265 PolarHBondContact O-N 2.88Å; I261-C265 PolarHBondContact O-SG 3.23Å; I261-C265 VanDerWaalsContact O-SG 3.33Å; I261-L272 HydrophobicContact CG2-CD1 4.41Å
262	F	72.4	Confident	67.9	Low	100 Å²	100	67.1 Å²	67.1	44%	0.439	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-47	-179.5	-168.7	-95.5	0	0	0	111.6	S258 E259 Q260 C265 N266 L272	S258-F262 WeakPolarHBondContact O-CB 3.46Å; S258-F262 PolarHBondContact O-N 2.97Å; E259-F262 WeakPolarHBondContact O-CB 3.43Å; E259-F262 PolarHBondContact O-N 3Å; Q260-F262 VanDerWaalsContact C-N 3.3Å; F262-C265 PolarHBondContact O-N 2.91Å; F262-N266 WeakPolarHBondContact CD1-ND2 3.07Å; F262-N266 WeakPolarHBondContact CE1-ND2 3.29Å; F262-N266 PolarHBondContact O-N 2.91Å; F262-L272 HydrophobicContact CB-CD1 4.17Å; F262-L272 HydrophobicContact CD2-CB 4.28Å; F262-L272 HydrophobicContact CD2-CD1 3.49Å; F262-L272 VanDerWaalsContact CD2-CD1 3.49Å; F262-L272 HydrophobicContact CE2-CB 4.28Å; F262-L272 HydrophobicContact CE2-CD1 4.2Å; F262-L272 HydrophobicContact CG-CD1 4.12Å
263	N	72.5	Confident	66.8	Low	91 Å²	91	70.8 Å²	70.8	49%	0.487	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-45.5	175.8	-73	-27.1	0	0	0	111.9	E259 Q260 I261 C265 N266 T267	E259-N263 WeakPolarHBondContact O-CB 3.16Å; E259-N263 VanDerWaalsContact O-CG 3.31Å; E259-N263 PolarHBondContact O-N 3.11Å; E259-N263 PolarHBondContact O-ND2 2.88Å; Q260-N263 PolarHBondContact O-N 2.9Å; I261-N263 VanDerWaalsContact C-N 3.35Å; I261-N263 PolarHBondContact O-N 3.11Å; N263-C265 PolarHBondContact O-N 3.42Å; N263-N266 PolarHBondContact O-N 2.81Å; N263-T267 PolarHBondContact O-N 2.79Å; N263-T267 PolarHBondContact O-OG1 2.96Å
264	A	65.7	Low	65.9	Low	15 Å²	15	74.7 Å²	74.7	12%	0.124	40%	0.402	C	S	.	.	H	α-helix	trans	-61.4	-43.1	176.8	0	0	0	0	0	112.6	L212 Q260 I261 T267 V268	L212-A264 HydrophobicContact CD1-CB 3.18Å; L212-A264 HydrophobicContact CD2-CB 4.44Å; L212-A264 HydrophobicContact CG-CB 4.42Å; Q260-A264 WeakPolarHBondContact O-CB 3.35Å; Q260-A264 PolarHBondContact O-N 3.21Å; I261-A264 PolarHBondContact O-N 3.35Å; A264-T267 WeakPolarHBondContact O-CB 3.45Å; A264-T267 PolarHBondContact O-N 2.83Å; A264-V268 WeakPolarHBondContact O-CG2 3.44Å; A264-V268 PolarHBondContact O-N 2.82Å
265	C	64.9	Low	65.4	Low	3 Å²	3	75.7 Å²	75.7	2%	0.02	41%	0.41	C	S	.	.	H	α-helix	trans	-65.3	-38.5	176.9	-70.5	0	0	0	0	112.6	I261 F262 N263 T267 V268 N269 I270 L272	I261-C265 WeakPolarHBondContact O-CB 3.42Å; I261-C265 PolarHBondContact O-N 2.88Å; I261-C265 PolarHBondContact O-SG 3.23Å; I261-C265 VanDerWaalsContact O-SG 3.33Å; F262-C265 PolarHBondContact O-N 2.91Å; N263-C265 PolarHBondContact O-N 3.42Å; C265-T267 VanDerWaalsContact C-N 3.3Å; C265-T267 PolarHBondContact O-N 3.16Å; C265-V268 CarbonylContact O-C 3.57Å; C265-V268 PolarHBondContact O-N 3.11Å; C265-V268 VanDerWaalsContact O-N 3.14Å; C265-N269 PolarHBondContact O-N 3.35Å; C265-I270 PolarHBondContact O-N 2.93Å; C265-I270 VanDerWaalsContact O-N 3.07Å; C265-L272 HydrophobicContact CB-CD1 3.41Å; C265-L272 VanDerWaalsContact CB-CD1 3.41Å; C265-L272 HydrophobicContact CB-CD2 4.2Å; C265-L272 HydrophobicContact CB-CG 3.7Å
266	N	68.4	Low	65.1	Low	76 Å²	76	77 Å²	77	41%	0.406	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-38.5	172.4	-81.3	-18.6	0	0	0	112	F262 N263 V268 N269	F262-N266 WeakPolarHBondContact CD1-ND2 3.07Å; F262-N266 WeakPolarHBondContact CE1-ND2 3.29Å; F262-N266 PolarHBondContact O-N 2.91Å; N263-N266 PolarHBondContact O-N 2.81Å; N266-V268 PolarHBondContact O-N 3.15Å; N266-V268 VanDerWaalsContact O-N 3.16Å; N266-N269 PolarHBondContact O-N 2.69Å
267	T	65.4	Low	65.4	Low	122 Å²	122	77.1 Å²	77.1	75%	0.748	41%	0.406	S	S	*	.	H	α-helix	trans	-61.7	-25.1	177.5	-38.6	0	0	0	0	111.9	N263 A264 C265	N263-T267 PolarHBondContact O-N 2.79Å; N263-T267 PolarHBondContact O-OG1 2.96Å; A264-T267 WeakPolarHBondContact O-CB 3.45Å; A264-T267 PolarHBondContact O-N 2.83Å; C265-T267 VanDerWaalsContact C-N 3.3Å; C265-T267 PolarHBondContact O-N 3.16Å
268	V	63.8	Low	66.3	Low	65 Å²	65	79.3 Å²	79.3	39%	0.394	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	10.8	177.8	-160.2	0	0	0	0	112.2	T208 A264 C265 N266 I270	T208-V268 HydrophobicContact CG2-CG2 4.41Å; A264-V268 WeakPolarHBondContact O-CG2 3.44Å; A264-V268 PolarHBondContact O-N 2.82Å; C265-V268 CarbonylContact O-C 3.57Å; C265-V268 PolarHBondContact O-N 3.11Å; C265-V268 VanDerWaalsContact O-N 3.14Å; N266-V268 PolarHBondContact O-N 3.15Å; N266-V268 VanDerWaalsContact O-N 3.16Å; V268-I270 HydrophobicContact CB-CD1 4.34Å; V268-I270 HydrophobicContact CG1-CD1 4.06Å; V268-I270 PolarHBondContact O-N 2.95Å
269	N	62.3	Low	67.1	Low	157 Å²	157	81.7 Å²	81.7	84%	0.84	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	39.2	178.7	-101.9	-9	0	0	0	114.6	C265 N266	C265-N269 PolarHBondContact O-N 3.35Å; N266-N269 PolarHBondContact O-N 2.69Å
270	I	59.9	Low	68.1	Low	27 Å²	27	76.9 Å²	76.9	14%	0.138	40%	0.401	C	S	.	.			trans	-114.2	116.8	-178.5	-69.7	165.6	0	0	0	110	E202 R204 I205 C265 V268 L272	E202-I270 HydrophobicContact CG-CD1 4.01Å; E202-I270 HydrophobicContact CG-CG2 4.2Å; R204-I270 HydrophobicContact CB-CD1 4.23Å; I205-I270 HydrophobicContact CG2-CB 4.11Å; I205-I270 HydrophobicContact CG2-CD1 3.18Å; I205-I270 HydrophobicContact CG2-CG1 4.18Å; I205-I270 HydrophobicContact CG2-CG2 3.95Å; C265-I270 PolarHBondContact O-N 2.93Å; C265-I270 VanDerWaalsContact O-N 3.07Å; V268-I270 HydrophobicContact CB-CD1 4.34Å; V268-I270 HydrophobicContact CG1-CD1 4.06Å; V268-I270 PolarHBondContact O-N 2.95Å; I270-L272 PolarHBondContact O-N 3.05Å
271	S	55.8	Low	69.3	Low	83 Å²	83	78.1 Å²	78.1	58%	0.58	41%	0.406	S	S	*	.			trans	-69.8	111.6	177.7	-174.1	0	0	0	0	110	E273	S271-E273 PolarHBondContact O-N 2.61Å; S271-E273 WeakPolarHBondContact OG-CG 3.32Å; S271-E273 PolarHBondContact OG-OE1 3.16Å
272	L	58.2	Low	70.5	Confident	29 Å²	29	77.6 Å²	77.6	15%	0.152	40%	0.403	C	S	.	.			trans	-77	52.6	175.9	-78	166.3	0	0	0	111.5	F198 I261 F262 C265 I270 K274 T275	F198-L272 HydrophobicContact CE2-CD2 4.18Å; F198-L272 HydrophobicContact CZ-CD2 3.91Å; I261-L272 HydrophobicContact CG2-CD1 4.41Å; F262-L272 HydrophobicContact CB-CD1 4.17Å; F262-L272 HydrophobicContact CD2-CB 4.28Å; F262-L272 HydrophobicContact CD2-CD1 3.49Å; F262-L272 VanDerWaalsContact CD2-CD1 3.49Å; F262-L272 HydrophobicContact CE2-CB 4.28Å; F262-L272 HydrophobicContact CE2-CD1 4.2Å; F262-L272 HydrophobicContact CG-CD1 4.12Å; C265-L272 HydrophobicContact CB-CD1 3.41Å; C265-L272 VanDerWaalsContact CB-CD1 3.41Å; C265-L272 HydrophobicContact CB-CD2 4.2Å; C265-L272 HydrophobicContact CB-CG 3.7Å; I270-L272 PolarHBondContact O-N 3.05Å; L272-K274 PolarHBondContact O-N 3.02Å; L272-T275 HydrophobicContact CD2-CG2 3.25Å; L272-T275 VanDerWaalsContact CD2-OG1 3.25Å; L272-T275 WeakPolarHBondContact CD2-OG1 3.25Å
273	E	51.2	Low	71.6	Confident	169 Å²	169	72.9 Å²	72.9	79%	0.79	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.5	-176.3	-93.3	168.8	-141.6	0	0	113.5	S271	S271-E273 PolarHBondContact O-N 2.61Å; S271-E273 WeakPolarHBondContact OG-CG 3.32Å; S271-E273 PolarHBondContact OG-OE1 3.16Å
274	K	51	Low	72.6	Confident	184 Å²	184	69.9 Å²	69.9	80%	0.8	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.2	51.7	-177.5	-70	-171.4	179.7	176.7	0	114	L272	L272-K274 PolarHBondContact O-N 3.02Å
275	T	57.7	Low	73.9	Confident	49 Å²	49	73.1 Å²	73.1	30%	0.301	38%	0.383	S	S	.	.			trans	-96.9	112.8	172.3	33.4	0	0	0	0	112.1	F198 L272	F198-T275 HydrophobicContact CD2-CG2 4.1Å; F198-T275 HydrophobicContact CE1-CG2 4.15Å; F198-T275 VanDerWaalsContact CE2-CB 3.45Å; F198-T275 HydrophobicContact CE2-CG2 3.16Å; F198-T275 HydrophobicContact CZ-CG2 3.21Å; L272-T275 HydrophobicContact CD2-CG2 3.25Å; L272-T275 VanDerWaalsContact CD2-OG1 3.25Å; L272-T275 WeakPolarHBondContact CD2-OG1 3.25Å
276	L	68.5	Low	75.3	Confident	103 Å²	103	78.5 Å²	78.5	54%	0.539	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.3	177.3	-72.5	155.8	0	0	0	107.7	R199 L278	R199-L276 PolarHBondContact N-O 3.39Å; L276-L278 HydrophobicContact CB-CD1 3.98Å; L276-L278 HydrophobicContact CB-CD2 4.09Å; L276-L278 HydrophobicContact CB-CG 3.79Å; L276-L278 PolarHBondContact O-N 3.48Å
277	L	78.9	Confident	76.6	Confident	57 Å²	57	75.2 Å²	75.2	30%	0.298	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	116.1	161.2	-169.6	73.4	0	0	0	107.3	Y196 L243 L254	Y196-L277 HydrophobicContact CD1-CD2 4.39Å; Y196-L277 HydrophobicContact CD1-CG 4.25Å; L243-L277 HydrophobicContact CD1-CD1 3.24Å; L254-L277 HydrophobicContact CD1-CD2 4.48Å; L254-L277 HydrophobicContact CD2-CD2 3.22Å; L254-L277 HydrophobicContact CG-CD2 3.76Å
278	L	87.4	Confident	77.9	Confident	57 Å²	57	71.4 Å²	71.4	30%	0.298	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	167.1	-173	-66.1	173.8	0	0	0	110.2	Y196 F197 L276	Y196-L278 CarbonylContact C-O 3.58Å; Y196-L278 VanDerWaalsContact CA-O 3.3Å; Y196-L278 WeakPolarHBondContact CA-O 3.31Å; F197-L278 HydrophobicContact CD1-CB 3.9Å; F197-L278 WeakPolarHBondContact CD1-O 3.29Å; F197-L278 HydrophobicContact CE1-CB 3.29Å; F197-L278 HydrophobicContact CE1-CD1 4.32Å; F197-L278 HydrophobicContact CE1-CG 4.44Å; F197-L278 HydrophobicContact CE2-CB 4.13Å; F197-L278 HydrophobicContact CE2-CD1 4.06Å; F197-L278 HydrophobicContact CZ-CB 3.44Å; F197-L278 VanDerWaalsContact CZ-CB 3.44Å; F197-L278 HydrophobicContact CZ-CD1 3.59Å; F197-L278 HydrophobicContact CZ-CG 4.15Å; F197-L278 PolarHBondContact N-O 2.91Å; F197-L278 PolarHBondContact O-N 2.82Å; L276-L278 HydrophobicContact CB-CD1 3.98Å; L276-L278 HydrophobicContact CB-CD2 4.09Å; L276-L278 HydrophobicContact CB-CG 3.79Å; L276-L278 PolarHBondContact O-N 3.48Å
279	K	90.6	Very high	79.4	Confident	102 Å²	102	68.8 Å²	68.8	44%	0.443	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.2	176.4	-69.5	175	162	-148.4	0	110.6	E194 F195 Y196	E194-K279 HydrophobicContact CG-CB 4.16Å; E194-K279 HydrophobicContact CG-CD 4.47Å; E194-K279 HydrophobicContact CG-CG 4.47Å; E194-K279 WeakPolarHBondContact OE2-CD 3.26Å; E194-K279 WeakPolarHBondContact OE2-CE 3.44Å; E194-K279 IonicContact OE2-NZ 3.71Å; E194-K279 PolarHBondContact OE2-NZ 3.46Å; F195-K279 CarbonylContact O-C 3.51Å; F195-K279 WeakPolarHBondContact O-CA 3.43Å; Y196-K279 HydrophobicContact CD1-CG 3.72Å; Y196-K279 HydrophobicContact CE1-CD 3.99Å; Y196-K279 HydrophobicContact CE1-CG 3.55Å; Y196-K279 WeakPolarHBondContact OH-CE 3.49Å
280	T	94.3	Very high	80.9	Confident	29 Å²	29	66.4 Å²	66.4	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.2	174.4	-161.4	0	0	0	0	110.8	E194 F195 F197 L242 V282 W300	E194-T280 CarbonylContact C-O 3.52Å; E194-T280 WeakPolarHBondContact CA-O 3.36Å; F195-T280 PolarHBondContact N-O 3.41Å; F195-T280 PolarHBondContact O-N 2.8Å; F197-T280 HydrophobicContact CD1-CG2 3.68Å; F197-T280 HydrophobicContact CE1-CG2 4.18Å; F197-T280 HydrophobicContact CG-CG2 4.43Å; L242-T280 HydrophobicContact CD1-CG2 4.14Å; T280-V282 HydrophobicContact CG2-CG1 3.92Å; T280-W300 HydrophobicContact CG2-CE3 4.15Å; T280-W300 HydrophobicContact CG2-CZ3 3.76Å
281	F	96.2	Very high	82.6	Confident	112 Å²	112	69.1 Å²	69.1	49%	0.491	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.4	175.2	-75.1	-86.2	0	0	0	110	L192 R193 E194 V299	L192-F281 HydrophobicContact CB-CB 4.15Å; L192-F281 HydrophobicContact CB-CD1 4.1Å; L192-F281 HydrophobicContact CD1-CB 4.12Å; R193-F281 WeakPolarHBondContact O-CA 3.46Å; E194-F281 HydrophobicContact CB-CD1 4.12Å; E194-F281 HydrophobicContact CB-CE1 3.76Å; E194-F281 HydrophobicContact CB-CZ 4.06Å; E194-F281 HydrophobicContact CG-CZ 4.38Å; F281-V299 WeakPolarHBondContact O-CG1 3.4Å
282	V	95.8	Very high	84.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	157.4	178.9	-57.5	0	0	0	0	110.8	L192 R193 F195 L225 L242 T280 A284 W300	L192-V282 CarbonylContact C-O 3.57Å; L192-V282 WeakPolarHBondContact CA-O 3.2Å; R193-V282 PolarHBondContact N-O 2.99Å; R193-V282 PolarHBondContact O-N 3.44Å; F195-V282 HydrophobicContact CB-CG2 4.31Å; F195-V282 HydrophobicContact CD2-CG2 3.32Å; F195-V282 HydrophobicContact CE2-CG2 3.6Å; F195-V282 HydrophobicContact CG-CG2 3.82Å; F195-V282 HydrophobicContact CZ-CG2 4.3Å; L225-V282 HydrophobicContact CD1-CB 4.47Å; L225-V282 HydrophobicContact CD1-CG2 3.75Å; L225-V282 HydrophobicContact CD2-CB 4.14Å; L225-V282 HydrophobicContact CD2-CG2 4.26Å; L242-V282 HydrophobicContact CD1-CG1 3.99Å; L242-V282 HydrophobicContact CD2-CG1 4.19Å; L242-V282 HydrophobicContact CD2-CG2 4.37Å; T280-V282 HydrophobicContact CG2-CG1 3.92Å; V282-A284 PolarHBondContact O-N 3.31Å; V282-A284 VanDerWaalsContact O-N 3.14Å; V282-W300 HydrophobicContact CB-CB 4.15Å; V282-W300 HydrophobicContact CB-CG 4.24Å; V282-W300 HydrophobicContact CG1-CB 3.93Å; V282-W300 HydrophobicContact CG1-CD2 3.61Å; V282-W300 HydrophobicContact CG1-CE3 3.66Å; V282-W300 HydrophobicContact CG1-CG 3.69Å; V282-W300 HydrophobicContact CG1-CZ3 4.44Å
283	P	95.9	Very high	86.3	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	117.2	174.8	-25.2	35.5	0	0	0	111.9	L190 H224 E285 W295 A296 V299 V302	L190-P283 HydrophobicContact CB-CB 4.49Å; L190-P283 HydrophobicContact CD1-CB 4.26Å; H224-P283 PolarHBondContact NE2-O 3.44Å; P283-E285 VanDerWaalsContact C-N 3.26Å; P283-E285 PolarHBondContact O-N 3.08Å; P283-W295 HydrophobicContact CG-CZ3 4.28Å; P283-A296 HydrophobicContact CB-CB 4.3Å; P283-A296 HydrophobicContact CG-CB 3.82Å; P283-V299 HydrophobicContact CG-CB 4.43Å; P283-V302 HydrophobicContact CG-CG1 4.42Å
284	A	92.8	Very high	88.4	Confident	29 Å²	29	67.5 Å²	67.5	24%	0.24	32%	0.319	C	S	.	.	S	Bend	trans	-69.1	-28	-177.7	0	0	0	0	0	112.4	P191 R193 V282	P191-A284 HydrophobicContact CG-CB 4.35Å; P191-A284 WeakPolarHBondContact O-CB 3.44Å; P191-A284 PolarHBondContact O-N 2.83Å; R193-A284 HydrophobicContact CB-CB 3.8Å; V282-A284 PolarHBondContact O-N 3.31Å; V282-A284 VanDerWaalsContact O-N 3.14Å
285	E	92.6	Very high	90.6	Very high	82 Å²	82	61.2 Å²	61.2	38%	0.383	29%	0.29	S	S	.	.	S	Bend	trans	-118.2	158.7	-176.8	-63.6	-177.1	-121.9	0	0	111.3	R187 L190 P191 H224 P283	R187-E285 IonicContact CZ-OE1 2.57Å; R187-E285 IonicContact CZ-OE2 2.73Å; R187-E285 IonicContact NH1-OE1 3.04Å; R187-E285 PolarHBondContact NH1-OE1 3.37Å; R187-E285 IonicContact NH1-OE2 3.53Å; R187-E285 IonicContact NH2-OE1 2.84Å; R187-E285 PolarHBondContact NH2-OE1 3.41Å; R187-E285 IonicContact NH2-OE2 3.75Å; R187-E285 PolarHBondContact NH2-OE2 2.95Å; L190-E285 WeakPolarHBondContact CD1-O 3.18Å; P191-E285 HydrophobicContact CG-CG 4.08Å; P191-E285 WeakPolarHBondContact CG-OE1 3.38Å; H224-E285 PolarHBondContact CD2-O 2.81Å; H224-E285 VanDerWaalsContact CD2-O 3.25Å; H224-E285 PolarHBondContact NE2-O 3.37Å; P283-E285 VanDerWaalsContact C-N 3.26Å; P283-E285 PolarHBondContact O-N 3.08Å
286	E	93.9	Very high	92.4	Very high	117 Å²	117	58.9 Å²	58.9	55%	0.547	28%	0.276	S	S	.	.			trans	-71.6	141.7	174.4	68.5	176.2	178.6	0	0	111.9	H224 L288	H224-E286 HydrophobicContact CB-CB 3.52Å; E286-L288 HydrophobicContact CG-CD2 4.03Å; E286-L288 PolarHBondContact O-N 3.05Å
287	P	95.6	Very high	93.7	Very high	7 Å²	7	55.9 Å²	55.9	5%	0.045	27%	0.266	C	S	.	.			trans	-70.7	124.7	172.8	27.9	-32.3	0	0	0	110.7	L190 Q292 Y293 A296 V302 F304	L190-P287 HydrophobicContact CD1-CB 4.1Å; P287-Q292 HydrophobicContact CB-CB 3.92Å; P287-Y293 HydrophobicContact CG-CD2 4.35Å; P287-A296 HydrophobicContact CB-CB 4.48Å; P287-V302 HydrophobicContact CG-CG2 4.3Å; P287-F304 HydrophobicContact CB-CD2 4.32Å; P287-F304 HydrophobicContact CG-CB 4.27Å; P287-F304 HydrophobicContact CG-CD2 4.13Å; P287-F304 VanDerWaalsContact O-CD2 3.31Å; P287-F304 WeakPolarHBondContact O-CD2 3.4Å
288	L	94.5	Very high	94.4	Very high	42 Å²	42	57.7 Å²	57.7	22%	0.22	28%	0.283	C	S	.	.			trans	-94.9	-20.7	179.1	-59.2	177.9	0	0	0	112.9	K184 Y185 E286	K184-L288 HydrophobicContact CB-CD1 4.02Å; K184-L288 HydrophobicContact CD-CD1 4.04Å; K184-L288 HydrophobicContact CG-CD1 3.92Å; Y185-L288 HydrophobicContact CD1-CB 3.85Å; Y185-L288 HydrophobicContact CD1-CD1 4.1Å; Y185-L288 HydrophobicContact CE1-CB 3.92Å; Y185-L288 HydrophobicContact CE1-CD1 3.86Å; Y185-L288 HydrophobicContact CE1-CG 4.43Å; E286-L288 HydrophobicContact CG-CD2 4.03Å; E286-L288 PolarHBondContact O-N 3.05Å
289	T	95	Very high	94.8	Very high	10 Å²	10	56.8 Å²	56.8	6%	0.061	28%	0.28	C	S	.	.	S	Bend	trans	-127.4	160.6	-178.8	72.3	0	0	0	0	111.8	Y185 V291 Q292 Y293 I314	Y185-T289 HydrophobicContact CD1-CG2 4.16Å; Y185-T289 WeakPolarHBondContact O-CG2 3.36Å; T289-V291 PolarHBondContact O-N 3.34Å; T289-Q292 PolarHBondContact O-N 3.19Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.41Å; T289-Q292 PolarHBondContact OG1-N 3.01Å; T289-Y293 PolarHBondContact O-N 3.36Å; T289-I314 HydrophobicContact CG2-CD1 3.7Å
290	R	94	Very high	95	Very high	107 Å²	107	52 Å²	52	40%	0.404	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-37.6	177.2	-170	61.3	70.2	137.1	4.5	113	Y293 R294 E306	R290-Y293 PolarHBondContact O-N 3.27Å; R290-R294 WeakPolarHBondContact O-CG 3.44Å; R290-R294 PolarHBondContact O-N 2.91Å; R290-E306 WeakPolarHBondContact CB-OE1 3.43Å; R290-E306 IonicContact CZ-OE1 2.8Å; R290-E306 IonicContact CZ-OE2 2.61Å; R290-E306 IonicContact NE-OE1 3Å; R290-E306 PolarHBondContact NE-OE1 3.39Å; R290-E306 IonicContact NE-OE2 3.82Å; R290-E306 IonicContact NH2-OE1 3.98Å; R290-E306 PolarHBondContact NH2-OE1 2.89Å; R290-E306 IonicContact NH2-OE2 2.65Å; R290-E306 PolarHBondContact NH2-OE2 3.49Å
291	V	93.8	Very high	95.1	Very high	84 Å²	84	52.3 Å²	52.3	51%	0.509	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-49.1	179.3	177	0	0	0	0	109.5	A188 T289 Y293 R294 W295	A188-V291 HydrophobicContact CB-CG1 4.06Å; T289-V291 PolarHBondContact O-N 3.34Å; V291-Y293 VanDerWaalsContact C-N 3.31Å; V291-Y293 PolarHBondContact O-N 2.82Å; V291-R294 PolarHBondContact O-N 3.04Å; V291-W295 PolarHBondContact O-N 3.46Å; V291-W295 VanDerWaalsContact O-N 3.08Å
292	Q	95.7	Very high	95.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-42.5	175.1	-70.6	171.2	-3.7	0	0	111.9	K184 R187 L190 P287 T289 W295 A296	K184-Q292 PolarHBondContact O-NE2 3.12Å; R187-Q292 WeakPolarHBondContact O-CG 3.32Å; R187-Q292 PolarHBondContact O-NE2 3.09Å; L190-Q292 HydrophobicContact CD1-CB 4.46Å; L190-Q292 HydrophobicContact CD2-CB 4.27Å; L190-Q292 HydrophobicContact CD2-CG 4.01Å; L190-Q292 HydrophobicContact CG-CB 4.4Å; P287-Q292 HydrophobicContact CB-CB 3.92Å; T289-Q292 PolarHBondContact O-N 3.19Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.41Å; T289-Q292 PolarHBondContact OG1-N 3.01Å; Q292-W295 PolarHBondContact O-N 2.89Å; Q292-A296 WeakPolarHBondContact O-CB 3.47Å; Q292-A296 PolarHBondContact O-N 3.37Å
293	Y	96.2	Very high	95	Very high	68 Å²	68	48.7 Å²	48.7	27%	0.267	25%	0.253	S	S	.	.	H	α-helix	trans	-61.1	-46.8	176.9	167.3	-109.1	0	0	0	112.3	P287 T289 R290 V291 W295 A296 A297 V302 F304	P287-Y293 HydrophobicContact CG-CD2 4.35Å; T289-Y293 PolarHBondContact O-N 3.36Å; R290-Y293 PolarHBondContact O-N 3.27Å; V291-Y293 VanDerWaalsContact C-N 3.31Å; V291-Y293 PolarHBondContact O-N 2.82Å; Y293-W295 VanDerWaalsContact C-N 3.3Å; Y293-W295 PolarHBondContact O-N 3.3Å; Y293-A296 PolarHBondContact O-N 2.72Å; Y293-A297 HydrophobicContact CD2-CB 4.46Å; Y293-A297 HydrophobicContact CE2-CB 4.12Å; Y293-A297 WeakPolarHBondContact O-CB 3.2Å; Y293-A297 PolarHBondContact O-N 3.42Å; Y293-V302 HydrophobicContact CD2-CG2 3.74Å; Y293-V302 HydrophobicContact CE2-CG2 3.87Å; Y293-F304 HydrophobicContact CD1-CB 4.48Å; Y293-F304 AromaticContact CD1-CD1 3.77Å; Y293-F304 HydrophobicContact CD1-CD1 3.77Å; Y293-F304 HydrophobicContact CD1-CE1 4.37Å; Y293-F304 HydrophobicContact CD1-CG 4.33Å; Y293-F304 HydrophobicContact CD2-CB 3.19Å; Y293-F304 AromaticContact CD2-CD1 4Å; Y293-F304 HydrophobicContact CD2-CD1 4Å; Y293-F304 AromaticContact CD2-CG 3.73Å; Y293-F304 HydrophobicContact CD2-CG 3.73Å; Y293-F304 HydrophobicContact CE1-CD1 4.41Å; Y293-F304 HydrophobicContact CE2-CB 3.63Å; Y293-F304 HydrophobicContact CE2-CG 4.46Å; Y293-F304 HydrophobicContact CG-CB 3.66Å; Y293-F304 AromaticContact CG-CD1 3.51Å; Y293-F304 HydrophobicContact CG-CD1 3.51Å; Y293-F304 HydrophobicContact CG-CD2 4.44Å; Y293-F304 HydrophobicContact CG-CE1 4.25Å; Y293-F304 AromaticContact CG-CG 3.62Å; Y293-F304 HydrophobicContact CG-CG 3.62Å
294	R	96.1	Very high	95	Very high	178 Å²	178	50.4 Å²	50.4	67%	0.672	26%	0.26	S	S	*	.	H	α-helix	trans	-58.8	-44.5	178.5	-76.6	176.6	177	175	0	111.2	R290 V291 S298	R290-R294 WeakPolarHBondContact O-CG 3.44Å; R290-R294 PolarHBondContact O-N 2.91Å; V291-R294 PolarHBondContact O-N 3.04Å; R294-S298 PolarHBondContact O-N 3.15Å
295	W	96.4	Very high	95	Very high	52 Å²	52	57.4 Å²	57.4	20%	0.197	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-51.7	175.3	178.2	84.9	0	0	0	111.5	Q189 L190 L192 P283 V291 Q292 Y293 A297 S298 V299	Q189-W295 HydrophobicContact CB-CD2 4.07Å; Q189-W295 HydrophobicContact CB-CE3 4.49Å; Q189-W295 HydrophobicContact CB-CH2 4.35Å; Q189-W295 HydrophobicContact CB-CZ2 3.88Å; Q189-W295 HydrophobicContact CG-CD2 4.14Å; Q189-W295 HydrophobicContact CG-CG 4.2Å; Q189-W295 HydrophobicContact CG-CZ2 4.24Å; L190-W295 HydrophobicContact CB-CE3 4.31Å; L190-W295 HydrophobicContact CB-CZ3 3.71Å; L190-W295 HydrophobicContact CG-CE3 4.37Å; L190-W295 HydrophobicContact CG-CZ3 4.24Å; L190-W295 WeakPolarHBondContact O-CH2 3.31Å; L190-W295 WeakPolarHBondContact O-CZ3 3.3Å; L192-W295 HydrophobicContact CD2-CH2 3.68Å; L192-W295 HydrophobicContact CD2-CZ2 4.5Å; L192-W295 HydrophobicContact CD2-CZ3 4.43Å; L192-W295 HydrophobicContact CG-CH2 4.1Å; P283-W295 HydrophobicContact CG-CZ3 4.28Å; V291-W295 PolarHBondContact O-N 3.46Å; V291-W295 VanDerWaalsContact O-N 3.08Å; Q292-W295 PolarHBondContact O-N 2.89Å; Y293-W295 VanDerWaalsContact C-N 3.3Å; Y293-W295 PolarHBondContact O-N 3.3Å; W295-A297 VanDerWaalsContact C-N 3.31Å; W295-A297 PolarHBondContact O-N 3.45Å; W295-S298 WeakPolarHBondContact O-CA 3.47Å; W295-S298 WeakPolarHBondContact O-CB 3.37Å; W295-S298 PolarHBondContact O-N 3.02Å; W295-S298 PolarHBondContact O-OG 2.78Å; W295-V299 HydrophobicContact CD2-CG2 4.42Å; W295-V299 HydrophobicContact CH2-CG2 4.1Å; W295-V299 HydrophobicContact CZ2-CG2 3.94Å; W295-V299 HydrophobicContact CZ3-CG2 4.38Å; W295-V299 PolarHBondContact O-N 2.77Å
296	A	96.1	Very high	94.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-43.9	-178.9	0	0	0	0	0	111.7	L190 P283 P287 Q292 Y293 S298 V299 W300 V302	L190-A296 HydrophobicContact CD1-CB 4.12Å; P283-A296 HydrophobicContact CB-CB 4.3Å; P283-A296 HydrophobicContact CG-CB 3.82Å; P287-A296 HydrophobicContact CB-CB 4.48Å; Q292-A296 WeakPolarHBondContact O-CB 3.47Å; Q292-A296 PolarHBondContact O-N 3.37Å; Y293-A296 PolarHBondContact O-N 2.72Å; A296-S298 PolarHBondContact O-N 2.96Å; A296-V299 PolarHBondContact O-N 3.33Å; A296-W300 CarbonylContact C-O 3.41Å; A296-W300 PolarHBondContact O-N 3.28Å; A296-V302 HydrophobicContact CB-CG1 4.36Å; A296-V302 HydrophobicContact CB-CG2 3.81Å
297	A	95.5	Very high	94.9	Very high	41 Å²	41	55.1 Å²	55.1	34%	0.339	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-25.1	177	0	0	0	0	0	113.4	Y293 W295 V299 W300 V302	Y293-A297 HydrophobicContact CD2-CB 4.46Å; Y293-A297 HydrophobicContact CE2-CB 4.12Å; Y293-A297 WeakPolarHBondContact O-CB 3.2Å; Y293-A297 PolarHBondContact O-N 3.42Å; W295-A297 VanDerWaalsContact C-N 3.31Å; W295-A297 PolarHBondContact O-N 3.45Å; A297-V299 VanDerWaalsContact C-N 3.34Å; A297-W300 WeakPolarHBondContact CA-O 3.44Å; A297-V302 HydrophobicContact CB-CG2 4.22Å
298	S	94.9	Very high	94.8	Very high	94 Å²	94	63.1 Å²	63.1	66%	0.657	31%	0.314	S	S	*	.	H	α-helix	trans	-74.2	-25.5	172.9	77.4	0	0	0	0	112.8	R294 W295 A296	R294-S298 PolarHBondContact O-N 3.15Å; W295-S298 WeakPolarHBondContact O-CA 3.47Å; W295-S298 WeakPolarHBondContact O-CB 3.37Å; W295-S298 PolarHBondContact O-N 3.02Å; W295-S298 PolarHBondContact O-OG 2.78Å; A296-S298 PolarHBondContact O-N 2.96Å
299	V	94.9	Very high	94.8	Very high	39 Å²	39	68.2 Å²	68.2	24%	0.236	33%	0.33	C	S	.	.	H	α-helix	trans	-88.4	-53.5	177.4	-179.1	0	0	0	0	111	L192 R229 F281 P283 W295 A296 A297	L192-V299 HydrophobicContact CD2-CG1 3.88Å; R229-V299 PolarHBondContact NH1-O 3.33Å; F281-V299 WeakPolarHBondContact O-CG1 3.4Å; P283-V299 HydrophobicContact CG-CB 4.43Å; W295-V299 HydrophobicContact CD2-CG2 4.42Å; W295-V299 HydrophobicContact CH2-CG2 4.1Å; W295-V299 HydrophobicContact CZ2-CG2 3.94Å; W295-V299 HydrophobicContact CZ3-CG2 4.38Å; W295-V299 PolarHBondContact O-N 2.77Å; A296-V299 PolarHBondContact O-N 3.33Å; A297-V299 VanDerWaalsContact C-N 3.34Å
300	W	95.9	Very high	94.7	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.332	C	S	.	.	S	Bend	trans	-147.9	143.7	-179.7	-167.9	-92.6	0	0	0	110.9	K226 R229 D240 L242 T280 V282 A296 A297 V302	K226-W300 PolarHBondContact O-NE1 3.24Å; R229-W300 HydrophobicContact CB-CH2 4Å; R229-W300 HydrophobicContact CB-CZ2 3.94Å; R229-W300 HydrophobicContact CB-CZ3 4.47Å; R229-W300 VanDerWaalsContact NH1-CE3 3.25Å; R229-W300 VanDerWaalsContact NH2-CZ3 3.33Å; D240-W300 HydrophobicContact CB-CH2 3.97Å; L242-W300 HydrophobicContact CB-CH2 4.39Å; L242-W300 HydrophobicContact CB-CZ2 3.76Å; L242-W300 HydrophobicContact CD1-CH2 3.98Å; L242-W300 HydrophobicContact CD1-CZ2 3.94Å; L242-W300 HydrophobicContact CD1-CZ3 4.36Å; L242-W300 HydrophobicContact CD2-CZ2 4.28Å; L242-W300 HydrophobicContact CG-CZ2 4.22Å; T280-W300 HydrophobicContact CG2-CE3 4.15Å; T280-W300 HydrophobicContact CG2-CZ3 3.76Å; V282-W300 HydrophobicContact CB-CB 4.15Å; V282-W300 HydrophobicContact CB-CG 4.24Å; V282-W300 HydrophobicContact CG1-CB 3.93Å; V282-W300 HydrophobicContact CG1-CD2 3.61Å; V282-W300 HydrophobicContact CG1-CE3 3.66Å; V282-W300 HydrophobicContact CG1-CG 3.69Å; V282-W300 HydrophobicContact CG1-CZ3 4.44Å; A296-W300 CarbonylContact C-O 3.41Å; A296-W300 PolarHBondContact O-N 3.28Å; A297-W300 WeakPolarHBondContact CA-O 3.44Å; W300-V302 PolarHBondContact O-N 3.23Å; W300-V302 VanDerWaalsContact O-N 3.13Å
301	P	96.1	Very high	94.6	Very high	36 Å²	36	64.2 Å²	64.2	23%	0.234	32%	0.318	C	S	.	.			trans	-58.1	120.4	175.8	-25.5	35.3	0	0	0	112	K226 R229	K226-P301 HydrophobicContact CB-CB 4Å; K226-P301 VanDerWaalsContact CB-O 3.3Å; K226-P301 WeakPolarHBondContact CB-O 3.12Å; K226-P301 HydrophobicContact CD-CB 3.96Å; K226-P301 HydrophobicContact CG-CB 4.32Å; K226-P301 PolarHBondContact N-O 3.14Å; R229-P301 HydrophobicContact CB-CG 3.85Å; R229-P301 HydrophobicContact CG-CG 3.82Å
302	V	95.7	Very high	94.6	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.018	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-122.9	152.8	-178.1	-74	0	0	0	0	112.2	H224 L225 P283 P287 Y293 A296 A297 W300	H224-V302 CarbonylContact O-C 3.18Å; H224-V302 WeakPolarHBondContact O-CA 3.23Å; H224-V302 VanDerWaalsContact O-CB 3.29Å; H224-V302 WeakPolarHBondContact O-CB 3.41Å; H224-V302 WeakPolarHBondContact O-CG1 3.48Å; L225-V302 HydrophobicContact CD2-CG1 3.94Å; P283-V302 HydrophobicContact CG-CG1 4.42Å; P287-V302 HydrophobicContact CG-CG2 4.3Å; Y293-V302 HydrophobicContact CD2-CG2 3.74Å; Y293-V302 HydrophobicContact CE2-CG2 3.87Å; A296-V302 HydrophobicContact CB-CG1 4.36Å; A296-V302 HydrophobicContact CB-CG2 3.81Å; A297-V302 HydrophobicContact CB-CG2 4.22Å; W300-V302 PolarHBondContact O-N 3.23Å; W300-V302 VanDerWaalsContact O-N 3.13Å
303	A	94	Very high	94.5	Very high	34 Å²	34	62 Å²	62	28%	0.281	31%	0.305	S	S	.	.			trans	-82.5	143.5	164.5	0	0	0	0	0	109.6	H224	H224-A303 PolarHBondContact O-N 3.45Å
304	F	94.7	Very high	94.3	Very high	35 Å²	35	62.7 Å²	62.7	15%	0.154	31%	0.313	C	S	.	.			trans	-148.9	126.8	178.7	171.9	-119.8	0	0	0	110.5	P287 Y293 E306	P287-F304 HydrophobicContact CB-CD2 4.32Å; P287-F304 HydrophobicContact CG-CB 4.27Å; P287-F304 HydrophobicContact CG-CD2 4.13Å; P287-F304 VanDerWaalsContact O-CD2 3.31Å; P287-F304 WeakPolarHBondContact O-CD2 3.4Å; Y293-F304 HydrophobicContact CD1-CB 4.48Å; Y293-F304 AromaticContact CD1-CD1 3.77Å; Y293-F304 HydrophobicContact CD1-CD1 3.77Å; Y293-F304 HydrophobicContact CD1-CE1 4.37Å; Y293-F304 HydrophobicContact CD1-CG 4.33Å; Y293-F304 HydrophobicContact CD2-CB 3.19Å; Y293-F304 AromaticContact CD2-CD1 4Å; Y293-F304 HydrophobicContact CD2-CD1 4Å; Y293-F304 AromaticContact CD2-CG 3.73Å; Y293-F304 HydrophobicContact CD2-CG 3.73Å; Y293-F304 HydrophobicContact CE1-CD1 4.41Å; Y293-F304 HydrophobicContact CE2-CB 3.63Å; Y293-F304 HydrophobicContact CE2-CG 4.46Å; Y293-F304 HydrophobicContact CG-CB 3.66Å; Y293-F304 AromaticContact CG-CD1 3.51Å; Y293-F304 HydrophobicContact CG-CD1 3.51Å; Y293-F304 HydrophobicContact CG-CD2 4.44Å; Y293-F304 HydrophobicContact CG-CE1 4.25Å; Y293-F304 AromaticContact CG-CG 3.62Å; Y293-F304 HydrophobicContact CG-CG 3.62Å; F304-E306 HydrophobicContact CE1-CB 3.7Å; F304-E306 HydrophobicContact CE1-CG 4.2Å; F304-E306 HydrophobicContact CE2-CB 4.4Å; F304-E306 HydrophobicContact CZ-CB 3.56Å; F304-E306 HydrophobicContact CZ-CG 3.82Å
305	H	93	Very high	94	Very high	176 Å²	176	60.1 Å²	60.1	82%	0.815	31%	0.309	S	S	*	.			trans	-120.5	107.9	173.1	-63.1	92.1	0	0	0	107.9	N307	H305-N307 PolarHBondContact O-N 3.5Å
306	E	91.4	Very high	93.8	Very high	68 Å²	68	58.4 Å²	58.4	32%	0.318	30%	0.303	S	S	.	.			trans	-68.8	123.5	-173.2	-172	161.7	-110.5	0	0	111.6	R290 F304 K308 A311	R290-E306 WeakPolarHBondContact CB-OE1 3.43Å; R290-E306 IonicContact CZ-OE1 2.8Å; R290-E306 IonicContact CZ-OE2 2.61Å; R290-E306 IonicContact NE-OE1 3Å; R290-E306 PolarHBondContact NE-OE1 3.39Å; R290-E306 IonicContact NE-OE2 3.82Å; R290-E306 IonicContact NH2-OE1 3.98Å; R290-E306 PolarHBondContact NH2-OE1 2.89Å; R290-E306 IonicContact NH2-OE2 2.65Å; R290-E306 PolarHBondContact NH2-OE2 3.49Å; F304-E306 HydrophobicContact CE1-CB 3.7Å; F304-E306 HydrophobicContact CE1-CG 4.2Å; F304-E306 HydrophobicContact CE2-CB 4.4Å; F304-E306 HydrophobicContact CZ-CB 3.56Å; F304-E306 HydrophobicContact CZ-CG 3.82Å; E306-K308 PolarHBondContact O-N 2.94Å; E306-K308 VanDerWaalsContact O-N 3.08Å; E306-A311 HydrophobicContact CG-CB 3.96Å
307	N	94.1	Very high	93.5	Very high	83 Å²	83	62.5 Å²	62.5	44%	0.444	33%	0.329	S	S	.	.			trans	-71.8	103.9	169.3	-175.2	-40.6	0	0	0	109.4	H305 R309 I310 A311	H305-N307 PolarHBondContact O-N 3.5Å; N307-R309 VanDerWaalsContact C-N 3.26Å; N307-R309 PolarHBondContact O-N 3.32Å; N307-R309 PolarHBondContact OD1-N 3.16Å; N307-R309 VanDerWaalsContact OD1-N 3.08Å; N307-I310 HydrophobicContact CB-CB 4.17Å; N307-I310 HydrophobicContact CB-CG1 4.13Å; N307-I310 PolarHBondContact O-N 2.8Å; N307-I310 VanDerWaalsContact O-N 3.16Å; N307-I310 PolarHBondContact OD1-N 3.11Å; N307-A311 PolarHBondContact O-N 3.07Å
308	K	93.5	Very high	93.3	Very high	176 Å²	176	64 Å²	64	77%	0.765	33%	0.33	S	S	*	.	H	α-helix	trans	-54	-39.7	-177	-65.2	-174.3	179.2	-178.9	0	113.1	E306 A311 S312	E306-K308 PolarHBondContact O-N 2.94Å; E306-K308 VanDerWaalsContact O-N 3.08Å; K308-A311 PolarHBondContact O-N 3.3Å; K308-S312 WeakPolarHBondContact O-CB 3.41Å; K308-S312 PolarHBondContact O-N 3.09Å; K308-S312 PolarHBondContact O-OG 2.84Å; K308-S312 VanDerWaalsContact O-OG 3.08Å
309	R	93.2	Very high	93.2	Very high	149 Å²	149	60 Å²	60	56%	0.562	30%	0.301	S	S	*	.	H	α-helix	trans	-66.3	-46.4	-180	-179.8	178.1	177	163.9	0.4	111.5	N307 A311 S312 L313 D475	N307-R309 VanDerWaalsContact C-N 3.26Å; N307-R309 PolarHBondContact O-N 3.32Å; N307-R309 PolarHBondContact OD1-N 3.16Å; N307-R309 VanDerWaalsContact OD1-N 3.08Å; R309-A311 VanDerWaalsContact C-N 3.35Å; R309-S312 PolarHBondContact O-N 3.45Å; R309-L313 HydrophobicContact CG-CD1 4.32Å; R309-L313 WeakPolarHBondContact O-CG 3.32Å; R309-L313 PolarHBondContact O-N 3Å; R309-D475 IonicContact NH2-OD1 3.67Å; R309-D475 PolarHBondContact NH2-OD1 3.49Å; R309-D475 IonicContact NH2-OD2 3.81Å; R309-D475 PolarHBondContact NH2-OD2 2.74Å; R309-D475 VanDerWaalsContact NH2-OD2 3.08Å
310	I	93	Very high	93.1	Very high	20 Å²	20	61 Å²	61	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-42.3	178.1	-62.1	-62.7	0	0	0	110.3	Y185 N307 S312 L313 I314	Y185-I310 HydrophobicContact CD1-CG2 3.76Å; Y185-I310 HydrophobicContact CE1-CD1 4.28Å; Y185-I310 HydrophobicContact CE1-CG1 4.08Å; Y185-I310 HydrophobicContact CE1-CG2 4.11Å; Y185-I310 HydrophobicContact CE2-CD1 4.32Å; Y185-I310 HydrophobicContact CG-CG2 4.22Å; N307-I310 HydrophobicContact CB-CB 4.17Å; N307-I310 HydrophobicContact CB-CG1 4.13Å; N307-I310 PolarHBondContact O-N 2.8Å; N307-I310 VanDerWaalsContact O-N 3.16Å; N307-I310 PolarHBondContact OD1-N 3.11Å; I310-S312 VanDerWaalsContact C-N 3.32Å; I310-S312 PolarHBondContact O-N 2.94Å; I310-L313 HydrophobicContact CD1-CD1 4.28Å; I310-L313 PolarHBondContact O-N 2.95Å; I310-I314 HydrophobicContact CG2-CD1 3.83Å; I310-I314 HydrophobicContact CG2-CG1 4.39Å; I310-I314 WeakPolarHBondContact O-CG1 3.2Å; I310-I314 PolarHBondContact O-N 3.45Å
311	A	93.3	Very high	92.9	Very high	13 Å²	13	66.8 Å²	66.8	11%	0.107	34%	0.341	C	S	.	.	H	α-helix	trans	-58.5	-44.6	175.2	0	0	0	0	0	111.5	E306 N307 K308 R309 L313 I314 Q315	E306-A311 HydrophobicContact CG-CB 3.96Å; N307-A311 PolarHBondContact O-N 3.07Å; K308-A311 PolarHBondContact O-N 3.3Å; R309-A311 VanDerWaalsContact C-N 3.35Å; A311-L313 PolarHBondContact O-N 3.09Å; A311-I314 PolarHBondContact O-N 3.26Å; A311-Q315 WeakPolarHBondContact O-CB 3.32Å; A311-Q315 WeakPolarHBondContact O-CG 3.45Å; A311-Q315 PolarHBondContact O-N 2.81Å
312	S	93.7	Very high	92.8	Very high	32 Å²	32	68.2 Å²	68.2	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-33	176.4	-64.2	0	0	0	0	114	K308 R309 I310 L316 T317	K308-S312 WeakPolarHBondContact O-CB 3.41Å; K308-S312 PolarHBondContact O-N 3.09Å; K308-S312 PolarHBondContact O-OG 2.84Å; K308-S312 VanDerWaalsContact O-OG 3.08Å; R309-S312 PolarHBondContact O-N 3.45Å; I310-S312 VanDerWaalsContact C-N 3.32Å; I310-S312 PolarHBondContact O-N 2.94Å; S312-L316 CarbonylContact O-C 3.57Å; S312-L316 VanDerWaalsContact O-CA 3.28Å; S312-L316 WeakPolarHBondContact O-CA 3.43Å; S312-L316 PolarHBondContact O-N 2.87Å; S312-T317 VanDerWaalsContact CA-OG1 3.28Å; S312-T317 WeakPolarHBondContact CA-OG1 3.23Å; S312-T317 WeakPolarHBondContact CB-OG1 3.32Å; S312-T317 PolarHBondContact O-N 2.93Å; S312-T317 VanDerWaalsContact O-N 3.08Å; S312-T317 PolarHBondContact OG-OG1 3.43Å
313	L	93.4	Very high	92.8	Very high	4 Å²	4	71.3 Å²	71.3	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-66.1	-45	172.3	-78	166.3	0	0	0	111.6	A179 L181 R309 I310 A311 L316 L318 D475 F477	A179-L313 HydrophobicContact CB-CB 4.15Å; A179-L313 HydrophobicContact CB-CD2 4.34Å; A179-L313 WeakPolarHBondContact CB-O 3.43Å; L181-L313 HydrophobicContact CD2-CB 4.36Å; L181-L313 HydrophobicContact CD2-CD1 4.1Å; R309-L313 HydrophobicContact CG-CD1 4.32Å; R309-L313 WeakPolarHBondContact O-CG 3.32Å; R309-L313 PolarHBondContact O-N 3Å; I310-L313 HydrophobicContact CD1-CD1 4.28Å; I310-L313 PolarHBondContact O-N 2.95Å; A311-L313 PolarHBondContact O-N 3.09Å; L313-L316 WeakPolarHBondContact O-CD2 3.32Å; L313-L316 PolarHBondContact O-N 3.39Å; L313-L318 HydrophobicContact CB-CD1 4.44Å; L313-L318 HydrophobicContact CD2-CD1 3.4Å; L313-L318 VanDerWaalsContact CD2-CD1 3.4Å; L313-L318 HydrophobicContact CG-CD1 3.71Å; L313-D475 HydrophobicContact CD2-CB 4.31Å; L313-F477 HydrophobicContact CD2-CE1 3.96Å; L313-F477 HydrophobicContact CD2-CZ 3.68Å
314	I	91.7	Very high	92.8	Very high	83 Å²	83	74 Å²	74	43%	0.426	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-44.5	178.9	-68.6	169.2	0	0	0	110.8	L181 T289 I310 A311 L316	L181-I314 HydrophobicContact CD1-CD1 4.21Å; L181-I314 HydrophobicContact CD1-CG1 3.47Å; L181-I314 VanDerWaalsContact CD1-CG1 3.47Å; T289-I314 HydrophobicContact CG2-CD1 3.7Å; I310-I314 HydrophobicContact CG2-CD1 3.83Å; I310-I314 HydrophobicContact CG2-CG1 4.39Å; I310-I314 WeakPolarHBondContact O-CG1 3.2Å; I310-I314 PolarHBondContact O-N 3.45Å; A311-I314 PolarHBondContact O-N 3.26Å; I314-L316 VanDerWaalsContact C-N 3.33Å
315	Q	90.5	Very high	92.8	Very high	124 Å²	124	78.8 Å²	78.8	58%	0.579	40%	0.398	S	S	*	.	H	α-helix	trans	-86.1	-4.2	-177.5	-64.2	173.9	-4.4	0	0	113.5	A311 T317	A311-Q315 WeakPolarHBondContact O-CB 3.32Å; A311-Q315 WeakPolarHBondContact O-CG 3.45Å; A311-Q315 PolarHBondContact O-N 2.81Å; Q315-T317 HydrophobicContact CB-CG2 3.81Å; Q315-T317 PolarHBondContact O-N 2.91Å; Q315-T317 VanDerWaalsContact O-N 3.14Å
316	L	91.3	Very high	92.9	Very high	17 Å²	17	72 Å²	72	9%	0.089	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	32.7	-173.5	-59.6	175.4	0	0	0	114	W177 S312 L313 I314 L318 F319 F477	W177-L316 HydrophobicContact CD2-CD1 4.24Å; W177-L316 HydrophobicContact CE3-CD1 4.43Å; W177-L316 WeakPolarHBondContact O-CD1 3.36Å; S312-L316 CarbonylContact O-C 3.57Å; S312-L316 VanDerWaalsContact O-CA 3.28Å; S312-L316 WeakPolarHBondContact O-CA 3.43Å; S312-L316 PolarHBondContact O-N 2.87Å; L313-L316 WeakPolarHBondContact O-CD2 3.32Å; L313-L316 PolarHBondContact O-N 3.39Å; I314-L316 VanDerWaalsContact C-N 3.33Å; L316-L318 PolarHBondContact O-N 3.32Å; L316-F319 HydrophobicContact CB-CD2 4.37Å; L316-F319 HydrophobicContact CD2-CD2 4.32Å; L316-F319 HydrophobicContact CD2-CE2 3.99Å; L316-F477 HydrophobicContact CD2-CD1 3.76Å; L316-F477 HydrophobicContact CD2-CE1 3.72Å
317	T	90.8	Very high	93.1	Very high	86 Å²	86	68.9 Å²	68.9	53%	0.528	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.7	176.7	53.5	0	0	0	0	112.9	S312 Q315 F319	S312-T317 VanDerWaalsContact CA-OG1 3.28Å; S312-T317 WeakPolarHBondContact CA-OG1 3.23Å; S312-T317 WeakPolarHBondContact CB-OG1 3.32Å; S312-T317 PolarHBondContact O-N 2.93Å; S312-T317 VanDerWaalsContact O-N 3.08Å; S312-T317 PolarHBondContact OG-OG1 3.43Å; Q315-T317 HydrophobicContact CB-CG2 3.81Å; Q315-T317 PolarHBondContact O-N 2.91Å; Q315-T317 VanDerWaalsContact O-N 3.14Å; T317-F319 PolarHBondContact O-N 3.42Å
318	L	90	Very high	93.2	Very high	71 Å²	71	69.8 Å²	69.8	37%	0.372	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.2	174.1	-62.6	167.8	0	0	0	113.5	L313 L316	L313-L318 HydrophobicContact CB-CD1 4.44Å; L313-L318 HydrophobicContact CD2-CD1 3.4Å; L313-L318 VanDerWaalsContact CD2-CD1 3.4Å; L313-L318 HydrophobicContact CG-CD1 3.71Å; L316-L318 PolarHBondContact O-N 3.32Å
319	F	92.2	Very high	93.4	Very high	10 Å²	10	68 Å²	68	4%	0.044	35%	0.351	C	S	.	.			trans	-114.6	120.3	-173.1	-57.4	-74.4	0	0	0	110	W177 L316 T317 D323 R324 I327 F448 F477	W177-F319 HydrophobicContact CH2-CD1 4.28Å; W177-F319 AromaticContact CH2-CD2 3.61Å; W177-F319 HydrophobicContact CH2-CD2 3.61Å; W177-F319 HydrophobicContact CH2-CE1 4.25Å; W177-F319 AromaticContact CH2-CE2 3.6Å; W177-F319 HydrophobicContact CH2-CE2 3.6Å; W177-F319 AromaticContact CH2-CG 3.95Å; W177-F319 HydrophobicContact CH2-CG 3.95Å; W177-F319 AromaticContact CH2-CZ 3.92Å; W177-F319 HydrophobicContact CH2-CZ 3.92Å; W177-F319 HydrophobicContact CZ2-CD2 4.39Å; W177-F319 HydrophobicContact CZ3-CD2 4.16Å; W177-F319 AromaticContact CZ3-CE2 3.7Å; W177-F319 HydrophobicContact CZ3-CE2 3.7Å; W177-F319 AromaticContact CZ3-CZ 3.98Å; W177-F319 HydrophobicContact CZ3-CZ 3.98Å; L316-F319 HydrophobicContact CB-CD2 4.37Å; L316-F319 HydrophobicContact CD2-CD2 4.32Å; L316-F319 HydrophobicContact CD2-CE2 3.99Å; T317-F319 PolarHBondContact O-N 3.42Å; F319-D323 HydrophobicContact CB-CB 4.02Å; F319-D323 HydrophobicContact CD1-CB 4.06Å; F319-R324 HydrophobicContact CB-CG 4.13Å; F319-I327 HydrophobicContact CD1-CD1 3.65Å; F319-I327 HydrophobicContact CE1-CD1 3.63Å; F319-I327 HydrophobicContact CG-CD1 4.33Å; F319-I327 HydrophobicContact CZ-CD1 4.33Å; F319-F448 HydrophobicContact CE1-CE1 4.06Å; F319-F448 AromaticContact CE1-CZ 3.95Å; F319-F448 HydrophobicContact CE1-CZ 3.95Å; F319-F448 AromaticContact CZ-CE1 3.84Å; F319-F448 HydrophobicContact CZ-CE1 3.84Å; F319-F448 HydrophobicContact CZ-CZ 4.03Å; F319-F477 HydrophobicContact CE2-CD1 4.01Å; F319-F477 AromaticContact CE2-CE1 3.48Å; F319-F477 HydrophobicContact CE2-CE1 3.48Å; F319-F477 VanDerWaalsContact CE2-CE1 3.48Å; F319-F477 HydrophobicContact CE2-CE2 4.45Å; F319-F477 AromaticContact CE2-CZ 3.74Å; F319-F477 HydrophobicContact CE2-CZ 3.74Å; F319-F477 HydrophobicContact CZ-CD1 4.21Å; F319-F477 HydrophobicContact CZ-CD2 4.29Å; F319-F477 AromaticContact CZ-CE1 3.7Å; F319-F477 HydrophobicContact CZ-CE1 3.7Å; F319-F477 AromaticContact CZ-CE2 3.81Å; F319-F477 HydrophobicContact CZ-CE2 3.81Å; F319-F477 HydrophobicContact CZ-CG 4.5Å; F319-F477 AromaticContact CZ-CZ 3.48Å; F319-F477 HydrophobicContact CZ-CZ 3.48Å; F319-F477 VanDerWaalsContact CZ-CZ 3.48Å
320	S	93.1	Very high	93.6	Very high	60 Å²	60	61.9 Å²	61.9	42%	0.42	33%	0.328	S	S	.	.			trans	-67.4	168	165.6	69.3	0	0	0	0	110.8	A322 D323 R324	S320-A322 VanDerWaalsContact C-N 3.25Å; S320-A322 PolarHBondContact O-N 3.41Å; S320-D323 WeakPolarHBondContact CB-OD2 3.5Å; S320-D323 PolarHBondContact N-OD2 3.12Å; S320-D323 WeakPolarHBondContact O-CB 3.42Å; S320-D323 PolarHBondContact O-N 3.23Å; S320-D323 VanDerWaalsContact O-N 3.11Å; S320-D323 PolarHBondContact OG-N 3.4Å; S320-D323 PolarHBondContact OG-OD2 3.33Å; S320-R324 WeakPolarHBondContact O-CG 3.32Å; S320-R324 PolarHBondContact O-N 2.7Å; S320-R324 VanDerWaalsContact O-N 3.07Å
321	N	92.3	Very high	93.8	Very high	123 Å²	123	61 Å²	61	66%	0.658	32%	0.323	S	S	*	.	H	α-helix	trans	-58.8	-39.7	174.5	-68	-17.2	0	0	0	111.8	D323 R324 E325	N321-D323 VanDerWaalsContact C-N 3.32Å; N321-D323 PolarHBondContact O-N 3.4Å; N321-R324 WeakPolarHBondContact O-CB 3.41Å; N321-R324 PolarHBondContact O-N 2.96Å; N321-R324 VanDerWaalsContact O-N 3.14Å; N321-E325 PolarHBondContact O-N 2.66Å
322	A	94.4	Very high	94	Very high	65 Å²	65	62 Å²	62	54%	0.537	33%	0.33	S	S	.	.	H	α-helix	trans	-62.7	-37.8	175.5	0	0	0	0	0	112.4	S320 R324 A326	S320-A322 VanDerWaalsContact C-N 3.25Å; S320-A322 PolarHBondContact O-N 3.41Å; A322-R324 VanDerWaalsContact C-N 3.32Å; A322-R324 PolarHBondContact O-N 3.01Å; A322-A326 WeakPolarHBondContact O-CB 3.4Å; A322-A326 PolarHBondContact O-N 3.2Å
323	D	94.6	Very high	94	Very high	68 Å²	68	62.9 Å²	62.9	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-38.6	174.7	-63.4	-57.2	0	0	0	111.6	F319 S320 N321 A326 I327	F319-D323 HydrophobicContact CB-CB 4.02Å; F319-D323 HydrophobicContact CD1-CB 4.06Å; S320-D323 WeakPolarHBondContact CB-OD2 3.5Å; S320-D323 PolarHBondContact N-OD2 3.12Å; S320-D323 WeakPolarHBondContact O-CB 3.42Å; S320-D323 PolarHBondContact O-N 3.23Å; S320-D323 VanDerWaalsContact O-N 3.11Å; S320-D323 PolarHBondContact OG-N 3.4Å; S320-D323 PolarHBondContact OG-OD2 3.33Å; N321-D323 VanDerWaalsContact C-N 3.32Å; N321-D323 PolarHBondContact O-N 3.4Å; D323-A326 PolarHBondContact O-N 2.89Å; D323-I327 WeakPolarHBondContact O-CB 3.33Å; D323-I327 WeakPolarHBondContact O-CD1 3.24Å; D323-I327 WeakPolarHBondContact O-CG1 3.31Å; D323-I327 PolarHBondContact O-N 3.19Å
324	R	94.1	Very high	94.2	Very high	91 Å²	91	62.7 Å²	62.7	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-47	178.6	-65	179.4	178.3	-158.1	-4.1	111.2	W177 F319 S320 N321 A322 A326 I327 E328	W177-R324 HydrophobicContact CZ2-CG 4.19Å; F319-R324 HydrophobicContact CB-CG 4.13Å; S320-R324 WeakPolarHBondContact O-CG 3.32Å; S320-R324 PolarHBondContact O-N 2.7Å; S320-R324 VanDerWaalsContact O-N 3.07Å; N321-R324 WeakPolarHBondContact O-CB 3.41Å; N321-R324 PolarHBondContact O-N 2.96Å; N321-R324 VanDerWaalsContact O-N 3.14Å; A322-R324 VanDerWaalsContact C-N 3.32Å; A322-R324 PolarHBondContact O-N 3.01Å; R324-A326 VanDerWaalsContact C-N 3.31Å; R324-A326 PolarHBondContact O-N 3.35Å; R324-I327 WeakPolarHBondContact O-CB 3.44Å; R324-I327 PolarHBondContact O-N 2.9Å; R324-E328 PolarHBondContact O-N 3.05Å
325	E	94.6	Very high	94.3	Very high	136 Å²	136	59.3 Å²	59.3	64%	0.636	31%	0.314	S	S	*	.	H	α-helix	trans	-59.4	-42.1	174.8	-71	174.2	-169.8	0	0	111.7	N321 E328 K329	N321-E325 PolarHBondContact O-N 2.66Å; E325-E328 PolarHBondContact O-N 3.28Å; E325-K329 WeakPolarHBondContact O-CB 3.47Å; E325-K329 PolarHBondContact O-N 2.87Å
326	A	95.9	Very high	94.4	Very high	32 Å²	32	58.7 Å²	58.7	26%	0.264	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-42.7	175.8	0	0	0	0	0	111.9	A322 D323 R324 K329 Y330	A322-A326 WeakPolarHBondContact O-CB 3.4Å; A322-A326 PolarHBondContact O-N 3.2Å; D323-A326 PolarHBondContact O-N 2.89Å; R324-A326 VanDerWaalsContact C-N 3.31Å; R324-A326 PolarHBondContact O-N 3.35Å; A326-K329 WeakPolarHBondContact O-CB 3.47Å; A326-K329 PolarHBondContact O-N 3.4Å; A326-Y330 HydrophobicContact CB-CD2 4.47Å; A326-Y330 HydrophobicContact CB-CE2 4.04Å; A326-Y330 WeakPolarHBondContact O-CD2 3.25Å; A326-Y330 PolarHBondContact O-N 3.02Å
327	I	96.7	Very high	94.5	Very high	3 Å²	3	58 Å²	58	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-45.7	177.5	-74.4	163.8	0	0	0	111.3	W177 F319 D323 R324 Y330 M331 Y426 F448 I480	W177-I327 HydrophobicContact CH2-CD1 3.39Å; W177-I327 HydrophobicContact CH2-CG2 4.27Å; W177-I327 HydrophobicContact CZ2-CD1 4.05Å; W177-I327 HydrophobicContact CZ2-CG2 4.38Å; W177-I327 HydrophobicContact CZ3-CD1 4.2Å; F319-I327 HydrophobicContact CD1-CD1 3.65Å; F319-I327 HydrophobicContact CE1-CD1 3.63Å; F319-I327 HydrophobicContact CG-CD1 4.33Å; F319-I327 HydrophobicContact CZ-CD1 4.33Å; D323-I327 WeakPolarHBondContact O-CB 3.33Å; D323-I327 WeakPolarHBondContact O-CD1 3.24Å; D323-I327 WeakPolarHBondContact O-CG1 3.31Å; D323-I327 PolarHBondContact O-N 3.19Å; R324-I327 WeakPolarHBondContact O-CB 3.44Å; R324-I327 PolarHBondContact O-N 2.9Å; I327-Y330 PolarHBondContact O-N 3.33Å; I327-M331 WeakPolarHBondContact O-CB 3.49Å; I327-M331 PolarHBondContact O-N 2.88Å; I327-Y426 HydrophobicContact CB-CE1 4.16Å; I327-Y426 HydrophobicContact CG1-CE1 4.05Å; I327-Y426 HydrophobicContact CG2-CE1 4.07Å; I327-F448 HydrophobicContact CD1-CD1 4.34Å; I327-F448 HydrophobicContact CD1-CE1 3.6Å; I327-F448 HydrophobicContact CD1-CZ 3.89Å; I327-F448 HydrophobicContact CG1-CD1 4.49Å; I327-F448 HydrophobicContact CG1-CE1 4.08Å; I327-F448 HydrophobicContact CG1-CZ 4.2Å; I327-F448 HydrophobicContact CG2-CD1 4.1Å; I327-F448 HydrophobicContact CG2-CE1 4.43Å; I327-I480 HydrophobicContact CG2-CG1 4.45Å; I327-I480 HydrophobicContact CG2-CG2 3.79Å
328	E	95.7	Very high	94.5	Very high	102 Å²	102	53.9 Å²	53.9	48%	0.477	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-40.8	176.2	-73	178.4	-175.2	0	0	112	R324 E325 Y330 M331 S332	R324-E328 PolarHBondContact O-N 3.05Å; E325-E328 PolarHBondContact O-N 3.28Å; E328-Y330 PolarHBondContact O-N 3.07Å; E328-M331 PolarHBondContact O-N 2.57Å; E328-S332 VanDerWaalsContact O-CB 3.31Å; E328-S332 WeakPolarHBondContact O-CB 3.37Å; E328-S332 PolarHBondContact O-N 3Å; E328-S332 PolarHBondContact O-OG 3.31Å
329	K	96.8	Very high	94.5	Very high	140 Å²	140	57.6 Å²	57.6	61%	0.609	30%	0.295	S	S	*	.	H	α-helix	trans	-57.9	-47	174.2	175.4	-174.7	174.3	-177.9	0	111.7	E325 A326 S332 L333	E325-K329 WeakPolarHBondContact O-CB 3.47Å; E325-K329 PolarHBondContact O-N 2.87Å; A326-K329 WeakPolarHBondContact O-CB 3.47Å; A326-K329 PolarHBondContact O-N 3.4Å; K329-S332 WeakPolarHBondContact O-CB 3.32Å; K329-S332 PolarHBondContact O-N 3.21Å; K329-L333 PolarHBondContact O-N 2.73Å; K329-L333 VanDerWaalsContact O-N 3.08Å
330	Y	97.4	Very high	94.2	Very high	20 Å²	20	64.4 Å²	64.4	8%	0.078	32%	0.32	C	S	.	.	H	α-helix	trans	-72.9	-35	-179.3	-63.5	-53.1	0	0	0	112.7	A326 I327 E328 L333 A334 V353 G358 V360 Y426	A326-Y330 HydrophobicContact CB-CD2 4.47Å; A326-Y330 HydrophobicContact CB-CE2 4.04Å; A326-Y330 WeakPolarHBondContact O-CD2 3.25Å; A326-Y330 PolarHBondContact O-N 3.02Å; I327-Y330 PolarHBondContact O-N 3.33Å; E328-Y330 PolarHBondContact O-N 3.07Å; Y330-L333 WeakPolarHBondContact O-CB 3.22Å; Y330-L333 PolarHBondContact O-N 2.82Å; Y330-A334 PolarHBondContact O-N 2.89Å; Y330-V353 HydrophobicContact CD1-CG1 4.33Å; Y330-V353 HydrophobicContact CD1-CG2 3.72Å; Y330-V353 HydrophobicContact CD2-CG1 4.45Å; Y330-V353 HydrophobicContact CD2-CG2 4.31Å; Y330-V353 HydrophobicContact CE1-CG1 3.79Å; Y330-V353 HydrophobicContact CE1-CG2 4Å; Y330-V353 HydrophobicContact CE2-CG1 3.95Å; Y330-V353 HydrophobicContact CG-CG2 3.91Å; Y330-G358 WeakPolarHBondContact OH-CA 3.36Å; Y330-G358 PolarHBondContact OH-O 3.06Å; Y330-V360 HydrophobicContact CD1-CG2 4.11Å; Y330-V360 HydrophobicContact CE1-CG2 3.88Å; Y330-Y426 HydrophobicContact CD2-CE1 4.45Å; Y330-Y426 AromaticContact CD2-CE2 3.85Å; Y330-Y426 HydrophobicContact CD2-CE2 3.85Å; Y330-Y426 AromaticContact CD2-CZ 3.72Å; Y330-Y426 HydrophobicContact CG-CD2 4.38Å; Y330-Y426 AromaticContact CG-CE2 3.99Å; Y330-Y426 HydrophobicContact CG-CE2 3.99Å
331	M	97.3	Very high	93.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-40.2	172.3	-172.3	54.6	74	0	0	111.5	I327 E328 L333 A334 I335 Y426 F448 I480 M481	I327-M331 WeakPolarHBondContact O-CB 3.49Å; I327-M331 PolarHBondContact O-N 2.88Å; E328-M331 PolarHBondContact O-N 2.57Å; M331-L333 VanDerWaalsContact C-N 3.28Å; M331-L333 PolarHBondContact O-N 2.91Å; M331-A334 WeakPolarHBondContact O-CA 3.47Å; M331-A334 WeakPolarHBondContact O-CB 3.1Å; M331-A334 PolarHBondContact O-N 3.07Å; M331-A334 HydrophobicContact SD-CB 4.2Å; M331-I335 HydrophobicContact CG-CD1 4.25Å; M331-I335 WeakPolarHBondContact O-CG1 3.29Å; M331-I335 PolarHBondContact O-N 2.84Å; M331-Y426 HydrophobicContact CE-CD1 4.46Å; M331-F448 HydrophobicContact CE-CB 4.37Å; M331-I480 HydrophobicContact CB-CB 4.49Å; M331-I480 HydrophobicContact CB-CG2 3.78Å; M331-I480 HydrophobicContact CE-CB 3.82Å; M331-I480 HydrophobicContact CE-CG1 4.15Å; M331-I480 HydrophobicContact CE-CG2 4.31Å; M331-I480 HydrophobicContact CG-CB 4.13Å; M331-I480 HydrophobicContact CG-CG2 3.87Å; M331-M481 HydrophobicContact CB-SD 3.97Å; M331-M481 HydrophobicContact CG-CB 4.12Å; M331-M481 HydrophobicContact CG-CG 4.25Å; M331-M481 HydrophobicContact CG-SD 4.05Å
332	S	96.8	Very high	92.5	Very high	36 Å²	36	61.8 Å²	61.8	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-57.2	-41.5	172.2	-67.8	0	0	0	0	111.9	E328 K329 I335 Q336 M481	E328-S332 VanDerWaalsContact O-CB 3.31Å; E328-S332 WeakPolarHBondContact O-CB 3.37Å; E328-S332 PolarHBondContact O-N 3Å; E328-S332 PolarHBondContact O-OG 3.31Å; K329-S332 WeakPolarHBondContact O-CB 3.32Å; K329-S332 PolarHBondContact O-N 3.21Å; S332-I335 PolarHBondContact O-N 3.2Å; S332-Q336 VanDerWaalsContact O-CG 3.29Å; S332-Q336 WeakPolarHBondContact O-CG 3.36Å; S332-Q336 PolarHBondContact O-N 2.83Å; S332-M481 WeakPolarHBondContact OG-CE 3.34Å; S332-M481 PolarHBondContact OG-SD 2.86Å; S332-M481 VanDerWaalsContact OG-SD 3.38Å
333	L	95.4	Very high	91	Very high	50 Å²	50	66.1 Å²	66.1	26%	0.262	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-40	174.2	-177	61.4	0	0	0	112	K329 Y330 M331 Q336 T337 V351 V360	K329-L333 PolarHBondContact O-N 2.73Å; K329-L333 VanDerWaalsContact O-N 3.08Å; Y330-L333 WeakPolarHBondContact O-CB 3.22Å; Y330-L333 PolarHBondContact O-N 2.82Å; M331-L333 VanDerWaalsContact C-N 3.28Å; M331-L333 PolarHBondContact O-N 2.91Å; L333-Q336 PolarHBondContact O-N 3.3Å; L333-T337 WeakPolarHBondContact O-CB 3.36Å; L333-T337 PolarHBondContact O-N 3.47Å; L333-T337 PolarHBondContact O-OG1 3.3Å; L333-V351 HydrophobicContact CB-CG2 4.44Å; L333-V351 HydrophobicContact CD2-CG1 4.13Å; L333-V351 HydrophobicContact CD2-CG2 4.34Å; L333-V351 HydrophobicContact CG-CG2 4.08Å; L333-V360 HydrophobicContact CD2-CB 4.47Å; L333-V360 HydrophobicContact CD2-CG1 4.06Å; L333-V360 HydrophobicContact CD2-CG2 3.79Å
334	A	95.7	Very high	89.8	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-41.9	174.8	0	0	0	0	0	111.7	Y330 M331 T337 A338 V351 T428	Y330-A334 PolarHBondContact O-N 2.89Å; M331-A334 WeakPolarHBondContact O-CA 3.47Å; M331-A334 WeakPolarHBondContact O-CB 3.1Å; M331-A334 PolarHBondContact O-N 3.07Å; M331-A334 HydrophobicContact SD-CB 4.2Å; A334-T337 PolarHBondContact O-N 3.01Å; A334-A338 WeakPolarHBondContact O-CB 3.41Å; A334-A338 PolarHBondContact O-N 3.29Å; A334-V351 HydrophobicContact CB-CB 4.47Å; A334-V351 HydrophobicContact CB-CG2 3.82Å; A334-T428 HydrophobicContact CB-CG2 4Å
335	I	94.9	Very high	88.7	Confident	12 Å²	12	72.3 Å²	72.3	6%	0.062	34%	0.34	C	S	.	.	H	α-helix	trans	-61.7	-47.1	174.5	-67.4	165.7	0	0	0	110.9	M331 S332 T337 A338 K339 T428 M481 E484 L488	M331-I335 HydrophobicContact CG-CD1 4.25Å; M331-I335 WeakPolarHBondContact O-CG1 3.29Å; M331-I335 PolarHBondContact O-N 2.84Å; S332-I335 PolarHBondContact O-N 3.2Å; I335-T337 VanDerWaalsContact C-N 3.28Å; I335-T337 PolarHBondContact O-N 3.09Å; I335-A338 WeakPolarHBondContact O-CB 3.31Å; I335-A338 PolarHBondContact O-N 3.23Å; I335-K339 WeakPolarHBondContact O-CG 3.36Å; I335-K339 PolarHBondContact O-N 3.34Å; I335-T428 HydrophobicContact CB-CG2 4.48Å; I335-T428 HydrophobicContact CG1-CG2 3.87Å; I335-M481 HydrophobicContact CD1-CB 4.08Å; I335-M481 HydrophobicContact CD1-CE 4.05Å; I335-M481 HydrophobicContact CD1-SD 4.08Å; I335-E484 HydrophobicContact CD1-CB 3.85Å; I335-L488 HydrophobicContact CG1-CD1 4.42Å; I335-L488 HydrophobicContact CG2-CD1 4.35Å; I335-L488 HydrophobicContact CG2-CD2 4.14Å; I335-L488 HydrophobicContact CG2-CG 4.47Å
336	Q	93.1	Very high	88.1	Confident	110 Å²	110	69.5 Å²	69.5	51%	0.514	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-39.9	176.7	-71.7	172.7	26.3	0	0	111.8	S332 L333 A338 K339	S332-Q336 VanDerWaalsContact O-CG 3.29Å; S332-Q336 WeakPolarHBondContact O-CG 3.36Å; S332-Q336 PolarHBondContact O-N 2.83Å; L333-Q336 PolarHBondContact O-N 3.3Å; Q336-A338 VanDerWaalsContact C-N 3.35Å; Q336-K339 PolarHBondContact O-N 2.89Å
337	T	91.8	Very high	87.8	Confident	2 Å²	2	68 Å²	68	1%	0.012	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-40.4	176.4	-52.3	0	0	0	0	110.8	L333 A334 I335 K339 R340 A363 S364 H365	L333-T337 WeakPolarHBondContact O-CB 3.36Å; L333-T337 PolarHBondContact O-N 3.47Å; L333-T337 PolarHBondContact O-OG1 3.3Å; A334-T337 PolarHBondContact O-N 3.01Å; I335-T337 VanDerWaalsContact C-N 3.28Å; I335-T337 PolarHBondContact O-N 3.09Å; T337-K339 VanDerWaalsContact C-N 3.3Å; T337-K339 PolarHBondContact O-N 3.44Å; T337-R340 WeakPolarHBondContact O-CB 3.39Å; T337-R340 PolarHBondContact O-N 3.17Å; T337-A363 HydrophobicContact CG2-CB 4.31Å; T337-S364 WeakPolarHBondContact CG2-O 3.36Å; T337-H365 HydrophobicContact CG2-CB 4.2Å; T337-H365 WeakPolarHBondContact O-CB 3.48Å; T337-H365 PolarHBondContact O-CD2 3.3Å; T337-H365 VanDerWaalsContact O-CD2 3.27Å
338	A	91.8	Very high	87.6	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.5	-31.1	175.3	0	0	0	0	0	113.5	A334 I335 Q336 R340 V341 G349 T428 L488	A334-A338 WeakPolarHBondContact O-CB 3.41Å; A334-A338 PolarHBondContact O-N 3.29Å; I335-A338 WeakPolarHBondContact O-CB 3.31Å; I335-A338 PolarHBondContact O-N 3.23Å; Q336-A338 VanDerWaalsContact C-N 3.35Å; A338-R340 PolarHBondContact O-N 3.1Å; A338-V341 VanDerWaalsContact O-CB 3.28Å; A338-V341 WeakPolarHBondContact O-CB 3.38Å; A338-V341 WeakPolarHBondContact O-CG2 3.3Å; A338-V341 PolarHBondContact O-N 3Å; A338-G349 VanDerWaalsContact CB-N 3.35Å; A338-T428 HydrophobicContact CB-CG2 4.14Å; A338-L488 HydrophobicContact CB-CD1 3.74Å; A338-L488 HydrophobicContact CB-CD2 4.23Å
339	K	89.9	Confident	87.5	Confident	149 Å²	149	63.3 Å²	63.3	65%	0.648	29%	0.293	S	S	*	.	H	α-helix	trans	-67.6	-19.7	177.8	-72.9	177.2	178.4	-179.2	0	113.3	I335 Q336 T337 V341 L488	I335-K339 WeakPolarHBondContact O-CG 3.36Å; I335-K339 PolarHBondContact O-N 3.34Å; Q336-K339 PolarHBondContact O-N 2.89Å; T337-K339 VanDerWaalsContact C-N 3.3Å; T337-K339 PolarHBondContact O-N 3.44Å; K339-V341 PolarHBondContact O-N 3Å; K339-L488 HydrophobicContact CG-CD2 3.68Å
340	R	85.6	Confident	87.4	Confident	153 Å²	153	56.7 Å²	56.7	58%	0.577	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.2	176.5	-59.4	177.5	-177.4	176.1	-1.7	113.1	T337 A338 N342	T337-R340 WeakPolarHBondContact O-CB 3.39Å; T337-R340 PolarHBondContact O-N 3.17Å; A338-R340 PolarHBondContact O-N 3.1Å; R340-N342 PolarHBondContact O-N 3.05Å
341	V	80	Confident	87.4	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.048	26%	0.26	C	S	.	.	S	Bend	trans	-67.3	128.6	-179.5	179.4	0	0	0	0	110.7	A338 K339 M345 A347 H365 N366 K492	A338-V341 VanDerWaalsContact O-CB 3.28Å; A338-V341 WeakPolarHBondContact O-CB 3.38Å; A338-V341 WeakPolarHBondContact O-CG2 3.3Å; A338-V341 PolarHBondContact O-N 3Å; K339-V341 PolarHBondContact O-N 3Å; V341-M345 HydrophobicContact CG1-CB 3.75Å; V341-A347 HydrophobicContact CB-CB 4.5Å; V341-H365 HydrophobicContact CG2-CB 3.5Å; V341-H365 VanDerWaalsContact CG2-CB 3.5Å; V341-H365 WeakPolarHBondContact CG2-ND1 3.35Å; V341-N366 WeakPolarHBondContact CG1-O 3.37Å; V341-N366 VanDerWaalsContact CG2-O 3.31Å; V341-N366 WeakPolarHBondContact CG2-O 2.98Å; V341-K492 PolarHBondContact O-NZ 2.79Å
342	N	68.9	Low	87.4	Confident	120 Å²	120	55.7 Å²	55.7	64%	0.642	26%	0.26	S	S	*	.			trans	-52.4	145.7	175.3	-155	-16.6	0	0	0	112	R340 K344 M345 K492	R340-N342 PolarHBondContact O-N 3.05Å; N342-K344 PolarHBondContact O-N 3Å; N342-M345 PolarHBondContact O-N 3.24Å; N342-M345 VanDerWaalsContact O-N 3.11Å; N342-K492 PolarHBondContact O-NZ 2.95Å; N342-K492 VanDerWaalsContact O-NZ 3.09Å
343	Q	64	Low	87.3	Confident	156 Å²	156	54 Å²	54	73%	0.729	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.2	-167.4	-74.6	179.4	-9	0	0	114	M345	Q343-M345 VanDerWaalsContact C-N 3.29Å; Q343-M345 PolarHBondContact O-N 3.17Å
344	K	69.1	Low	87.3	Confident	201 Å²	201	52 Å²	52	87%	0.874	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.9	-178.5	-66	-174.7	178.9	-179	0	115.3	N342	N342-K344 PolarHBondContact O-N 3Å
345	M	72.2	Confident	87.2	Confident	89 Å²	89	54 Å²	54	44%	0.438	25%	0.251	S	S	.	.	S	Bend	trans	-116.2	149.3	-176.2	-68.4	-69.9	-71.4	0	0	111	V341 N342 Q343 A347 K492	V341-M345 HydrophobicContact CG1-CB 3.75Å; N342-M345 PolarHBondContact O-N 3.24Å; N342-M345 VanDerWaalsContact O-N 3.11Å; Q343-M345 VanDerWaalsContact C-N 3.29Å; Q343-M345 PolarHBondContact O-N 3.17Å; M345-A347 PolarHBondContact O-N 3.38Å; M345-K492 PolarHBondContact O-NZ 3.07Å
346	E	80.8	Confident	87	Confident	76 Å²	76	61.5 Å²	61.5	36%	0.355	28%	0.283	S	S	.	.			trans	-60.3	130.3	175.6	-165.6	-178.1	178.8	0	0	111.1	V348 N366 R429 N489	E346-V348 HydrophobicContact CG-CG2 4.23Å; E346-V348 PolarHBondContact O-N 3.45Å; E346-N366 VanDerWaalsContact O-CB 3.24Å; E346-N366 WeakPolarHBondContact O-CB 3.36Å; E346-R429 VanDerWaalsContact OE1-CD 3.32Å; E346-R429 WeakPolarHBondContact OE1-CD 3.43Å; E346-R429 IonicContact OE1-CZ 2.82Å; E346-R429 IonicContact OE1-NE 2.92Å; E346-R429 IonicContact OE1-NH1 2.7Å; E346-R429 PolarHBondContact OE1-NH1 3.49Å; E346-R429 IonicContact OE2-CZ 3.61Å; E346-R429 IonicContact OE2-NH1 3.27Å; E346-R429 PolarHBondContact OE2-NH1 2.91Å; E346-R429 IonicContact OE2-NH2 3.62Å; E346-N489 VanDerWaalsContact CG-OD1 3.28Å; E346-N489 WeakPolarHBondContact CG-OD1 3.15Å
347	A	89.5	Confident	86.9	Confident	2 Å²	2	58.9 Å²	58.9	2%	0.017	28%	0.277	C	S	.	.			trans	-81	87.6	-174.3	0	0	0	0	0	111.1	V341 M345 L488 N489 K492	V341-A347 HydrophobicContact CB-CB 4.5Å; M345-A347 PolarHBondContact O-N 3.38Å; A347-L488 HydrophobicContact CB-CB 4.06Å; A347-N489 PolarHBondContact N-OD1 3.09Å; A347-K492 HydrophobicContact CB-CD 4.38Å
348	V	92	Very high	87	Confident	6 Å²	6	60 Å²	60	4%	0.036	29%	0.289	C	S	.	.			trans	-116.5	129.7	173.9	-174.4	0	0	0	0	109.5	E346 H365 N366 A377 V427 T428 R429	E346-V348 HydrophobicContact CG-CG2 4.23Å; E346-V348 PolarHBondContact O-N 3.45Å; V348-H365 CarbonylContact O-C 3.52Å; V348-H365 WeakPolarHBondContact O-CA 3.43Å; V348-H365 VanDerWaalsContact O-CB 3.26Å; V348-H365 WeakPolarHBondContact O-CB 3.25Å; V348-N366 HydrophobicContact CB-CB 4.3Å; V348-N366 WeakPolarHBondContact CB-ND2 3.4Å; V348-N366 VanDerWaalsContact CG2-ND2 3.29Å; V348-N366 WeakPolarHBondContact CG2-ND2 3.26Å; V348-N366 PolarHBondContact O-N 3.27Å; V348-A377 HydrophobicContact CG1-CB 4.13Å; V348-V427 HydrophobicContact CG1-CG2 4.05Å; V348-T428 WeakPolarHBondContact CA-OG1 3.42Å; V348-R429 HydrophobicContact CG1-CB 4.09Å; V348-R429 HydrophobicContact CG2-CB 4.14Å
349	G	93.8	Very high	87	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	148.3	174.8	0	0	0	0	0	110.8	A338 S364 V427 T428	A338-G349 VanDerWaalsContact CB-N 3.35Å; G349-S364 CarbonylContact C-O 3.52Å; G349-S364 WeakPolarHBondContact CA-O 3.47Å; G349-V427 WeakPolarHBondContact O-CA 3.43Å; G349-T428 PolarHBondContact N-OG1 3.14Å; G349-T428 VanDerWaalsContact N-OG1 3.11Å; G349-T428 PolarHBondContact O-N 3.1Å
350	C	95.7	Very high	87.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.6	179.5	-177.2	0	0	0	0	110.1	A363 S364 A377 V378 A381 C425 Y426 V427	C350-A363 WeakPolarHBondContact O-CA 3.39Å; C350-S364 WeakPolarHBondContact CB-OG 3.47Å; C350-S364 PolarHBondContact N-O 3.27Å; C350-S364 PolarHBondContact O-N 2.89Å; C350-S364 PolarHBondContact O-OG 2.84Å; C350-A377 HydrophobicContact CB-CB 3.67Å; C350-V378 HydrophobicContact CB-CG2 4.44Å; C350-A381 HydrophobicContact CB-CB 4.35Å; C350-C425 VanDerWaalsContact SG-SG 3.61Å; C350-Y426 CarbonylContact C-O 3.5Å; C350-Y426 VanDerWaalsContact CA-O 3.26Å; C350-Y426 WeakPolarHBondContact CA-O 3.37Å; C350-V427 HydrophobicContact CB-CG2 4.36Å
351	V	96.6	Very high	87.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	131.6	179.3	179	0	0	0	0	109	L333 A334 V353 V360 A362 A363 C425 Y426	L333-V351 HydrophobicContact CB-CG2 4.44Å; L333-V351 HydrophobicContact CD2-CG1 4.13Å; L333-V351 HydrophobicContact CD2-CG2 4.34Å; L333-V351 HydrophobicContact CG-CG2 4.08Å; A334-V351 HydrophobicContact CB-CB 4.47Å; A334-V351 HydrophobicContact CB-CG2 3.82Å; V351-V353 HydrophobicContact CG1-CG2 3.74Å; V351-V360 HydrophobicContact CG1-CG1 3.54Å; V351-V360 HydrophobicContact CG1-CG2 4.4Å; V351-A362 CarbonylContact C-O 3.54Å; V351-A362 VanDerWaalsContact CA-O 3.25Å; V351-A362 WeakPolarHBondContact CA-O 3.42Å; V351-A363 HydrophobicContact CG2-CB 4.25Å; V351-C425 CarbonylContact O-C 3.59Å; V351-C425 WeakPolarHBondContact O-CA 3.37Å; V351-Y426 PolarHBondContact N-O 3.48Å; V351-Y426 PolarHBondContact O-N 3.2Å
352	I	97.1	Very high	88.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.2	172.9	-62	175.4	0	0	0	109.1	L361 A362 A381 I382 V385 F423 D424 C425	I352-L361 PolarHBondContact O-N 3.36Å; I352-A362 HydrophobicContact CB-CB 4.27Å; I352-A362 PolarHBondContact N-O 2.97Å; I352-A362 PolarHBondContact O-N 3.09Å; I352-A381 HydrophobicContact CD1-CB 3.63Å; I352-A381 HydrophobicContact CG1-CB 3.95Å; I352-I382 HydrophobicContact CD1-CG1 4.32Å; I352-V385 HydrophobicContact CB-CG2 4.08Å; I352-V385 HydrophobicContact CD1-CG2 3.85Å; I352-V385 HydrophobicContact CG2-CG2 3.93Å; I352-F423 HydrophobicContact CG2-CB 3.74Å; I352-F423 HydrophobicContact CG2-CD2 4.11Å; I352-F423 HydrophobicContact CG2-CG 4.29Å; I352-D424 WeakPolarHBondContact CA-O 3.48Å; I352-C425 HydrophobicContact CG1-CB 4.31Å
353	V	96.3	Very high	89.3	Confident	1 Å²	1	43 Å²	43	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.7	-171.1	-171.7	0	0	0	0	110.5	Y330 V351 P355 V359 V360 F423 D424 Y426	Y330-V353 HydrophobicContact CD1-CG1 4.33Å; Y330-V353 HydrophobicContact CD1-CG2 3.72Å; Y330-V353 HydrophobicContact CD2-CG1 4.45Å; Y330-V353 HydrophobicContact CD2-CG2 4.31Å; Y330-V353 HydrophobicContact CE1-CG1 3.79Å; Y330-V353 HydrophobicContact CE1-CG2 4Å; Y330-V353 HydrophobicContact CE2-CG1 3.95Å; Y330-V353 HydrophobicContact CG-CG2 3.91Å; V351-V353 HydrophobicContact CG1-CG2 3.74Å; V353-P355 WeakPolarHBondContact O-CD 3.34Å; V353-V359 WeakPolarHBondContact CA-O 3.41Å; V353-V359 WeakPolarHBondContact CG1-O 3Å; V353-V360 HydrophobicContact CG2-CG2 4.24Å; V353-F423 WeakPolarHBondContact O-CA 3.29Å; V353-F423 WeakPolarHBondContact O-CB 3.43Å; V353-D424 PolarHBondContact N-O 2.95Å; V353-D424 PolarHBondContact O-N 3.01Å; V353-Y426 HydrophobicContact CB-CE2 4.3Å; V353-Y426 HydrophobicContact CG2-CD2 4.01Å; V353-Y426 HydrophobicContact CG2-CE2 3.89Å
354	E	94.4	Very high	90.6	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.037	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	110	162.5	-160.9	-82.5	179.5	0	0	108.3	K356 S357 G358 V359 L361 L409 R413 F417 F423	E354-K356 VanDerWaalsContact C-N 3.32Å; E354-K356 PolarHBondContact O-N 3.45Å; E354-K356 PolarHBondContact OE2-N 2.92Å; E354-S357 PolarHBondContact O-OG 3.48Å; E354-S357 WeakPolarHBondContact OE2-CA 3.44Å; E354-S357 WeakPolarHBondContact OE2-CB 3.41Å; E354-S357 PolarHBondContact OE2-N 3.2Å; E354-S357 PolarHBondContact OE2-OG 2.75Å; E354-G358 WeakPolarHBondContact O-CA 3.39Å; E354-G358 PolarHBondContact O-N 2.95Å; E354-V359 PolarHBondContact N-O 3.19Å; E354-V359 PolarHBondContact O-N 2.95Å; E354-L361 HydrophobicContact CB-CD1 4.21Å; E354-L361 HydrophobicContact CB-CG 4.44Å; E354-L409 HydrophobicContact CB-CD1 4.35Å; E354-L409 HydrophobicContact CG-CD1 4.48Å; E354-R413 IonicContact OE1-CZ 3.54Å; E354-R413 VanDerWaalsContact OE1-CZ 3.29Å; E354-R413 IonicContact OE1-NE 2.64Å; E354-R413 PolarHBondContact OE1-NE 3.03Å; E354-R413 IonicContact OE1-NH2 3.52Å; E354-R413 PolarHBondContact OE1-NH2 3.49Å; E354-F417 HydrophobicContact CG-CE1 4.27Å; E354-F417 HydrophobicContact CG-CZ 3.8Å; E354-F423 HydrophobicContact CB-CD1 4.08Å; E354-F423 HydrophobicContact CB-CE1 4.09Å; E354-F423 HydrophobicContact CG-CD1 3.91Å; E354-F423 HydrophobicContact CG-CE1 3.67Å
355	P	93.2	Very high	91.6	Very high	41 Å²	41	26.6 Å²	26.6	27%	0.266	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-16.9	-162.8	28.3	-35.6	0	0	0	114	V353 G422	V353-P355 WeakPolarHBondContact O-CD 3.34Å; P355-G422 WeakPolarHBondContact CD-O 3.46Å; P355-G422 VanDerWaalsContact CG-O 3.23Å; P355-G422 WeakPolarHBondContact CG-O 3.31Å
356	K	91.6	Very high	92.1	Very high	169 Å²	169	22.8 Å²	22.8	74%	0.735	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-24.2	-176.1	-69.5	177.7	175.8	-177.6	0	112.2	E354	E354-K356 VanDerWaalsContact C-N 3.32Å; E354-K356 PolarHBondContact O-N 3.45Å; E354-K356 PolarHBondContact OE2-N 2.92Å
357	S	91.3	Very high	91.3	Very high	56 Å²	56	20.2 Å²	20.2	39%	0.392	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-22.8	175.3	63.1	0	0	0	0	111.7	E354 V359 L409	E354-S357 PolarHBondContact O-OG 3.48Å; E354-S357 WeakPolarHBondContact OE2-CA 3.44Å; E354-S357 WeakPolarHBondContact OE2-CB 3.41Å; E354-S357 PolarHBondContact OE2-N 3.2Å; E354-S357 PolarHBondContact OE2-OG 2.75Å; S357-V359 PolarHBondContact O-N 3.23Å; S357-V359 WeakPolarHBondContact OG-CG2 3.36Å; S357-V359 PolarHBondContact OG-N 2.89Å; S357-L409 WeakPolarHBondContact OG-CD2 3.47Å
358	G	92.5	Very high	89.8	Confident	25 Å²	25	21 Å²	21	26%	0.258	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	7.7	-174.1	0	0	0	0	0	114.4	Y330 E354 V360	Y330-G358 WeakPolarHBondContact OH-CA 3.36Å; Y330-G358 PolarHBondContact OH-O 3.06Å; E354-G358 WeakPolarHBondContact O-CA 3.39Å; E354-G358 PolarHBondContact O-N 2.95Å; G358-V360 PolarHBondContact O-N 3.32Å
359	V	92.9	Very high	87.7	Confident	31 Å²	31	22.5 Å²	22.5	19%	0.188	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.9	179.6	173.6	0	0	0	0	110.4	V353 E354 S357 L361 A404 L409	V353-V359 WeakPolarHBondContact CA-O 3.41Å; V353-V359 WeakPolarHBondContact CG1-O 3Å; E354-V359 PolarHBondContact N-O 3.19Å; E354-V359 PolarHBondContact O-N 2.95Å; S357-V359 PolarHBondContact O-N 3.23Å; S357-V359 WeakPolarHBondContact OG-CG2 3.36Å; S357-V359 PolarHBondContact OG-N 2.89Å; V359-L361 HydrophobicContact CG1-CD2 4.29Å; V359-L361 PolarHBondContact O-N 3.27Å; V359-A404 HydrophobicContact CG1-CB 3.72Å; V359-L409 HydrophobicContact CB-CD1 4.4Å; V359-L409 HydrophobicContact CB-CD2 4.16Å; V359-L409 HydrophobicContact CB-CG 4.31Å; V359-L409 HydrophobicContact CG1-CD1 4.39Å; V359-L409 HydrophobicContact CG1-CG 4.36Å; V359-L409 HydrophobicContact CG2-CD2 3.74Å; V359-L409 HydrophobicContact CG2-CG 4.14Å
360	V	94.5	Very high	85.7	Confident	36 Å²	36	28.7 Å²	28.7	22%	0.218	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	105.1	173.5	177.4	0	0	0	0	108.8	Y330 L333 V351 V353 G358 A404	Y330-V360 HydrophobicContact CD1-CG2 4.11Å; Y330-V360 HydrophobicContact CE1-CG2 3.88Å; L333-V360 HydrophobicContact CD2-CB 4.47Å; L333-V360 HydrophobicContact CD2-CG1 4.06Å; L333-V360 HydrophobicContact CD2-CG2 3.79Å; V351-V360 HydrophobicContact CG1-CG1 3.54Å; V351-V360 HydrophobicContact CG1-CG2 4.4Å; V353-V360 HydrophobicContact CG2-CG2 4.24Å; G358-V360 PolarHBondContact O-N 3.32Å; V360-A404 WeakPolarHBondContact O-CB 3.4Å
361	L	92.5	Very high	83.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-38	-177.1	-65.1	172.7	0	0	0	112.4	I352 E354 V359 V385 F388 A404 L409 F423	I352-L361 PolarHBondContact O-N 3.36Å; E354-L361 HydrophobicContact CB-CD1 4.21Å; E354-L361 HydrophobicContact CB-CG 4.44Å; V359-L361 HydrophobicContact CG1-CD2 4.29Å; V359-L361 PolarHBondContact O-N 3.27Å; L361-V385 HydrophobicContact CB-CG2 4.23Å; L361-F388 HydrophobicContact CD2-CD1 4.09Å; L361-F388 HydrophobicContact CD2-CD2 4.27Å; L361-F388 HydrophobicContact CD2-CE1 3.84Å; L361-F388 HydrophobicContact CD2-CE2 4.03Å; L361-F388 HydrophobicContact CD2-CG 4.29Å; L361-F388 HydrophobicContact CD2-CZ 3.8Å; L361-A404 HydrophobicContact CD2-CB 4.31Å; L361-A404 PolarHBondContact O-N 2.91Å; L361-L409 HydrophobicContact CD2-CD1 3.88Å; L361-F423 HydrophobicContact CD1-CD1 3.93Å; L361-F423 HydrophobicContact CD1-CD2 3.48Å; L361-F423 VanDerWaalsContact CD1-CD2 3.48Å; L361-F423 HydrophobicContact CD1-CE1 3.78Å; L361-F423 HydrophobicContact CD1-CE2 3.32Å; L361-F423 HydrophobicContact CD1-CG 3.81Å; L361-F423 HydrophobicContact CD1-CZ 3.49Å; L361-F423 VanDerWaalsContact CD1-CZ 3.49Å
362	A	92.7	Very high	82.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.2	-178.2	0	0	0	0	0	111	V351 I352 A381 I384 V385 S402	V351-A362 CarbonylContact C-O 3.54Å; V351-A362 VanDerWaalsContact CA-O 3.25Å; V351-A362 WeakPolarHBondContact CA-O 3.42Å; I352-A362 HydrophobicContact CB-CB 4.27Å; I352-A362 PolarHBondContact N-O 2.97Å; I352-A362 PolarHBondContact O-N 3.09Å; A362-A381 HydrophobicContact CB-CB 4.2Å; A362-A381 WeakPolarHBondContact CB-O 3.27Å; A362-I384 HydrophobicContact CB-CB 3.72Å; A362-I384 HydrophobicContact CB-CD1 4.33Å; A362-I384 HydrophobicContact CB-CG2 3.52Å; A362-V385 HydrophobicContact CB-CG2 3.98Å; A362-S402 WeakPolarHBondContact CA-O 3.47Å
363	A	93.4	Very high	81.1	Confident	7 Å²	7	47.5 Å²	47.5	6%	0.058	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.5	164.2	0	0	0	0	0	109.5	T337 C350 V351 F401 S402	T337-A363 HydrophobicContact CG2-CB 4.31Å; C350-A363 WeakPolarHBondContact O-CA 3.39Å; V351-A363 HydrophobicContact CG2-CB 4.25Å; A363-F401 WeakPolarHBondContact O-CA 3.41Å; A363-F401 WeakPolarHBondContact O-CD1 3.28Å; A363-S402 PolarHBondContact N-O 3.11Å; A363-S402 PolarHBondContact O-N 3.27Å
364	S	91.6	Very high	80	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	159.4	-172.1	55.8	0	0	0	0	113	T337 G349 C350 A377 A381	T337-S364 WeakPolarHBondContact CG2-O 3.36Å; G349-S364 CarbonylContact C-O 3.52Å; G349-S364 WeakPolarHBondContact CA-O 3.47Å; C350-S364 WeakPolarHBondContact CB-OG 3.47Å; C350-S364 PolarHBondContact N-O 3.27Å; C350-S364 PolarHBondContact O-N 2.89Å; C350-S364 PolarHBondContact O-OG 2.84Å; S364-A377 WeakPolarHBondContact CB-O 3.43Å; S364-A377 PolarHBondContact OG-O 3.48Å; S364-A381 WeakPolarHBondContact OG-CB 3.46Å; S364-A381 PolarHBondContact OG-N 3.47Å
365	H	89.9	Confident	79.1	Confident	11 Å²	11	53.5 Å²	53.5	5%	0.051	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	166.1	172.3	62.9	77.5	0	0	0	113.7	T337 V341 V348 M368	T337-H365 HydrophobicContact CG2-CB 4.2Å; T337-H365 WeakPolarHBondContact O-CB 3.48Å; T337-H365 PolarHBondContact O-CD2 3.3Å; T337-H365 VanDerWaalsContact O-CD2 3.27Å; V341-H365 HydrophobicContact CG2-CB 3.5Å; V341-H365 VanDerWaalsContact CG2-CB 3.5Å; V341-H365 WeakPolarHBondContact CG2-ND1 3.35Å; V348-H365 CarbonylContact O-C 3.52Å; V348-H365 WeakPolarHBondContact O-CA 3.43Å; V348-H365 VanDerWaalsContact O-CB 3.26Å; V348-H365 WeakPolarHBondContact O-CB 3.25Å; H365-M368 VanDerWaalsContact CD2-SD 3.57Å; H365-M368 VanDerWaalsContact CE1-CG 3.47Å; H365-M368 WeakPolarHBondContact CE1-CG 3.35Å; H365-M368 PolarHBondContact CE1-SD 2.91Å; H365-M368 VanDerWaalsContact CG-SD 3.6Å; H365-M368 PolarHBondContact ND1-SD 2.88Å; H365-M368 VanDerWaalsContact ND1-SD 3.43Å; H365-M368 WeakPolarHBondContact NE2-CE 3.29Å; H365-M368 PolarHBondContact NE2-SD 2.96Å; H365-M368 VanDerWaalsContact NE2-SD 3.43Å
366	N	81.3	Confident	78.8	Confident	10 Å²	10	53.8 Å²	53.8	5%	0.053	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	156.1	173.2	-81.6	4.4	0	0	0	111.3	V341 E346 V348 H376 A377	V341-N366 WeakPolarHBondContact CG1-O 3.37Å; V341-N366 VanDerWaalsContact CG2-O 3.31Å; V341-N366 WeakPolarHBondContact CG2-O 2.98Å; E346-N366 VanDerWaalsContact O-CB 3.24Å; E346-N366 WeakPolarHBondContact O-CB 3.36Å; V348-N366 HydrophobicContact CB-CB 4.3Å; V348-N366 WeakPolarHBondContact CB-ND2 3.4Å; V348-N366 VanDerWaalsContact CG2-ND2 3.29Å; V348-N366 WeakPolarHBondContact CG2-ND2 3.26Å; V348-N366 PolarHBondContact O-N 3.27Å; N366-H376 WeakPolarHBondContact OD1-CA 3.47Å; N366-A377 PolarHBondContact OD1-N 3.06Å
367	G	65.1	Low	78.7	Confident	22 Å²	22	45.8 Å²	45.8	23%	0.227	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	14	171.1	0	0	0	0	0	116.1
368	M	57.5	Low	78.8	Confident	19 Å²	19	43.3 Å²	43.3	9%	0.094	24%	0.244	C	C	.	.	S	Bend	trans	-78.1	-13.4	179.7	-96	146.7	133.5	0	0	114.9	H365 P398 P399 F401	H365-M368 VanDerWaalsContact CD2-SD 3.57Å; H365-M368 VanDerWaalsContact CE1-CG 3.47Å; H365-M368 WeakPolarHBondContact CE1-CG 3.35Å; H365-M368 PolarHBondContact CE1-SD 2.91Å; H365-M368 VanDerWaalsContact CG-SD 3.6Å; H365-M368 PolarHBondContact ND1-SD 2.88Å; H365-M368 VanDerWaalsContact ND1-SD 3.43Å; H365-M368 WeakPolarHBondContact NE2-CE 3.29Å; H365-M368 PolarHBondContact NE2-SD 2.96Å; H365-M368 VanDerWaalsContact NE2-SD 3.43Å; M368-P398 HydrophobicContact CB-CG 3.57Å; M368-P398 HydrophobicContact CG-CG 3.74Å; M368-P398 VanDerWaalsContact O-CG 3.31Å; M368-P398 WeakPolarHBondContact O-CG 3.44Å; M368-P399 WeakPolarHBondContact CE-O 3.23Å; M368-F401 HydrophobicContact CB-CE2 3.78Å; M368-F401 HydrophobicContact CB-CZ 3.66Å; M368-F401 HydrophobicContact CE-CB 4.07Å; M368-F401 HydrophobicContact CE-CD1 3.33Å; M368-F401 HydrophobicContact CE-CD2 3.27Å; M368-F401 HydrophobicContact CE-CE1 3.46Å; M368-F401 VanDerWaalsContact CE-CE1 3.46Å; M368-F401 HydrophobicContact CE-CE2 3.4Å; M368-F401 HydrophobicContact CE-CG 3.25Å; M368-F401 HydrophobicContact CE-CZ 3.52Å; M368-F401 HydrophobicContact CG-CE1 4.45Å; M368-F401 HydrophobicContact CG-CE2 3.81Å; M368-F401 HydrophobicContact CG-CZ 3.78Å; M368-F401 HydrophobicContact SD-CD1 3.73Å; M368-F401 HydrophobicContact SD-CD2 4.01Å; M368-F401 HydrophobicContact SD-CE1 3.16Å; M368-F401 WeakPolarHBondContact SD-CE1 3.42Å; M368-F401 HydrophobicContact SD-CE2 3.47Å; M368-F401 WeakPolarHBondContact SD-CE2 3.28Å; M368-F401 HydrophobicContact SD-CG 4.14Å; M368-F401 HydrophobicContact SD-CZ 3.03Å; M368-F401 WeakPolarHBondContact SD-CZ 3.46Å
369	T	48.8	Very low	78.7	Confident	37 Å²	37	43.6 Å²	43.6	23%	0.227	24%	0.24	C	C	.	.			trans	-146.8	128.2	157.6	57.5	0	0	0	0	110.5	S371 K375	T369-S371 PolarHBondContact O-N 3.31Å; T369-K375 WeakPolarHBondContact OG1-CD 3.21Å; T369-K375 VanDerWaalsContact OG1-CE 3.26Å; T369-K375 WeakPolarHBondContact OG1-CE 3.35Å; T369-K375 PolarHBondContact OG1-NZ 3.17Å
370	S	50.8	Low	78.4	Confident	129 Å²	129	42.4 Å²	42.4	90%	0.902	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.9	-178.3	53.6	0	0	0	0	114.4
371	S	57.4	Low	78.3	Confident	108 Å²	108	40.7 Å²	40.7	76%	0.755	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-29.3	-172.5	57.4	0	0	0	0	114.8	T369	T369-S371 PolarHBondContact O-N 3.31Å
372	N	66.1	Low	78.3	Confident	56 Å²	56	42.1 Å²	42.1	30%	0.299	23%	0.23	S	C	.	.			trans	-112.1	105.2	-172.2	-169.3	-17.8	0	0	0	112.6	L374 K375	N372-L374 PolarHBondContact O-N 3.31Å; N372-L374 WeakPolarHBondContact OD1-CB 3.37Å; N372-L374 PolarHBondContact OD1-N 2.88Å; N372-K375 HydrophobicContact CB-CD 4.33Å; N372-K375 HydrophobicContact CB-CG 4.09Å; N372-K375 PolarHBondContact O-N 3.46Å
373	R	70.7	Confident	78	Confident	231 Å²	231	42.4 Å²	42.4	87%	0.872	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.8	180	-62	-171.6	-175.6	-159.8	2	114.3	H376	R373-H376 PolarHBondContact O-NE2 3.01Å
374	L	73	Confident	77.7	Confident	104 Å²	104	42.1 Å²	42.1	55%	0.545	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.7	-180	-55.9	176.8	0	0	0	113.2	N372 H376 M434	N372-L374 PolarHBondContact O-N 3.31Å; N372-L374 WeakPolarHBondContact OD1-CB 3.37Å; N372-L374 PolarHBondContact OD1-N 2.88Å; L374-H376 PolarHBondContact O-N 3.39Å; L374-M434 HydrophobicContact CB-SD 4.28Å; L374-M434 HydrophobicContact CD2-SD 3.76Å; L374-M434 WeakPolarHBondContact O-CE 3.36Å
375	K	75.4	Confident	77.7	Confident	31 Å²	31	42.1 Å²	42.1	14%	0.135	23%	0.229	C	C	.	.			trans	-78.1	66.7	-179.9	-71.4	-168.8	-165.5	179.9	0	112.1	T369 N372 F395	T369-K375 WeakPolarHBondContact OG1-CD 3.21Å; T369-K375 VanDerWaalsContact OG1-CE 3.26Å; T369-K375 WeakPolarHBondContact OG1-CE 3.35Å; T369-K375 PolarHBondContact OG1-NZ 3.17Å; N372-K375 HydrophobicContact CB-CD 4.33Å; N372-K375 HydrophobicContact CB-CG 4.09Å; N372-K375 PolarHBondContact O-N 3.46Å; K375-F395 HydrophobicContact CD-CB 4.23Å; K375-F395 HydrophobicContact CD-CD1 4.03Å; K375-F395 HydrophobicContact CD-CD2 4.37Å; K375-F395 HydrophobicContact CD-CE1 4.43Å; K375-F395 HydrophobicContact CD-CG 3.93Å; K375-F395 HydrophobicContact CG-CD1 4.06Å; K375-F395 HydrophobicContact CG-CD2 4.2Å; K375-F395 HydrophobicContact CG-CE1 3.97Å; K375-F395 HydrophobicContact CG-CE2 4.17Å; K375-F395 HydrophobicContact CG-CG 4.12Å; K375-F395 HydrophobicContact CG-CZ 4.02Å
376	H	85.8	Confident	77.5	Confident	48 Å²	48	43 Å²	43	22%	0.222	24%	0.239	C	C	.	.			trans	-73.2	153.4	167.7	-65.2	-178	0	0	0	110.2	N366 R373 L374 V378 I379 A380 C432 M434 C435	N366-H376 WeakPolarHBondContact OD1-CA 3.47Å; R373-H376 PolarHBondContact O-NE2 3.01Å; L374-H376 PolarHBondContact O-N 3.39Å; H376-V378 PolarHBondContact O-N 3.24Å; H376-V378 VanDerWaalsContact O-N 3.13Å; H376-I379 HydrophobicContact CB-CG1 4.36Å; H376-I379 PolarHBondContact O-N 2.86Å; H376-A380 PolarHBondContact O-N 3.37Å; H376-C432 VanDerWaalsContact CE1-SG 3.54Å; H376-C432 PolarHBondContact ND1-SG 2.73Å; H376-C432 VanDerWaalsContact ND1-SG 3.43Å; H376-M434 HydrophobicContact CB-CE 4.34Å; H376-M434 WeakPolarHBondContact ND1-CE 3.43Å; H376-C435 WeakPolarHBondContact CB-SG 3.43Å; H376-C435 PolarHBondContact ND1-SG 3.46Å
377	A	90.8	Very high	77.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-48.8	-43.4	179.1	0	0	0	0	0	112.4	V348 C350 S364 N366 I379 A380 A381	V348-A377 HydrophobicContact CG1-CB 4.13Å; C350-A377 HydrophobicContact CB-CB 3.67Å; S364-A377 WeakPolarHBondContact CB-O 3.43Å; S364-A377 PolarHBondContact OG-O 3.48Å; N366-A377 PolarHBondContact OD1-N 3.06Å; A377-I379 PolarHBondContact O-N 2.88Å; A377-A380 PolarHBondContact O-N 3.3Å; A377-A381 PolarHBondContact O-N 3.37Å
378	V	92.9	Very high	78.6	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.4	177.2	0	0	0	0	112.4	C350 H376 A380 A381 I382 V427 P431 C435 L439	C350-V378 HydrophobicContact CB-CG2 4.44Å; H376-V378 PolarHBondContact O-N 3.24Å; H376-V378 VanDerWaalsContact O-N 3.13Å; V378-A380 VanDerWaalsContact C-N 3.35Å; V378-A381 PolarHBondContact O-N 2.99Å; V378-I382 HydrophobicContact CG1-CD1 4.11Å; V378-I382 WeakPolarHBondContact O-CG1 3.46Å; V378-I382 PolarHBondContact O-N 3.02Å; V378-I382 VanDerWaalsContact O-N 3.09Å; V378-V427 HydrophobicContact CG2-CB 4.48Å; V378-V427 HydrophobicContact CG2-CG2 3.88Å; V378-P431 HydrophobicContact CG2-CG 4.34Å; V378-C435 HydrophobicContact CB-CB 3.86Å; V378-C435 HydrophobicContact CG1-CB 3.94Å; V378-C435 HydrophobicContact CG2-CB 4.16Å; V378-L439 HydrophobicContact CG1-CD1 3.68Å; V378-L439 HydrophobicContact CG1-CD2 3.94Å; V378-L439 HydrophobicContact CG1-CG 3.59Å
379	I	89.2	Confident	79.9	Confident	32 Å²	32	46.4 Å²	46.4	16%	0.164	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-43.4	179.6	-57.7	-56.8	0	0	0	110.2	H376 A377 A381 I382 D383 F395 M434 A438	H376-I379 HydrophobicContact CB-CG1 4.36Å; H376-I379 PolarHBondContact O-N 2.86Å; A377-I379 PolarHBondContact O-N 2.88Å; I379-A381 VanDerWaalsContact C-N 3.33Å; I379-A381 PolarHBondContact O-N 3.31Å; I379-I382 PolarHBondContact O-N 2.83Å; I379-D383 PolarHBondContact O-N 2.94Å; I379-F395 HydrophobicContact CG2-CE2 3.9Å; I379-F395 HydrophobicContact CG2-CZ 4.4Å; I379-M434 HydrophobicContact CD1-CE 4.41Å; I379-M434 HydrophobicContact CD1-CG 4.44Å; I379-M434 HydrophobicContact CG1-CE 3.87Å; I379-A438 HydrophobicContact CD1-CB 3.37Å
380	A	88.1	Confident	81.5	Confident	6 Å²	6	47.9 Å²	47.9	5%	0.05	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-37	176.4	0	0	0	0	0	112.4	H376 A377 V378 D383 I384 F401	H376-A380 PolarHBondContact O-N 3.37Å; A377-A380 PolarHBondContact O-N 3.3Å; V378-A380 VanDerWaalsContact C-N 3.35Å; A380-D383 PolarHBondContact O-N 3.15Å; A380-I384 VanDerWaalsContact O-CG1 3.32Å; A380-I384 WeakPolarHBondContact O-CG1 3.42Å; A380-I384 PolarHBondContact O-N 2.9Å; A380-F401 HydrophobicContact CB-CE1 3.61Å; A380-F401 HydrophobicContact CB-CZ 3.74Å
381	A	92.1	Very high	82.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-43.8	175.5	0	0	0	0	0	111.7	C350 I352 A362 S364 A377 V378 I379 D383 I384 V385	C350-A381 HydrophobicContact CB-CB 4.35Å; I352-A381 HydrophobicContact CD1-CB 3.63Å; I352-A381 HydrophobicContact CG1-CB 3.95Å; A362-A381 HydrophobicContact CB-CB 4.2Å; A362-A381 WeakPolarHBondContact CB-O 3.27Å; S364-A381 WeakPolarHBondContact OG-CB 3.46Å; S364-A381 PolarHBondContact OG-N 3.47Å; A377-A381 PolarHBondContact O-N 3.37Å; V378-A381 PolarHBondContact O-N 2.99Å; I379-A381 VanDerWaalsContact C-N 3.33Å; I379-A381 PolarHBondContact O-N 3.31Å; A381-D383 VanDerWaalsContact C-N 3.3Å; A381-D383 PolarHBondContact O-N 2.98Å; A381-I384 PolarHBondContact O-N 3.48Å; A381-V385 WeakPolarHBondContact O-CG2 3.34Å; A381-V385 PolarHBondContact O-N 3.5Å
382	I	91.7	Very high	83.7	Confident	29 Å²	29	46.6 Å²	46.6	15%	0.149	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-41.4	177.2	-68.3	165.5	0	0	0	110.5	I352 V378 I379 V385 A386 A438 L439 S442	I352-I382 HydrophobicContact CD1-CG1 4.32Å; V378-I382 HydrophobicContact CG1-CD1 4.11Å; V378-I382 WeakPolarHBondContact O-CG1 3.46Å; V378-I382 PolarHBondContact O-N 3.02Å; V378-I382 VanDerWaalsContact O-N 3.09Å; I379-I382 PolarHBondContact O-N 2.83Å; I382-V385 PolarHBondContact O-N 3.09Å; I382-A386 PolarHBondContact O-N 3.06Å; I382-A438 HydrophobicContact CD1-CB 3.76Å; I382-L439 HydrophobicContact CD1-CD2 4.13Å; I382-L439 HydrophobicContact CD1-CG 4.3Å; I382-L439 HydrophobicContact CG1-CD2 4.47Å; I382-S442 WeakPolarHBondContact CG2-OG 3.38Å
383	D	86.4	Confident	83.9	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-40.2	177.3	-168.6	37.8	0	0	0	112.1	I379 A380 A381 V385 A386 Q387 L394 F395	I379-D383 PolarHBondContact O-N 2.94Å; A380-D383 PolarHBondContact O-N 3.15Å; A381-D383 VanDerWaalsContact C-N 3.3Å; A381-D383 PolarHBondContact O-N 2.98Å; D383-V385 VanDerWaalsContact C-N 3.35Å; D383-V385 PolarHBondContact O-N 3.5Å; D383-A386 WeakPolarHBondContact O-CB 3.48Å; D383-A386 PolarHBondContact O-N 3.44Å; D383-Q387 WeakPolarHBondContact O-CG 3.28Å; D383-Q387 PolarHBondContact O-N 3.01Å; D383-L394 WeakPolarHBondContact OD1-CB 3.4Å; D383-L394 PolarHBondContact OD1-N 2.77Å; D383-L394 PolarHBondContact OD2-N 2.74Å; D383-L394 VanDerWaalsContact OD2-N 3.12Å; D383-F395 HydrophobicContact CB-CD2 4.35Å; D383-F395 WeakPolarHBondContact OD2-CD2 3.28Å; D383-F395 PolarHBondContact OD2-N 3.13Å; D383-F395 VanDerWaalsContact OD2-N 3.17Å
384	I	88.5	Confident	83.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-42	173.1	-69.2	162.1	0	0	0	111.5	A362 A380 A381 A386 Q387 F388 L397 F401 I403	A362-I384 HydrophobicContact CB-CB 3.72Å; A362-I384 HydrophobicContact CB-CD1 4.33Å; A362-I384 HydrophobicContact CB-CG2 3.52Å; A380-I384 VanDerWaalsContact O-CG1 3.32Å; A380-I384 WeakPolarHBondContact O-CG1 3.42Å; A380-I384 PolarHBondContact O-N 2.9Å; A381-I384 PolarHBondContact O-N 3.48Å; I384-A386 VanDerWaalsContact C-N 3.29Å; I384-A386 PolarHBondContact O-N 3.05Å; I384-Q387 WeakPolarHBondContact O-CB 3.36Å; I384-Q387 PolarHBondContact O-N 3.09Å; I384-F388 PolarHBondContact O-N 3.19Å; I384-L397 HydrophobicContact CD1-CD2 4.14Å; I384-L397 HydrophobicContact CG1-CD2 3.62Å; I384-F401 HydrophobicContact CD1-CB 3.87Å; I384-F401 HydrophobicContact CD1-CD1 3.44Å; I384-F401 VanDerWaalsContact CD1-CD1 3.44Å; I384-F401 HydrophobicContact CD1-CE1 4.18Å; I384-F401 HydrophobicContact CD1-CG 3.85Å; I384-I403 HydrophobicContact CG2-CB 4.13Å; I384-I403 HydrophobicContact CG2-CG1 3.8Å; I384-I403 HydrophobicContact CG2-CG2 4.06Å
385	V	90.2	Very high	83.3	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-37.7	175.8	174.1	0	0	0	0	110.9	I352 L361 A362 A381 I382 D383 Q387 F388 H389 F423	I352-V385 HydrophobicContact CB-CG2 4.08Å; I352-V385 HydrophobicContact CD1-CG2 3.85Å; I352-V385 HydrophobicContact CG2-CG2 3.93Å; L361-V385 HydrophobicContact CB-CG2 4.23Å; A362-V385 HydrophobicContact CB-CG2 3.98Å; A381-V385 WeakPolarHBondContact O-CG2 3.34Å; A381-V385 PolarHBondContact O-N 3.5Å; I382-V385 PolarHBondContact O-N 3.09Å; D383-V385 VanDerWaalsContact C-N 3.35Å; D383-V385 PolarHBondContact O-N 3.5Å; V385-Q387 VanDerWaalsContact C-N 3.32Å; V385-Q387 PolarHBondContact O-N 2.7Å; V385-F388 WeakPolarHBondContact O-CB 3.49Å; V385-F388 PolarHBondContact O-N 3.47Å; V385-H389 PolarHBondContact O-CD2 3Å; V385-H389 PolarHBondContact O-N 3.3Å; V385-H389 VanDerWaalsContact O-N 3.14Å; V385-F423 HydrophobicContact CG1-CD2 4.26Å; V385-F423 HydrophobicContact CG1-CE2 3.95Å
386	A	86.5	Confident	82.9	Confident	30 Å²	30	44.3 Å²	44.3	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-41.2	174.2	0	0	0	0	0	111.5	I382 D383 I384 H389 G390 A391	I382-A386 PolarHBondContact O-N 3.06Å; D383-A386 WeakPolarHBondContact O-CB 3.48Å; D383-A386 PolarHBondContact O-N 3.44Å; I384-A386 VanDerWaalsContact C-N 3.29Å; I384-A386 PolarHBondContact O-N 3.05Å; A386-H389 CarbonylContact O-C 3.58Å; A386-H389 WeakPolarHBondContact O-CA 3.2Å; A386-H389 WeakPolarHBondContact O-CB 3.29Å; A386-H389 PolarHBondContact O-N 3.04Å; A386-H389 VanDerWaalsContact O-N 3.1Å; A386-G390 PolarHBondContact O-N 2.9Å; A386-A391 HydrophobicContact CB-CB 4Å; A386-A391 WeakPolarHBondContact O-CB 3.21Å; A386-A391 PolarHBondContact O-N 3.3Å
387	Q	84.8	Confident	81.9	Confident	33 Å²	33	45 Å²	45	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-37.8	174.2	-70.2	176.3	67.5	0	0	113	D383 I384 V385 H389 G390 A391 P393	D383-Q387 WeakPolarHBondContact O-CG 3.28Å; D383-Q387 PolarHBondContact O-N 3.01Å; I384-Q387 WeakPolarHBondContact O-CB 3.36Å; I384-Q387 PolarHBondContact O-N 3.09Å; V385-Q387 VanDerWaalsContact C-N 3.32Å; V385-Q387 PolarHBondContact O-N 2.7Å; Q387-H389 PolarHBondContact O-N 3.38Å; Q387-G390 WeakPolarHBondContact O-CA 3.46Å; Q387-G390 PolarHBondContact O-N 3.2Å; Q387-A391 WeakPolarHBondContact CA-O 3.47Å; Q387-P393 VanDerWaalsContact CD-CB 3.45Å; Q387-P393 HydrophobicContact CG-CB 4.12Å
388	F	84.7	Confident	80.4	Confident	16 Å²	16	46.5 Å²	46.5	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-32	171.9	177.7	-93.5	0	0	0	112.1	L361 I384 V385 G390 I403 A404 L409 R414 F417	L361-F388 HydrophobicContact CD2-CD1 4.09Å; L361-F388 HydrophobicContact CD2-CD2 4.27Å; L361-F388 HydrophobicContact CD2-CE1 3.84Å; L361-F388 HydrophobicContact CD2-CE2 4.03Å; L361-F388 HydrophobicContact CD2-CG 4.29Å; L361-F388 HydrophobicContact CD2-CZ 3.8Å; I384-F388 PolarHBondContact O-N 3.19Å; V385-F388 WeakPolarHBondContact O-CB 3.49Å; V385-F388 PolarHBondContact O-N 3.47Å; F388-G390 PolarHBondContact O-N 3.2Å; F388-I403 HydrophobicContact CB-CG2 4.33Å; F388-A404 HydrophobicContact CD2-CB 4.35Å; F388-A404 WeakPolarHBondContact CD2-O 3.39Å; F388-A404 HydrophobicContact CE2-CB 4.16Å; F388-L409 HydrophobicContact CZ-CD1 4.04Å; F388-R414 HydrophobicContact CE1-CG 4.27Å; F388-R414 HydrophobicContact CZ-CG 4.17Å; F388-F417 HydrophobicContact CE1-CD2 4.17Å; F388-F417 HydrophobicContact CE1-CE2 4.26Å
389	H	84.9	Confident	78.7	Confident	72 Å²	72	52.3 Å²	52.3	33%	0.333	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-0.9	172.1	-62.3	-47	0	0	0	114.2	V385 A386 Q387 F417 L419	V385-H389 PolarHBondContact O-CD2 3Å; V385-H389 PolarHBondContact O-N 3.3Å; V385-H389 VanDerWaalsContact O-N 3.14Å; A386-H389 CarbonylContact O-C 3.58Å; A386-H389 WeakPolarHBondContact O-CA 3.2Å; A386-H389 WeakPolarHBondContact O-CB 3.29Å; A386-H389 PolarHBondContact O-N 3.04Å; A386-H389 VanDerWaalsContact O-N 3.1Å; Q387-H389 PolarHBondContact O-N 3.38Å; H389-F417 VanDerWaalsContact CE1-CB 3.46Å; H389-F417 WeakPolarHBondContact CE1-CB 3.49Å; H389-L419 PolarHBondContact NE2-O 3.39Å
390	G	81	Confident	77.2	Confident	69 Å²	69	51.8 Å²	51.8	71%	0.711	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	11.2	179.9	0	0	0	0	0	115.1	A386 Q387 F388	A386-G390 PolarHBondContact O-N 2.9Å; Q387-G390 WeakPolarHBondContact O-CA 3.46Å; Q387-G390 PolarHBondContact O-N 3.2Å; F388-G390 PolarHBondContact O-N 3.2Å
391	A	80.1	Confident	76.2	Confident	50 Å²	50	53.3 Å²	53.3	41%	0.413	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-73.5	154.8	172.4	0	0	0	0	0	111.4	A386 Q387	A386-A391 HydrophobicContact CB-CB 4Å; A386-A391 WeakPolarHBondContact O-CB 3.21Å; A386-A391 PolarHBondContact O-N 3.3Å; Q387-A391 WeakPolarHBondContact CA-O 3.47Å
392	L	74	Confident	75.3	Confident	160 Å²	160	56.3 Å²	56.3	84%	0.838	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-69	138.6	168.6	-75.7	159.4	0	0	0	109.9	L394	L392-L394 PolarHBondContact O-N 3.35Å
393	P	71.2	Confident	74.5	Confident	62 Å²	62	58 Å²	58	40%	0.403	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-53.4	132	172.6	10.2	-20	0	0	0	111.3	Q387 F395	Q387-P393 VanDerWaalsContact CD-CB 3.45Å; Q387-P393 HydrophobicContact CG-CB 4.12Å; P393-F395 VanDerWaalsContact CB-O 3.23Å; P393-F395 WeakPolarHBondContact CB-O 2.92Å
394	L	66.4	Low	74.1	Confident	135 Å²	135	58 Å²	58	71%	0.707	35%	0.35	S	S	*	.	S	Bend	trans	-67.5	-27.2	163	-90.6	144	0	0	0	111.4	D383 L392	D383-L394 WeakPolarHBondContact OD1-CB 3.4Å; D383-L394 PolarHBondContact OD1-N 2.77Å; D383-L394 PolarHBondContact OD2-N 2.74Å; D383-L394 VanDerWaalsContact OD2-N 3.12Å; L392-L394 PolarHBondContact O-N 3.35Å
395	F	65.6	Low	73.6	Confident	41 Å²	41	62 Å²	62	18%	0.18	38%	0.376	C	S	.	.	S	Bend	trans	-133.7	140.4	-176	-51.8	-57.1	0	0	0	110.9	K375 I379 D383 P393 L397	K375-F395 HydrophobicContact CD-CB 4.23Å; K375-F395 HydrophobicContact CD-CD1 4.03Å; K375-F395 HydrophobicContact CD-CD2 4.37Å; K375-F395 HydrophobicContact CD-CE1 4.43Å; K375-F395 HydrophobicContact CD-CG 3.93Å; K375-F395 HydrophobicContact CG-CD1 4.06Å; K375-F395 HydrophobicContact CG-CD2 4.2Å; K375-F395 HydrophobicContact CG-CE1 3.97Å; K375-F395 HydrophobicContact CG-CE2 4.17Å; K375-F395 HydrophobicContact CG-CG 4.12Å; K375-F395 HydrophobicContact CG-CZ 4.02Å; I379-F395 HydrophobicContact CG2-CE2 3.9Å; I379-F395 HydrophobicContact CG2-CZ 4.4Å; D383-F395 HydrophobicContact CB-CD2 4.35Å; D383-F395 WeakPolarHBondContact OD2-CD2 3.28Å; D383-F395 PolarHBondContact OD2-N 3.13Å; D383-F395 VanDerWaalsContact OD2-N 3.17Å; P393-F395 VanDerWaalsContact CB-O 3.23Å; P393-F395 WeakPolarHBondContact CB-O 2.92Å; F395-L397 PolarHBondContact O-N 3.18Å
396	D	66.2	Low	72.8	Confident	135 Å²	135	63.7 Å²	63.7	72%	0.722	39%	0.39	S	S	*	.			trans	-48.7	136.1	164	-60.4	-39	0	0	0	108.8	P398	D396-P398 WeakPolarHBondContact O-CD 3.46Å
397	L	65.8	Low	72.4	Confident	63 Å²	63	69.6 Å²	69.6	33%	0.33	41%	0.413	S	S	.	.			trans	-92.9	87.6	177.8	-74.1	170.3	0	0	0	110.1	I384 F395 F401 I403	I384-L397 HydrophobicContact CD1-CD2 4.14Å; I384-L397 HydrophobicContact CG1-CD2 3.62Å; F395-L397 PolarHBondContact O-N 3.18Å; L397-F401 HydrophobicContact CB-CD2 4.21Å; L397-F401 HydrophobicContact CD2-CB 3.91Å; L397-F401 HydrophobicContact CD2-CD2 3.63Å; L397-F401 HydrophobicContact CD2-CE2 4.29Å; L397-F401 HydrophobicContact CD2-CG 3.82Å; L397-I403 HydrophobicContact CD1-CD1 3.6Å; L397-I403 HydrophobicContact CD1-CG1 4.32Å
398	P	57.7	Low	72.4	Confident	31 Å²	31	70.1 Å²	70.1	20%	0.201	42%	0.42	C	S	.	.			trans	-62.6	164.7	171.5	24.7	-38	0	0	0	112.9	M368 D396 G400 F401	M368-P398 HydrophobicContact CB-CG 3.57Å; M368-P398 HydrophobicContact CG-CG 3.74Å; M368-P398 VanDerWaalsContact O-CG 3.31Å; M368-P398 WeakPolarHBondContact O-CG 3.44Å; D396-P398 WeakPolarHBondContact O-CD 3.46Å; P398-G400 PolarHBondContact O-N 2.88Å; P398-F401 VanDerWaalsContact CD-CE2 3.47Å; P398-F401 HydrophobicContact CG-CD2 3.93Å; P398-F401 HydrophobicContact CG-CE2 3.48Å; P398-F401 VanDerWaalsContact CG-CE2 3.48Å; P398-F401 VanDerWaalsContact O-CD2 3.28Å; P398-F401 WeakPolarHBondContact O-CD2 3.4Å
399	P	57.6	Low	72.5	Confident	127 Å²	127	69.5 Å²	69.5	83%	0.825	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	135.4	177.7	-7.2	6.9	0	0	0	112	M368	M368-P399 WeakPolarHBondContact CE-O 3.23Å
400	G	57.8	Low	72.5	Confident	21 Å²	21	70.3 Å²	70.3	22%	0.216	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.1	-12.7	178	0	0	0	0	0	114.6	P398	P398-G400 PolarHBondContact O-N 2.88Å
401	F	68.2	Low	72.6	Confident	38 Å²	38	71.4 Å²	71.4	17%	0.167	42%	0.418	C	S	.	.			trans	-80	141.4	167.7	-67.8	-58	0	0	0	110.1	A363 M368 A380 I384 L397 P398	A363-F401 WeakPolarHBondContact O-CA 3.41Å; A363-F401 WeakPolarHBondContact O-CD1 3.28Å; M368-F401 HydrophobicContact CB-CE2 3.78Å; M368-F401 HydrophobicContact CB-CZ 3.66Å; M368-F401 HydrophobicContact CE-CB 4.07Å; M368-F401 HydrophobicContact CE-CD1 3.33Å; M368-F401 HydrophobicContact CE-CD2 3.27Å; M368-F401 HydrophobicContact CE-CE1 3.46Å; M368-F401 VanDerWaalsContact CE-CE1 3.46Å; M368-F401 HydrophobicContact CE-CE2 3.4Å; M368-F401 HydrophobicContact CE-CG 3.25Å; M368-F401 HydrophobicContact CE-CZ 3.52Å; M368-F401 HydrophobicContact CG-CE1 4.45Å; M368-F401 HydrophobicContact CG-CE2 3.81Å; M368-F401 HydrophobicContact CG-CZ 3.78Å; M368-F401 HydrophobicContact SD-CD1 3.73Å; M368-F401 HydrophobicContact SD-CD2 4.01Å; M368-F401 HydrophobicContact SD-CE1 3.16Å; M368-F401 WeakPolarHBondContact SD-CE1 3.42Å; M368-F401 HydrophobicContact SD-CE2 3.47Å; M368-F401 WeakPolarHBondContact SD-CE2 3.28Å; M368-F401 HydrophobicContact SD-CG 4.14Å; M368-F401 HydrophobicContact SD-CZ 3.03Å; M368-F401 WeakPolarHBondContact SD-CZ 3.46Å; A380-F401 HydrophobicContact CB-CE1 3.61Å; A380-F401 HydrophobicContact CB-CZ 3.74Å; I384-F401 HydrophobicContact CD1-CB 3.87Å; I384-F401 HydrophobicContact CD1-CD1 3.44Å; I384-F401 VanDerWaalsContact CD1-CD1 3.44Å; I384-F401 HydrophobicContact CD1-CE1 4.18Å; I384-F401 HydrophobicContact CD1-CG 3.85Å; L397-F401 HydrophobicContact CB-CD2 4.21Å; L397-F401 HydrophobicContact CD2-CB 3.91Å; L397-F401 HydrophobicContact CD2-CD2 3.63Å; L397-F401 HydrophobicContact CD2-CE2 4.29Å; L397-F401 HydrophobicContact CD2-CG 3.82Å; P398-F401 VanDerWaalsContact CD-CE2 3.47Å; P398-F401 HydrophobicContact CG-CD2 3.93Å; P398-F401 HydrophobicContact CG-CE2 3.48Å; P398-F401 VanDerWaalsContact CG-CE2 3.48Å; P398-F401 VanDerWaalsContact O-CD2 3.28Å; P398-F401 WeakPolarHBondContact O-CD2 3.4Å
402	S	71.2	Confident	72.8	Confident	62 Å²	62	76.2 Å²	76.2	43%	0.434	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.3	172.2	-177.1	0	0	0	0	108.9	A362 A363	A362-S402 WeakPolarHBondContact CA-O 3.47Å; A363-S402 PolarHBondContact N-O 3.11Å; A363-S402 PolarHBondContact O-N 3.27Å
403	I	75.1	Confident	73.3	Confident	64 Å²	64	72.6 Å²	72.6	33%	0.328	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.3	167.9	-40.7	-170.6	0	0	0	106.1	I384 F388 L397	I384-I403 HydrophobicContact CG2-CB 4.13Å; I384-I403 HydrophobicContact CG2-CG1 3.8Å; I384-I403 HydrophobicContact CG2-CG2 4.06Å; F388-I403 HydrophobicContact CB-CG2 4.33Å; L397-I403 HydrophobicContact CD1-CD1 3.6Å; L397-I403 HydrophobicContact CD1-CG1 4.32Å
404	A	78.9	Confident	73.8	Confident	8 Å²	8	73.1 Å²	73.1	7%	0.066	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-58.9	131.8	165.6	0	0	0	0	0	109.5	V359 V360 L361 F388	V359-A404 HydrophobicContact CG1-CB 3.72Å; V360-A404 WeakPolarHBondContact O-CB 3.4Å; L361-A404 HydrophobicContact CD2-CB 4.31Å; L361-A404 PolarHBondContact O-N 2.91Å; F388-A404 HydrophobicContact CD2-CB 4.35Å; F388-A404 WeakPolarHBondContact CD2-O 3.39Å; F388-A404 HydrophobicContact CE2-CB 4.16Å
405	P	77.3	Confident	74.6	Confident	84 Å²	84	76 Å²	76	55%	0.545	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-57.2	143.6	171.7	21.7	-29	0	0	0	109.5	E407 S408	P405-E407 WeakPolarHBondContact CB-OE2 3.49Å; P405-E407 PolarHBondContact O-N 2.61Å; P405-S408 WeakPolarHBondContact O-CB 3.46Å; P405-S408 PolarHBondContact O-N 2.65Å; P405-S408 PolarHBondContact O-OG 3.17Å
406	A	72.9	Confident	75.4	Confident	36 Å²	36	81.6 Å²	81.6	30%	0.298	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-61	-22.2	-174.2	0	0	0	0	0	112.6	S408 R414	A406-S408 VanDerWaalsContact C-N 3.31Å; A406-R414 PolarHBondContact O-NE 3.05Å; A406-R414 VanDerWaalsContact O-NE 3.08Å
407	E	79.9	Confident	76.4	Confident	155 Å²	155	76.8 Å²	76.8	72%	0.724	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-78.1	-13.9	178.1	-53.7	72.3	-150.6	0	0	113	P405 L409	P405-E407 WeakPolarHBondContact CB-OE2 3.49Å; P405-E407 PolarHBondContact O-N 2.61Å; E407-L409 PolarHBondContact O-N 3.3Å; E407-L409 VanDerWaalsContact O-N 3.14Å
408	S	84.3	Confident	77.4	Confident	43 Å²	43	80 Å²	80	30%	0.301	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-62.4	-19.9	178.8	61.2	0	0	0	0	113.5	P405 A406	P405-S408 WeakPolarHBondContact O-CB 3.46Å; P405-S408 PolarHBondContact O-N 2.65Å; P405-S408 PolarHBondContact O-OG 3.17Å; A406-S408 VanDerWaalsContact C-N 3.31Å
409	L	86.6	Confident	78.9	Confident	4 Å²	4	81.7 Å²	81.7	2%	0.021	42%	0.417	C	S	.	.	S	Bend	trans	-130.5	134.1	179.7	-68.6	173.7	0	0	0	111.4	E354 S357 V359 L361 F388 E407 L411 R414 F417	E354-L409 HydrophobicContact CB-CD1 4.35Å; E354-L409 HydrophobicContact CG-CD1 4.48Å; S357-L409 WeakPolarHBondContact OG-CD2 3.47Å; V359-L409 HydrophobicContact CB-CD1 4.4Å; V359-L409 HydrophobicContact CB-CD2 4.16Å; V359-L409 HydrophobicContact CB-CG 4.31Å; V359-L409 HydrophobicContact CG1-CD1 4.39Å; V359-L409 HydrophobicContact CG1-CG 4.36Å; V359-L409 HydrophobicContact CG2-CD2 3.74Å; V359-L409 HydrophobicContact CG2-CG 4.14Å; L361-L409 HydrophobicContact CD2-CD1 3.88Å; F388-L409 HydrophobicContact CZ-CD1 4.04Å; E407-L409 PolarHBondContact O-N 3.3Å; E407-L409 VanDerWaalsContact O-N 3.14Å; L409-L411 PolarHBondContact O-N 2.83Å; L409-R414 HydrophobicContact CB-CG 3.87Å; L409-R414 PolarHBondContact O-NE 3.47Å; L409-F417 HydrophobicContact CD1-CE2 3.68Å; L409-F417 HydrophobicContact CD1-CZ 4Å
410	P	85.6	Confident	80.6	Confident	88 Å²	88	75.8 Å²	75.8	57%	0.571	38%	0.379	S	S	*	.			trans	-53.4	140.2	176.5	-25.3	32.9	0	0	0	112	E412 R413 R414	P410-E412 VanDerWaalsContact C-N 3.26Å; P410-E412 PolarHBondContact O-N 2.62Å; P410-R413 HydrophobicContact CB-CB 4.46Å; P410-R413 WeakPolarHBondContact O-CA 3.39Å; P410-R413 VanDerWaalsContact O-CB 3.29Å; P410-R413 WeakPolarHBondContact O-CB 3.48Å; P410-R413 PolarHBondContact O-N 2.89Å; P410-R414 PolarHBondContact O-N 2.97Å; P410-R414 VanDerWaalsContact O-N 3.08Å
411	L	83.2	Confident	82.3	Confident	92 Å²	92	77.7 Å²	77.7	48%	0.482	39%	0.386	S	S	.	.	H	α-helix	trans	-55.7	-41.4	-177	-172.7	73.3	0	0	0	112.2	L409 R413 R414 R415	L409-L411 PolarHBondContact O-N 2.83Å; L411-R413 PolarHBondContact O-N 2.99Å; L411-R414 PolarHBondContact O-N 3.13Å; L411-R414 VanDerWaalsContact O-N 3.16Å; L411-R415 WeakPolarHBondContact O-CG 3.32Å; L411-R415 PolarHBondContact O-N 3.25Å
412	E	83.5	Confident	83.5	Confident	152 Å²	152	77.3 Å²	77.3	71%	0.71	39%	0.393	S	S	*	.	H	α-helix	trans	-57.1	-38.2	176.7	-64.9	-174.9	169.7	0	0	112.1	P410 H416	P410-E412 VanDerWaalsContact C-N 3.26Å; P410-E412 PolarHBondContact O-N 2.62Å; E412-H416 PolarHBondContact O-CE1 3.48Å; E412-H416 PolarHBondContact O-ND1 3.45Å
413	R	84.7	Confident	84.7	Confident	84 Å²	84	74.4 Å²	74.4	32%	0.317	37%	0.373	S	S	.	.	H	α-helix	trans	-71	-43.7	177.8	-160	-178.8	-166.4	94	2.8	111.3	E354 P410 L411 R415 H416 F417	E354-R413 IonicContact OE1-CZ 3.54Å; E354-R413 VanDerWaalsContact OE1-CZ 3.29Å; E354-R413 IonicContact OE1-NE 2.64Å; E354-R413 PolarHBondContact OE1-NE 3.03Å; E354-R413 IonicContact OE1-NH2 3.52Å; E354-R413 PolarHBondContact OE1-NH2 3.49Å; P410-R413 HydrophobicContact CB-CB 4.46Å; P410-R413 WeakPolarHBondContact O-CA 3.39Å; P410-R413 VanDerWaalsContact O-CB 3.29Å; P410-R413 WeakPolarHBondContact O-CB 3.48Å; P410-R413 PolarHBondContact O-N 2.89Å; L411-R413 PolarHBondContact O-N 2.99Å; R413-R415 VanDerWaalsContact C-N 3.3Å; R413-R415 PolarHBondContact O-N 3.34Å; R413-H416 PolarHBondContact O-N 3.36Å; R413-F417 HydrophobicContact CG-CE1 4.06Å; R413-F417 HydrophobicContact CG-CZ 3.88Å; R413-F417 WeakPolarHBondContact O-CE1 3.35Å
414	R	82	Confident	85.8	Confident	73 Å²	73	71.4 Å²	71.4	28%	0.275	36%	0.357	S	S	.	.	H	α-helix	trans	-62	-35	179	-67.9	-167.3	-71.1	131.3	-9.5	112.9	F388 A406 L409 P410 L411 H416 F417	F388-R414 HydrophobicContact CE1-CG 4.27Å; F388-R414 HydrophobicContact CZ-CG 4.17Å; A406-R414 PolarHBondContact O-NE 3.05Å; A406-R414 VanDerWaalsContact O-NE 3.08Å; L409-R414 HydrophobicContact CB-CG 3.87Å; L409-R414 PolarHBondContact O-NE 3.47Å; P410-R414 PolarHBondContact O-N 2.97Å; P410-R414 VanDerWaalsContact O-N 3.08Å; L411-R414 PolarHBondContact O-N 3.13Å; L411-R414 VanDerWaalsContact O-N 3.16Å; R414-H416 PolarHBondContact O-N 3.43Å; R414-H416 VanDerWaalsContact O-N 3.15Å; R414-F417 HydrophobicContact CB-CD2 4.39Å; R414-F417 HydrophobicContact CG-CD2 4.36Å; R414-F417 HydrophobicContact CG-CE2 4.13Å; R414-F417 WeakPolarHBondContact O-CB 3.46Å; R414-F417 PolarHBondContact O-N 2.68Å
415	R	81.8	Confident	86.7	Confident	194 Å²	194	71 Å²	71	73%	0.732	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.3	177.5	-76	179.9	179.9	-172.6	0.6	114.2	L411 R413	L411-R415 WeakPolarHBondContact O-CG 3.32Å; L411-R415 PolarHBondContact O-N 3.25Å; R413-R415 VanDerWaalsContact C-N 3.3Å; R413-R415 PolarHBondContact O-N 3.34Å
416	H	82.4	Confident	87.7	Confident	159 Å²	159	67.3 Å²	67.3	74%	0.736	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.1	179.2	-64.3	92.2	0	0	0	113.1	E412 R413 R414	E412-H416 PolarHBondContact O-CE1 3.48Å; E412-H416 PolarHBondContact O-ND1 3.45Å; R413-H416 PolarHBondContact O-N 3.36Å; R414-H416 PolarHBondContact O-N 3.43Å; R414-H416 VanDerWaalsContact O-N 3.15Å
417	F	87.3	Confident	88.9	Confident	34 Å²	34	65.7 Å²	65.7	15%	0.149	32%	0.315	C	S	.	.			trans	-79.6	136.2	-178.8	-60.8	-20.5	0	0	0	111.1	E354 F388 H389 L409 R413 R414 F423	E354-F417 HydrophobicContact CG-CE1 4.27Å; E354-F417 HydrophobicContact CG-CZ 3.8Å; F388-F417 HydrophobicContact CE1-CD2 4.17Å; F388-F417 HydrophobicContact CE1-CE2 4.26Å; H389-F417 VanDerWaalsContact CE1-CB 3.46Å; H389-F417 WeakPolarHBondContact CE1-CB 3.49Å; L409-F417 HydrophobicContact CD1-CE2 3.68Å; L409-F417 HydrophobicContact CD1-CZ 4Å; R413-F417 HydrophobicContact CG-CE1 4.06Å; R413-F417 HydrophobicContact CG-CZ 3.88Å; R413-F417 WeakPolarHBondContact O-CE1 3.35Å; R414-F417 HydrophobicContact CB-CD2 4.39Å; R414-F417 HydrophobicContact CG-CD2 4.36Å; R414-F417 HydrophobicContact CG-CE2 4.13Å; R414-F417 WeakPolarHBondContact O-CB 3.46Å; R414-F417 PolarHBondContact O-N 2.68Å; F417-F423 HydrophobicContact CB-CZ 4.15Å; F417-F423 AromaticContact CD1-CE1 3.98Å; F417-F423 HydrophobicContact CD1-CE1 3.98Å; F417-F423 AromaticContact CD1-CZ 3.98Å; F417-F423 HydrophobicContact CD1-CZ 3.98Å; F417-F423 HydrophobicContact CD2-CE1 4.25Å; F417-F423 AromaticContact CD2-CZ 3.7Å; F417-F423 HydrophobicContact CD2-CZ 3.7Å; F417-F423 AromaticContact CE1-CE1 3.91Å; F417-F423 HydrophobicContact CE1-CE1 3.91Å; F417-F423 HydrophobicContact CE1-CZ 4.27Å; F417-F423 HydrophobicContact CE2-CE1 4.18Å; F417-F423 AromaticContact CE2-CZ 4Å; F417-F423 HydrophobicContact CE2-CZ 4Å; F417-F423 HydrophobicContact CG-CE1 4.16Å; F417-F423 AromaticContact CG-CZ 3.69Å; F417-F423 HydrophobicContact CG-CZ 3.69Å; F417-F423 HydrophobicContact CZ-CE1 4.01Å; F417-F423 HydrophobicContact CZ-CZ 4.28Å
418	Y	87.2	Confident	89.7	Confident	130 Å²	130	58.3 Å²	58.3	51%	0.51	28%	0.281	S	S	.	.			trans	-138.4	116.1	175.3	175.1	-97.8	0	0	0	108.5	C420 T421	Y418-C420 PolarHBondContact O-N 3.23Å; Y418-T421 WeakPolarHBondContact O-CB 3.45Å; Y418-T421 PolarHBondContact O-N 3.17Å; Y418-T421 PolarHBondContact O-OG1 2.85Å
419	L	90.1	Very high	90.1	Very high	68 Å²	68	58.1 Å²	58.1	36%	0.356	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	-126.3	-173.8	-55.6	174.9	0	0	0	110.6	H389 H441 S442	H389-L419 PolarHBondContact NE2-O 3.39Å; L419-H441 WeakPolarHBondContact CD1-O 3.11Å; L419-S442 VanDerWaalsContact CB-O 3.23Å; L419-S442 WeakPolarHBondContact CB-O 3.27Å
420	C	93	Very high	90.5	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.014	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	21.5	174.6	-60.3	0	0	0	0	112.9	Y418 G422 F423 S442 I444	Y418-C420 PolarHBondContact O-N 3.23Å; C420-G422 PolarHBondContact O-N 3.12Å; C420-F423 HydrophobicContact CB-CD2 4.08Å; C420-F423 PolarHBondContact O-N 2.94Å; C420-F423 VanDerWaalsContact O-N 3.09Å; C420-S442 WeakPolarHBondContact CA-O 3.26Å; C420-S442 WeakPolarHBondContact CB-O 3.3Å; C420-S442 PolarHBondContact N-O 2.9Å; C420-I444 HydrophobicContact CB-CB 4.47Å; C420-I444 HydrophobicContact CB-CD1 3.68Å
421	T	93.5	Very high	91	Very high	61 Å²	61	53.9 Å²	53.9	37%	0.374	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	123.8	-177.9	-52.7	0	0	0	0	110.5	Y418 F423 R443	Y418-T421 WeakPolarHBondContact O-CB 3.45Å; Y418-T421 PolarHBondContact O-N 3.17Å; Y418-T421 PolarHBondContact O-OG1 2.85Å; T421-F423 VanDerWaalsContact C-N 3.34Å; T421-R443 WeakPolarHBondContact CA-O 3.38Å
422	G	93.7	Very high	91.3	Very high	30 Å²	30	50.4 Å²	50.4	31%	0.309	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-4.2	-179.3	0	0	0	0	0	115	P355 C420	P355-G422 WeakPolarHBondContact CD-O 3.46Å; P355-G422 VanDerWaalsContact CG-O 3.23Å; P355-G422 WeakPolarHBondContact CG-O 3.31Å; C420-G422 PolarHBondContact O-N 3.12Å
423	F	96.3	Very high	91.5	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	22%	0.217	C	C	.	.			trans	-95.1	150.1	-179.4	-52.9	-24.7	0	0	0	112.5	I352 V353 E354 L361 V385 F417 C420 T421 I444 R445	I352-F423 HydrophobicContact CG2-CB 3.74Å; I352-F423 HydrophobicContact CG2-CD2 4.11Å; I352-F423 HydrophobicContact CG2-CG 4.29Å; V353-F423 WeakPolarHBondContact O-CA 3.29Å; V353-F423 WeakPolarHBondContact O-CB 3.43Å; E354-F423 HydrophobicContact CB-CD1 4.08Å; E354-F423 HydrophobicContact CB-CE1 4.09Å; E354-F423 HydrophobicContact CG-CD1 3.91Å; E354-F423 HydrophobicContact CG-CE1 3.67Å; L361-F423 HydrophobicContact CD1-CD1 3.93Å; L361-F423 HydrophobicContact CD1-CD2 3.48Å; L361-F423 VanDerWaalsContact CD1-CD2 3.48Å; L361-F423 HydrophobicContact CD1-CE1 3.78Å; L361-F423 HydrophobicContact CD1-CE2 3.32Å; L361-F423 HydrophobicContact CD1-CG 3.81Å; L361-F423 HydrophobicContact CD1-CZ 3.49Å; L361-F423 VanDerWaalsContact CD1-CZ 3.49Å; V385-F423 HydrophobicContact CG1-CD2 4.26Å; V385-F423 HydrophobicContact CG1-CE2 3.95Å; F417-F423 HydrophobicContact CB-CZ 4.15Å; F417-F423 AromaticContact CD1-CE1 3.98Å; F417-F423 HydrophobicContact CD1-CE1 3.98Å; F417-F423 AromaticContact CD1-CZ 3.98Å; F417-F423 HydrophobicContact CD1-CZ 3.98Å; F417-F423 HydrophobicContact CD2-CE1 4.25Å; F417-F423 AromaticContact CD2-CZ 3.7Å; F417-F423 HydrophobicContact CD2-CZ 3.7Å; F417-F423 AromaticContact CE1-CE1 3.91Å; F417-F423 HydrophobicContact CE1-CE1 3.91Å; F417-F423 HydrophobicContact CE1-CZ 4.27Å; F417-F423 HydrophobicContact CE2-CE1 4.18Å; F417-F423 AromaticContact CE2-CZ 4Å; F417-F423 HydrophobicContact CE2-CZ 4Å; F417-F423 HydrophobicContact CG-CE1 4.16Å; F417-F423 AromaticContact CG-CZ 3.69Å; F417-F423 HydrophobicContact CG-CZ 3.69Å; F417-F423 HydrophobicContact CZ-CE1 4.01Å; F417-F423 HydrophobicContact CZ-CZ 4.28Å; C420-F423 HydrophobicContact CB-CD2 4.08Å; C420-F423 PolarHBondContact O-N 2.94Å; C420-F423 VanDerWaalsContact O-N 3.09Å; T421-F423 VanDerWaalsContact C-N 3.34Å; F423-I444 HydrophobicContact CB-CD1 4.14Å; F423-I444 WeakPolarHBondContact O-CD1 3.32Å; F423-R445 WeakPolarHBondContact O-CB 3.4Å; F423-R445 PolarHBondContact O-N 3.21Å
424	D	98	Very high	91.7	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.9	174.3	-73.6	-3	0	0	0	110	I352 V353 Y426 R445 R446 F448	I352-D424 WeakPolarHBondContact CA-O 3.48Å; V353-D424 PolarHBondContact N-O 2.95Å; V353-D424 PolarHBondContact O-N 3.01Å; D424-Y426 HydrophobicContact CB-CE2 3.86Å; D424-R445 IonicContact OD1-CZ 3.51Å; D424-R445 VanDerWaalsContact OD1-CZ 3.23Å; D424-R445 IonicContact OD1-NE 3.99Å; D424-R445 PolarHBondContact OD1-NE 2.84Å; D424-R445 IonicContact OD1-NH2 3.07Å; D424-R445 PolarHBondContact OD1-NH2 2.88Å; D424-R445 IonicContact OD2-CZ 3.23Å; D424-R445 IonicContact OD2-NE 3.28Å; D424-R445 IonicContact OD2-NH2 3.46Å; D424-R445 PolarHBondContact OD2-NH2 3.28Å; D424-R446 WeakPolarHBondContact OD1-CB 3.48Å; D424-R446 IonicContact OD1-NE 3.52Å; D424-R446 PolarHBondContact OD1-NE 3.17Å; D424-R446 IonicContact OD2-CZ 3.49Å; D424-R446 IonicContact OD2-NE 2.85Å; D424-R446 PolarHBondContact OD2-NE 2.8Å; D424-R446 IonicContact OD2-NH2 2.96Å; D424-R446 PolarHBondContact OD2-NH2 3.18Å; D424-F448 HydrophobicContact CB-CD2 4.49Å; D424-F448 HydrophobicContact CB-CE2 4.05Å
425	C	98.3	Very high	92.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.8	178.3	177.6	0	0	0	0	110.2	C350 V351 I352 L439 I444 R446 V447 F448	C350-C425 VanDerWaalsContact SG-SG 3.61Å; V351-C425 CarbonylContact O-C 3.59Å; V351-C425 WeakPolarHBondContact O-CA 3.37Å; I352-C425 HydrophobicContact CG1-CB 4.31Å; C425-L439 HydrophobicContact CB-CD2 4.18Å; C425-I444 HydrophobicContact CB-CD1 3.9Å; C425-I444 HydrophobicContact CB-CG1 3.91Å; C425-R446 PolarHBondContact N-O 3.02Å; C425-V447 HydrophobicContact CB-CG1 4.36Å; C425-V447 HydrophobicContact CB-CG2 4.22Å; C425-V447 CarbonylContact O-C 3.57Å; C425-V447 WeakPolarHBondContact O-CA 3.4Å; C425-F448 PolarHBondContact O-N 3.28Å
426	Y	98.3	Very high	92.7	Very high	7 Å²	7	33 Å²	33	3%	0.027	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.5	177.3	-60.6	-96.2	0	0	0	108.7	I327 Y330 M331 C350 V351 V353 D424 F448	I327-Y426 HydrophobicContact CB-CE1 4.16Å; I327-Y426 HydrophobicContact CG1-CE1 4.05Å; I327-Y426 HydrophobicContact CG2-CE1 4.07Å; Y330-Y426 HydrophobicContact CD2-CE1 4.45Å; Y330-Y426 AromaticContact CD2-CE2 3.85Å; Y330-Y426 HydrophobicContact CD2-CE2 3.85Å; Y330-Y426 AromaticContact CD2-CZ 3.72Å; Y330-Y426 HydrophobicContact CG-CD2 4.38Å; Y330-Y426 AromaticContact CG-CE2 3.99Å; Y330-Y426 HydrophobicContact CG-CE2 3.99Å; M331-Y426 HydrophobicContact CE-CD1 4.46Å; C350-Y426 CarbonylContact C-O 3.5Å; C350-Y426 VanDerWaalsContact CA-O 3.26Å; C350-Y426 WeakPolarHBondContact CA-O 3.37Å; V351-Y426 PolarHBondContact N-O 3.48Å; V351-Y426 PolarHBondContact O-N 3.2Å; V353-Y426 HydrophobicContact CB-CE2 4.3Å; V353-Y426 HydrophobicContact CG2-CD2 4.01Å; V353-Y426 HydrophobicContact CG2-CE2 3.89Å; D424-Y426 HydrophobicContact CB-CE2 3.86Å; Y426-F448 CarbonylContact C-O 3.58Å; Y426-F448 WeakPolarHBondContact CA-O 3.49Å; Y426-F448 HydrophobicContact CD1-CB 3.66Å; Y426-F448 AromaticContact CD1-CD2 3.96Å; Y426-F448 HydrophobicContact CD1-CD2 3.96Å; Y426-F448 AromaticContact CD1-CG 3.98Å; Y426-F448 HydrophobicContact CD1-CG 3.98Å; Y426-F448 HydrophobicContact CE1-CB 3.95Å; Y426-F448 HydrophobicContact CE1-CD1 4.48Å; Y426-F448 AromaticContact CE1-CD2 3.52Å; Y426-F448 HydrophobicContact CE1-CD2 3.52Å; Y426-F448 HydrophobicContact CE1-CE2 4.13Å; Y426-F448 AromaticContact CE1-CG 3.74Å; Y426-F448 HydrophobicContact CE1-CG 3.74Å; Y426-F448 HydrophobicContact CE2-CD2 4.4Å; Y426-F448 HydrophobicContact CG-CB 4.42Å; Y426-F448 AromaticContact CZ-CD2 3.77Å
427	V	97.2	Very high	93	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.5	-176.3	62.7	0	0	0	0	111	V348 G349 C350 V378 R429 P431 V447 F448 Y449 G450	V348-V427 HydrophobicContact CG1-CG2 4.05Å; G349-V427 WeakPolarHBondContact O-CA 3.43Å; C350-V427 HydrophobicContact CB-CG2 4.36Å; V378-V427 HydrophobicContact CG2-CB 4.48Å; V378-V427 HydrophobicContact CG2-CG2 3.88Å; V427-R429 WeakPolarHBondContact CG1-O 2.87Å; V427-R429 VanDerWaalsContact CG2-O 3.3Å; V427-R429 WeakPolarHBondContact CG2-O 3.32Å; V427-R429 PolarHBondContact O-N 3.38Å; V427-P431 HydrophobicContact CG1-CG 3.85Å; V427-V447 HydrophobicContact CG1-CG1 4.2Å; V427-F448 PolarHBondContact N-O 3.38Å; V427-Y449 WeakPolarHBondContact O-CA 3.48Å; V427-Y449 WeakPolarHBondContact O-CB 3.4Å; V427-G450 PolarHBondContact O-N 3.19Å; V427-G450 VanDerWaalsContact O-N 3.11Å
428	T	96.2	Very high	93.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-16.5	-174.2	59.7	0	0	0	0	113.6	A334 I335 A338 V348 G349 H451 C485 L488	A334-T428 HydrophobicContact CB-CG2 4Å; I335-T428 HydrophobicContact CB-CG2 4.48Å; I335-T428 HydrophobicContact CG1-CG2 3.87Å; A338-T428 HydrophobicContact CB-CG2 4.14Å; V348-T428 WeakPolarHBondContact CA-OG1 3.42Å; G349-T428 PolarHBondContact N-OG1 3.14Å; G349-T428 VanDerWaalsContact N-OG1 3.11Å; G349-T428 PolarHBondContact O-N 3.1Å; T428-H451 PolarHBondContact O-N 3.17Å; T428-H451 PolarHBondContact O-ND1 3.23Å; T428-C485 WeakPolarHBondContact O-CB 3.49Å; T428-L488 HydrophobicContact CG2-CD1 3.85Å
429	R	94	Very high	93.5	Very high	39 Å²	39	21.3 Å²	21.3	15%	0.147	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	144.4	-174.8	-170.6	-176.2	87.3	160.5	-9.8	110.7	E346 V348 V427 P431 T453	E346-R429 VanDerWaalsContact OE1-CD 3.32Å; E346-R429 WeakPolarHBondContact OE1-CD 3.43Å; E346-R429 IonicContact OE1-CZ 2.82Å; E346-R429 IonicContact OE1-NE 2.92Å; E346-R429 IonicContact OE1-NH1 2.7Å; E346-R429 PolarHBondContact OE1-NH1 3.49Å; E346-R429 IonicContact OE2-CZ 3.61Å; E346-R429 IonicContact OE2-NH1 3.27Å; E346-R429 PolarHBondContact OE2-NH1 2.91Å; E346-R429 IonicContact OE2-NH2 3.62Å; V348-R429 HydrophobicContact CG1-CB 4.09Å; V348-R429 HydrophobicContact CG2-CB 4.14Å; V427-R429 WeakPolarHBondContact CG1-O 2.87Å; V427-R429 VanDerWaalsContact CG2-O 3.3Å; V427-R429 WeakPolarHBondContact CG2-O 3.32Å; V427-R429 PolarHBondContact O-N 3.38Å; R429-P431 WeakPolarHBondContact O-CD 3.49Å; R429-T453 VanDerWaalsContact CD-CG2 3.41Å; R429-T453 HydrophobicContact CG-CG2 3.16Å
430	E	95.4	Very high	93.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-52	125.3	172.7	-167.5	-177.3	172.9	0	0	111.4	Y449 H451 T453 G456 A457 F458 G459 S460	E430-Y449 HydrophobicContact CB-CD2 3.83Å; E430-Y449 HydrophobicContact CB-CE2 3.72Å; E430-Y449 HydrophobicContact CB-CG 4.39Å; E430-Y449 HydrophobicContact CG-CD2 4.36Å; E430-Y449 HydrophobicContact CG-CE1 4.24Å; E430-Y449 HydrophobicContact CG-CE2 3.99Å; E430-H451 PolarHBondContact N-O 3.1Å; E430-T453 PolarHBondContact OE2-N 3.3Å; E430-G456 WeakPolarHBondContact OE1-CA 3.49Å; E430-A457 PolarHBondContact OE1-N 3.33Å; E430-F458 HydrophobicContact CG-CB 4.4Å; E430-F458 PolarHBondContact OE1-N 3.43Å; E430-G459 PolarHBondContact OE1-N 3.41Å; E430-S460 PolarHBondContact OE1-N 3.43Å; E430-S460 VanDerWaalsContact OE1-N 3.16Å; E430-S460 WeakPolarHBondContact OE2-CB 3.36Å; E430-S460 PolarHBondContact OE2-OG 2.85Å
431	P	94.2	Very high	93.3	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.026	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-60.9	140	177.7	-31.5	41.5	0	0	0	113.4	V378 V427 R429 C435 A436 L439 A457 F458	V378-P431 HydrophobicContact CG2-CG 4.34Å; V427-P431 HydrophobicContact CG1-CG 3.85Å; R429-P431 WeakPolarHBondContact O-CD 3.49Å; P431-C435 HydrophobicContact CB-CB 3.71Å; P431-A436 HydrophobicContact CB-CB 4.49Å; P431-L439 HydrophobicContact CG-CD1 4.35Å; P431-A457 PolarHBondContact O-N 3.26Å; P431-F458 HydrophobicContact CB-CD2 4.48Å; P431-F458 HydrophobicContact CB-CE2 4Å; P431-F458 HydrophobicContact CB-CZ 4.43Å; P431-F458 HydrophobicContact CG-CD2 4.09Å; P431-F458 HydrophobicContact CG-CE2 3.56Å; P431-F458 HydrophobicContact CG-CZ 4.35Å
432	C	90.7	Very high	93.2	Very high	19 Å²	19	20.4 Å²	20.4	13%	0.128	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-70.5	168.8	169.3	74.6	0	0	0	0	111.2	H376 M434 C435 A436	H376-C432 VanDerWaalsContact CE1-SG 3.54Å; H376-C432 PolarHBondContact ND1-SG 2.73Å; H376-C432 VanDerWaalsContact ND1-SG 3.43Å; C432-M434 VanDerWaalsContact C-N 3.28Å; C432-M434 PolarHBondContact O-N 3.38Å; C432-M434 VanDerWaalsContact O-N 3.17Å; C432-C435 PolarHBondContact O-N 3.43Å; C432-C435 VanDerWaalsContact SG-SG 3.65Å; C432-A436 PolarHBondContact O-N 2.87Å
433	P	87.6	Confident	93.2	Very high	67 Å²	67	24.1 Å²	24.1	44%	0.435	13%	0.125	S	C	.	.	H	α-helix	trans	-52.5	-41.6	-178.4	-30	35.8	0	0	0	114.1	C435 A436 V437 N455 A457 L464	P433-C435 PolarHBondContact O-N 3.02Å; P433-A436 PolarHBondContact O-N 2.84Å; P433-V437 WeakPolarHBondContact O-CB 3.47Å; P433-V437 VanDerWaalsContact O-CG2 3.29Å; P433-V437 WeakPolarHBondContact O-CG2 3.42Å; P433-V437 PolarHBondContact O-N 2.71Å; P433-N455 WeakPolarHBondContact CD-O 3.28Å; P433-A457 HydrophobicContact CB-CB 4.24Å; P433-A457 HydrophobicContact CG-CB 3.96Å; P433-L464 HydrophobicContact CB-CD1 4.13Å
434	M	87.8	Confident	93.2	Very high	67 Å²	67	24 Å²	24	33%	0.33	12%	0.124	S	C	.	.	H	α-helix	trans	-59.3	-48.3	176.3	179.2	-173.7	70.5	0	0	112	L374 H376 I379 C432 A438	L374-M434 HydrophobicContact CB-SD 4.28Å; L374-M434 HydrophobicContact CD2-SD 3.76Å; L374-M434 WeakPolarHBondContact O-CE 3.36Å; H376-M434 HydrophobicContact CB-CE 4.34Å; H376-M434 WeakPolarHBondContact ND1-CE 3.43Å; I379-M434 HydrophobicContact CD1-CE 4.41Å; I379-M434 HydrophobicContact CD1-CG 4.44Å; I379-M434 HydrophobicContact CG1-CE 3.87Å; C432-M434 VanDerWaalsContact C-N 3.28Å; C432-M434 PolarHBondContact O-N 3.38Å; C432-M434 VanDerWaalsContact O-N 3.17Å; M434-A438 WeakPolarHBondContact O-CB 3.26Å; M434-A438 PolarHBondContact O-N 2.69Å
435	C	92.2	Very high	93.1	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.02	14%	0.139	C	C	.	.	H	α-helix	trans	-69.4	-39.4	-178.5	-67.6	0	0	0	0	111.9	H376 V378 P431 C432 P433 A438 L439	H376-C435 WeakPolarHBondContact CB-SG 3.43Å; H376-C435 PolarHBondContact ND1-SG 3.46Å; V378-C435 HydrophobicContact CB-CB 3.86Å; V378-C435 HydrophobicContact CG1-CB 3.94Å; V378-C435 HydrophobicContact CG2-CB 4.16Å; P431-C435 HydrophobicContact CB-CB 3.71Å; C432-C435 PolarHBondContact O-N 3.43Å; C432-C435 VanDerWaalsContact SG-SG 3.65Å; P433-C435 PolarHBondContact O-N 3.02Å; C435-A438 PolarHBondContact O-N 3.35Å; C435-L439 WeakPolarHBondContact O-CG 3.26Å; C435-L439 PolarHBondContact O-N 3.23Å
436	A	92.7	Very high	93	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-45.7	175.7	0	0	0	0	0	111.9	P431 C432 P433 L439 L440 A457 F458 L464	P431-A436 HydrophobicContact CB-CB 4.49Å; C432-A436 PolarHBondContact O-N 2.87Å; P433-A436 PolarHBondContact O-N 2.84Å; A436-L439 PolarHBondContact O-N 2.76Å; A436-L440 WeakPolarHBondContact O-CB 3.4Å; A436-L440 PolarHBondContact O-N 3.17Å; A436-A457 HydrophobicContact CB-CB 3.68Å; A436-F458 HydrophobicContact CB-CD1 4.05Å; A436-F458 HydrophobicContact CB-CE1 3.41Å; A436-F458 VanDerWaalsContact CB-CE1 3.41Å; A436-F458 HydrophobicContact CB-CZ 3.77Å; A436-L464 HydrophobicContact CB-CB 4.34Å; A436-L464 HydrophobicContact CB-CD1 4.06Å
437	V	88.6	Confident	93	Very high	55 Å²	55	29.5 Å²	29.5	33%	0.333	15%	0.145	S	C	.	.	H	α-helix	trans	-67.8	-35	176.3	173.1	0	0	0	0	111.6	P433 L440 H441 L464	P433-V437 WeakPolarHBondContact O-CB 3.47Å; P433-V437 VanDerWaalsContact O-CG2 3.29Å; P433-V437 WeakPolarHBondContact O-CG2 3.42Å; P433-V437 PolarHBondContact O-N 2.71Å; V437-L440 WeakPolarHBondContact O-CB 3.23Å; V437-L440 PolarHBondContact O-N 3.41Å; V437-H441 VanDerWaalsContact CG1-CD2 3.47Å; V437-H441 WeakPolarHBondContact CG1-CD2 3.39Å; V437-H441 PolarHBondContact O-CD2 2.99Å; V437-H441 VanDerWaalsContact O-CD2 3.32Å; V437-H441 PolarHBondContact O-N 3.06Å; V437-L464 HydrophobicContact CG2-CD1 3.78Å
438	A	90	Very high	93.1	Very high	22 Å²	22	29.5 Å²	29.5	18%	0.182	15%	0.145	C	C	.	.	H	α-helix	trans	-63.2	-43	174.3	0	0	0	0	0	112.2	I379 I382 M434 C435 H441 S442	I379-A438 HydrophobicContact CD1-CB 3.37Å; I382-A438 HydrophobicContact CD1-CB 3.76Å; M434-A438 WeakPolarHBondContact O-CB 3.26Å; M434-A438 PolarHBondContact O-N 2.69Å; C435-A438 PolarHBondContact O-N 3.35Å; A438-H441 PolarHBondContact O-N 2.98Å; A438-S442 VanDerWaalsContact O-CB 3.32Å; A438-S442 WeakPolarHBondContact O-CB 3.27Å; A438-S442 PolarHBondContact O-N 3.33Å; A438-S442 PolarHBondContact O-OG 3.33Å
439	L	94.8	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-41.1	174.7	-76	167.4	0	0	0	112	V378 I382 C425 P431 C435 A436 S442 R443 I444 V447 F458 F474	V378-L439 HydrophobicContact CG1-CD1 3.68Å; V378-L439 HydrophobicContact CG1-CD2 3.94Å; V378-L439 HydrophobicContact CG1-CG 3.59Å; I382-L439 HydrophobicContact CD1-CD2 4.13Å; I382-L439 HydrophobicContact CD1-CG 4.3Å; I382-L439 HydrophobicContact CG1-CD2 4.47Å; C425-L439 HydrophobicContact CB-CD2 4.18Å; P431-L439 HydrophobicContact CG-CD1 4.35Å; C435-L439 WeakPolarHBondContact O-CG 3.26Å; C435-L439 PolarHBondContact O-N 3.23Å; A436-L439 PolarHBondContact O-N 2.76Å; L439-S442 CarbonylContact O-C 3.55Å; L439-S442 PolarHBondContact O-N 2.95Å; L439-R443 PolarHBondContact O-N 3.34Å; L439-I444 HydrophobicContact CB-CB 4.49Å; L439-I444 HydrophobicContact CB-CG2 3.94Å; L439-I444 HydrophobicContact CD2-CB 4.17Å; L439-I444 HydrophobicContact CD2-CD1 4.47Å; L439-I444 HydrophobicContact CD2-CG1 4.16Å; L439-I444 HydrophobicContact CD2-CG2 4.33Å; L439-I444 PolarHBondContact O-N 3.49Å; L439-V447 HydrophobicContact CD1-CG1 4.47Å; L439-V447 HydrophobicContact CD1-CG2 4Å; L439-F458 HydrophobicContact CD1-CE2 4.37Å; L439-F458 HydrophobicContact CD1-CZ 4.08Å; L439-F474 HydrophobicContact CB-CZ 4.41Å
440	L	91.6	Very high	93.2	Very high	17 Å²	17	27.6 Å²	27.6	9%	0.089	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-50.3	173.7	178.5	70.1	0	0	0	111.7	A436 V437 S442 R443 V470 H472 F474	A436-L440 WeakPolarHBondContact O-CB 3.4Å; A436-L440 PolarHBondContact O-N 3.17Å; V437-L440 WeakPolarHBondContact O-CB 3.23Å; V437-L440 PolarHBondContact O-N 3.41Å; L440-S442 PolarHBondContact O-N 3.02Å; L440-R443 PolarHBondContact O-N 2.84Å; L440-V470 HydrophobicContact CD1-CB 4.43Å; L440-V470 HydrophobicContact CD1-CG2 4.01Å; L440-V470 HydrophobicContact CD2-CB 4.08Å; L440-V470 HydrophobicContact CD2-CG1 3.87Å; L440-V470 HydrophobicContact CD2-CG2 4.19Å; L440-H472 HydrophobicContact CD1-CB 4.18Å; L440-H472 WeakPolarHBondContact CD1-O 3.47Å; L440-F474 HydrophobicContact CB-CE1 3.99Å; L440-F474 HydrophobicContact CD1-CD1 4.29Å; L440-F474 HydrophobicContact CD1-CE1 3.9Å
441	H	88.5	Confident	93	Very high	83 Å²	83	28.7 Å²	28.7	38%	0.384	14%	0.143	S	C	.	.	H	α-helix	trans	-64.4	-30.3	177.2	-79.8	-49.9	0	0	0	112.9	R55 L419 V437 A438 R443	R55-H441 PolarHBondContact NH1-CE1 2.8Å; R55-H441 VanDerWaalsContact NH1-CE1 3.31Å; L419-H441 WeakPolarHBondContact CD1-O 3.11Å; V437-H441 VanDerWaalsContact CG1-CD2 3.47Å; V437-H441 WeakPolarHBondContact CG1-CD2 3.39Å; V437-H441 PolarHBondContact O-CD2 2.99Å; V437-H441 VanDerWaalsContact O-CD2 3.32Å; V437-H441 PolarHBondContact O-N 3.06Å; A438-H441 PolarHBondContact O-N 2.98Å; H441-R443 PolarHBondContact O-N 3.36Å
442	S	91.7	Very high	92.9	Very high	12 Å²	12	30.7 Å²	30.7	8%	0.084	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.1	175.7	-55.3	0	0	0	0	113.2	I382 L419 C420 A438 L439 L440 I444	I382-S442 WeakPolarHBondContact CG2-OG 3.38Å; L419-S442 VanDerWaalsContact CB-O 3.23Å; L419-S442 WeakPolarHBondContact CB-O 3.27Å; C420-S442 WeakPolarHBondContact CA-O 3.26Å; C420-S442 WeakPolarHBondContact CB-O 3.3Å; C420-S442 PolarHBondContact N-O 2.9Å; A438-S442 VanDerWaalsContact O-CB 3.32Å; A438-S442 WeakPolarHBondContact O-CB 3.27Å; A438-S442 PolarHBondContact O-N 3.33Å; A438-S442 PolarHBondContact O-OG 3.33Å; L439-S442 CarbonylContact O-C 3.55Å; L439-S442 PolarHBondContact O-N 2.95Å; L440-S442 PolarHBondContact O-N 3.02Å; S442-I444 VanDerWaalsContact C-N 3.3Å; S442-I444 PolarHBondContact O-N 3.23Å
443	R	92.9	Very high	92.7	Very high	107 Å²	107	31 Å²	31	40%	0.404	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	40.6	-178.5	-60.8	-161.4	175.6	127.2	6.1	114.1	T421 L439 L440 H441 H472	T421-R443 WeakPolarHBondContact CA-O 3.38Å; L439-R443 PolarHBondContact O-N 3.34Å; L440-R443 PolarHBondContact O-N 2.84Å; H441-R443 PolarHBondContact O-N 3.36Å; R443-H472 WeakPolarHBondContact CA-NE2 3.44Å; R443-H472 HydrophobicContact CG-CB 4.49Å
444	I	96.1	Very high	92.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.174	C	C	.	.			trans	-54.5	146.5	176.8	-162.8	66.8	0	0	0	111	C420 F423 C425 L439 S442 V447 H472 F474	C420-I444 HydrophobicContact CB-CB 4.47Å; C420-I444 HydrophobicContact CB-CD1 3.68Å; F423-I444 HydrophobicContact CB-CD1 4.14Å; F423-I444 WeakPolarHBondContact O-CD1 3.32Å; C425-I444 HydrophobicContact CB-CD1 3.9Å; C425-I444 HydrophobicContact CB-CG1 3.91Å; L439-I444 HydrophobicContact CB-CB 4.49Å; L439-I444 HydrophobicContact CB-CG2 3.94Å; L439-I444 HydrophobicContact CD2-CB 4.17Å; L439-I444 HydrophobicContact CD2-CD1 4.47Å; L439-I444 HydrophobicContact CD2-CG1 4.16Å; L439-I444 HydrophobicContact CD2-CG2 4.33Å; L439-I444 PolarHBondContact O-N 3.49Å; S442-I444 VanDerWaalsContact C-N 3.3Å; S442-I444 PolarHBondContact O-N 3.23Å; I444-V447 HydrophobicContact CG1-CG2 4.3Å; I444-V447 HydrophobicContact CG2-CG2 3.85Å; I444-H472 PolarHBondContact O-NE2 3.42Å; I444-F474 HydrophobicContact CG2-CB 4.31Å; I444-F474 HydrophobicContact CG2-CD1 3.94Å; I444-F474 HydrophobicContact CG2-CD2 3.75Å; I444-F474 HydrophobicContact CG2-CE1 4.11Å; I444-F474 HydrophobicContact CG2-CE2 3.92Å; I444-F474 HydrophobicContact CG2-CG 3.74Å; I444-F474 HydrophobicContact CG2-CZ 4.08Å; I444-F474 VanDerWaalsContact O-CB 3.32Å; I444-F474 WeakPolarHBondContact O-CB 2.77Å
445	R	96.1	Very high	92	Very high	82 Å²	82	38 Å²	38	31%	0.309	19%	0.187	S	C	.	.	S	Bend	trans	-77.7	-52.1	179.6	-168.8	-174.6	67.2	165.9	3.4	112	F423 D424 F474	F423-R445 WeakPolarHBondContact O-CB 3.4Å; F423-R445 PolarHBondContact O-N 3.21Å; D424-R445 IonicContact OD1-CZ 3.51Å; D424-R445 VanDerWaalsContact OD1-CZ 3.23Å; D424-R445 IonicContact OD1-NE 3.99Å; D424-R445 PolarHBondContact OD1-NE 2.84Å; D424-R445 IonicContact OD1-NH2 3.07Å; D424-R445 PolarHBondContact OD1-NH2 2.88Å; D424-R445 IonicContact OD2-CZ 3.23Å; D424-R445 IonicContact OD2-NE 3.28Å; D424-R445 IonicContact OD2-NH2 3.46Å; D424-R445 PolarHBondContact OD2-NH2 3.28Å; R445-F474 VanDerWaalsContact O-CB 3.27Å; R445-F474 WeakPolarHBondContact O-CB 3.21Å
446	R	97	Very high	91.7	Very high	41 Å²	41	37.8 Å²	37.8	16%	0.155	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	153.5	-179.1	-54.5	-175.1	-67.1	-175.9	7.2	110.8	D424 C425 F448 D475	D424-R446 WeakPolarHBondContact OD1-CB 3.48Å; D424-R446 IonicContact OD1-NE 3.52Å; D424-R446 PolarHBondContact OD1-NE 3.17Å; D424-R446 IonicContact OD2-CZ 3.49Å; D424-R446 IonicContact OD2-NE 2.85Å; D424-R446 PolarHBondContact OD2-NE 2.8Å; D424-R446 IonicContact OD2-NH2 2.96Å; D424-R446 PolarHBondContact OD2-NH2 3.18Å; C425-R446 PolarHBondContact N-O 3.02Å; R446-F448 HydrophobicContact CB-CE2 4Å; R446-F448 HydrophobicContact CB-CZ 4.41Å; R446-D475 CarbonylContact C-O 3.57Å; R446-D475 WeakPolarHBondContact CA-O 3.23Å; R446-D475 HydrophobicContact CG-CB 4.16Å
447	V	98.3	Very high	91.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.5	173.8	-172.7	0	0	0	0	110.3	C425 V427 L439 I444 F458 F474 D475 V476 F477	C425-V447 HydrophobicContact CB-CG1 4.36Å; C425-V447 HydrophobicContact CB-CG2 4.22Å; C425-V447 CarbonylContact O-C 3.57Å; C425-V447 WeakPolarHBondContact O-CA 3.4Å; V427-V447 HydrophobicContact CG1-CG1 4.2Å; L439-V447 HydrophobicContact CD1-CG1 4.47Å; L439-V447 HydrophobicContact CD1-CG2 4Å; I444-V447 HydrophobicContact CG1-CG2 4.3Å; I444-V447 HydrophobicContact CG2-CG2 3.85Å; V447-F458 HydrophobicContact CB-CE2 4.22Å; V447-F458 HydrophobicContact CG1-CE2 3.93Å; V447-F458 HydrophobicContact CG2-CE2 4.32Å; V447-F458 HydrophobicContact CG2-CZ 4.41Å; V447-F474 HydrophobicContact CB-CE2 4.38Å; V447-F474 HydrophobicContact CG2-CD2 3.81Å; V447-F474 HydrophobicContact CG2-CE2 3.51Å; V447-F474 HydrophobicContact CG2-CZ 4.5Å; V447-D475 PolarHBondContact N-O 3.44Å; V447-V476 HydrophobicContact CB-CG2 4.22Å; V447-V476 CarbonylContact O-C 3.58Å; V447-V476 VanDerWaalsContact O-CA 3.28Å; V447-V476 WeakPolarHBondContact O-CA 3.44Å; V447-F477 PolarHBondContact O-N 3.4Å
448	F	98	Very high	91.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.6	174.7	-60.8	-91.5	0	0	0	108	W177 F319 I327 M331 D424 C425 Y426 V427 R446 F477 I480	W177-F448 HydrophobicContact CH2-CE1 4.14Å; W177-F448 AromaticContact CZ3-CD1 3.92Å; W177-F448 HydrophobicContact CZ3-CD1 3.92Å; W177-F448 AromaticContact CZ3-CE1 3.66Å; W177-F448 HydrophobicContact CZ3-CE1 3.66Å; F319-F448 HydrophobicContact CE1-CE1 4.06Å; F319-F448 AromaticContact CE1-CZ 3.95Å; F319-F448 HydrophobicContact CE1-CZ 3.95Å; F319-F448 AromaticContact CZ-CE1 3.84Å; F319-F448 HydrophobicContact CZ-CE1 3.84Å; F319-F448 HydrophobicContact CZ-CZ 4.03Å; I327-F448 HydrophobicContact CD1-CD1 4.34Å; I327-F448 HydrophobicContact CD1-CE1 3.6Å; I327-F448 HydrophobicContact CD1-CZ 3.89Å; I327-F448 HydrophobicContact CG1-CD1 4.49Å; I327-F448 HydrophobicContact CG1-CE1 4.08Å; I327-F448 HydrophobicContact CG1-CZ 4.2Å; I327-F448 HydrophobicContact CG2-CD1 4.1Å; I327-F448 HydrophobicContact CG2-CE1 4.43Å; M331-F448 HydrophobicContact CE-CB 4.37Å; D424-F448 HydrophobicContact CB-CD2 4.49Å; D424-F448 HydrophobicContact CB-CE2 4.05Å; C425-F448 PolarHBondContact O-N 3.28Å; Y426-F448 CarbonylContact C-O 3.58Å; Y426-F448 WeakPolarHBondContact CA-O 3.49Å; Y426-F448 HydrophobicContact CD1-CB 3.66Å; Y426-F448 AromaticContact CD1-CD2 3.96Å; Y426-F448 HydrophobicContact CD1-CD2 3.96Å; Y426-F448 AromaticContact CD1-CG 3.98Å; Y426-F448 HydrophobicContact CD1-CG 3.98Å; Y426-F448 HydrophobicContact CE1-CB 3.95Å; Y426-F448 HydrophobicContact CE1-CD1 4.48Å; Y426-F448 AromaticContact CE1-CD2 3.52Å; Y426-F448 HydrophobicContact CE1-CD2 3.52Å; Y426-F448 HydrophobicContact CE1-CE2 4.13Å; Y426-F448 AromaticContact CE1-CG 3.74Å; Y426-F448 HydrophobicContact CE1-CG 3.74Å; Y426-F448 HydrophobicContact CE2-CD2 4.4Å; Y426-F448 HydrophobicContact CG-CB 4.42Å; Y426-F448 AromaticContact CZ-CD2 3.77Å; V427-F448 PolarHBondContact N-O 3.38Å; R446-F448 HydrophobicContact CB-CE2 4Å; R446-F448 HydrophobicContact CB-CZ 4.41Å; F448-F477 CarbonylContact C-O 3.53Å; F448-F477 WeakPolarHBondContact CA-O 3Å; F448-F477 HydrophobicContact CD1-CB 3.7Å; F448-F477 AromaticContact CD1-CD2 3.83Å; F448-F477 HydrophobicContact CD1-CD2 3.83Å; F448-F477 AromaticContact CD1-CG 3.98Å; F448-F477 HydrophobicContact CD1-CG 3.98Å; F448-F477 HydrophobicContact CE1-CB 4.06Å; F448-F477 AromaticContact CE1-CD2 3.45Å; F448-F477 HydrophobicContact CE1-CD2 3.45Å; F448-F477 VanDerWaalsContact CE1-CD2 3.45Å; F448-F477 HydrophobicContact CE1-CE2 4.1Å; F448-F477 AromaticContact CE1-CG 3.81Å; F448-F477 HydrophobicContact CE1-CG 3.81Å; F448-F477 AromaticContact CZ-CD2 3.89Å; F448-F477 HydrophobicContact CZ-CD2 3.89Å; F448-F477 HydrophobicContact CZ-CE2 4.21Å; F448-I480 HydrophobicContact CB-CG1 3.93Å; F448-I480 HydrophobicContact CD1-CD1 4.34Å; F448-I480 HydrophobicContact CD1-CG1 4.31Å
449	Y	97.3	Very high	91.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.5	175.8	76.2	-94.2	0	0	0	114.4	V180 V427 E430 H451 C452 F458 V476 F477 R478 G479 I480	V180-Y449 HydrophobicContact CG2-CE1 4.02Å; V427-Y449 WeakPolarHBondContact O-CA 3.48Å; V427-Y449 WeakPolarHBondContact O-CB 3.4Å; E430-Y449 HydrophobicContact CB-CD2 3.83Å; E430-Y449 HydrophobicContact CB-CE2 3.72Å; E430-Y449 HydrophobicContact CB-CG 4.39Å; E430-Y449 HydrophobicContact CG-CD2 4.36Å; E430-Y449 HydrophobicContact CG-CE1 4.24Å; E430-Y449 HydrophobicContact CG-CE2 3.99Å; Y449-H451 WeakPolarHBondContact CD2-O 3.27Å; Y449-C452 PolarHBondContact OH-SG 3.19Å; Y449-C452 VanDerWaalsContact OH-SG 3.42Å; Y449-F458 HydrophobicContact CD1-CD2 4.43Å; Y449-F458 HydrophobicContact CE1-CB 4.31Å; Y449-V476 HydrophobicContact CD1-CG1 3.86Å; Y449-V476 HydrophobicContact CE1-CG1 3.74Å; Y449-F477 WeakPolarHBondContact CD1-O 3.26Å; Y449-F477 PolarHBondContact N-O 3.14Å; Y449-R478 HydrophobicContact CD1-CB 4.14Å; Y449-R478 HydrophobicContact CD2-CB 4.19Å; Y449-R478 HydrophobicContact CE1-CB 3.47Å; Y449-R478 VanDerWaalsContact CE1-CB 3.47Å; Y449-R478 HydrophobicContact CE2-CB 3.53Å; Y449-R478 HydrophobicContact CG-CB 4.47Å; Y449-R478 CarbonylContact O-C 3.45Å; Y449-R478 WeakPolarHBondContact O-CA 3.17Å; Y449-R478 VanDerWaalsContact OH-CB 3.23Å; Y449-R478 WeakPolarHBondContact OH-CB 3.44Å; Y449-R478 WeakPolarHBondContact OH-CD 2.99Å; Y449-G479 PolarHBondContact O-N 2.87Å; Y449-I480 PolarHBondContact O-N 3.19Å
450	G	95.1	Very high	90.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-78.6	-178.2	0	0	0	0	0	112.9	V427 G479 I480	V427-G450 PolarHBondContact O-N 3.19Å; V427-G450 VanDerWaalsContact O-N 3.11Å; G450-G479 WeakPolarHBondContact O-CA 3.06Å; G450-G479 PolarHBondContact O-N 3.05Å; G450-G479 VanDerWaalsContact O-N 3.11Å; G450-I480 VanDerWaalsContact CA-O 3.3Å; G450-I480 WeakPolarHBondContact CA-O 3.41Å
451	H	92	Very high	90.3	Very high	23 Å²	23	43.6 Å²	43.6	11%	0.106	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	149.7	-175.2	73.5	-72.2	0	0	0	113.2	T428 E430 Y449 E482 R486	T428-H451 PolarHBondContact O-N 3.17Å; T428-H451 PolarHBondContact O-ND1 3.23Å; E430-H451 PolarHBondContact N-O 3.1Å; Y449-H451 WeakPolarHBondContact CD2-O 3.27Å; H451-E482 HydrophobicContact CB-CG 3.94Å; H451-R486 HydrophobicContact CB-CG 3.52Å
452	C	91.4	Very high	89.8	Confident	46 Å²	46	41.2 Å²	41.2	31%	0.311	21%	0.212	S	C	.	.			trans	-71	157.2	174.6	-63.2	0	0	0	0	111.9	Y449	Y449-C452 PolarHBondContact OH-SG 3.19Å; Y449-C452 VanDerWaalsContact OH-SG 3.42Å
453	T	86.7	Confident	89.6	Confident	26 Å²	26	42.9 Å²	42.9	16%	0.16	22%	0.22	C	C	.	.			trans	-135.2	155.5	173.3	63.7	0	0	0	0	112.2	R429 E430 N455 G456 S460	R429-T453 VanDerWaalsContact CD-CG2 3.41Å; R429-T453 HydrophobicContact CG-CG2 3.16Å; E430-T453 PolarHBondContact OE2-N 3.3Å; T453-N455 PolarHBondContact O-N 3.38Å; T453-G456 PolarHBondContact O-N 3.23Å; T453-G456 WeakPolarHBondContact OG1-CA 3.28Å; T453-G456 PolarHBondContact OG1-N 2.9Å; T453-G456 VanDerWaalsContact OG1-N 3.17Å; T453-S460 WeakPolarHBondContact O-CB 3.31Å; T453-S460 PolarHBondContact O-OG 3.29Å; T453-S460 VanDerWaalsContact O-OG 3.06Å
454	E	81.5	Confident	89.2	Confident	165 Å²	165	38.3 Å²	38.3	77%	0.771	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.4	177.6	-67.6	-174.3	171.9	0	0	113.8	K461	E454-K461 WeakPolarHBondContact O-CE 3.24Å; E454-K461 WeakPolarHBondContact O-CG 3.33Å
455	N	79.9	Confident	88.8	Confident	114 Å²	114	38.3 Å²	38.3	61%	0.61	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.4	21.7	179.8	-65.3	-42.7	0	0	0	112.7	P433 T453	P433-N455 WeakPolarHBondContact CD-O 3.28Å; T453-N455 PolarHBondContact O-N 3.38Å
456	G	86.7	Confident	88.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.			trans	-75.3	142.2	-178.7	0	0	0	0	0	113.3	E430 T453 K461	E430-G456 WeakPolarHBondContact OE1-CA 3.49Å; T453-G456 PolarHBondContact O-N 3.23Å; T453-G456 WeakPolarHBondContact OG1-CA 3.28Å; T453-G456 PolarHBondContact OG1-N 2.9Å; T453-G456 VanDerWaalsContact OG1-N 3.17Å; G456-K461 WeakPolarHBondContact O-CB 3.47Å; G456-K461 PolarHBondContact O-N 3.43Å
457	A	89	Confident	87.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	8.6	-170.8	0	0	0	0	0	115.1	E430 P431 P433 A436 A462 L464	E430-A457 PolarHBondContact OE1-N 3.33Å; P431-A457 PolarHBondContact O-N 3.26Å; P433-A457 HydrophobicContact CB-CB 4.24Å; P433-A457 HydrophobicContact CG-CB 3.96Å; A436-A457 HydrophobicContact CB-CB 3.68Å; A457-A462 CarbonylContact C-O 3.5Å; A457-A462 CarbonylContact O-C 3.5Å; A457-L464 HydrophobicContact CB-CD1 3.75Å; A457-L464 HydrophobicContact CB-CG 4.12Å; A457-L464 PolarHBondContact O-N 3.21Å
458	F	90.6	Very high	86.3	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-17.7	176.3	-68.2	-32.6	0	0	0	113.9	V180 E430 P431 A436 L439 V447 Y449 A462 L463 H465 F474 V476	V180-F458 WeakPolarHBondContact CG1-O 3.12Å; E430-F458 HydrophobicContact CG-CB 4.4Å; E430-F458 PolarHBondContact OE1-N 3.43Å; P431-F458 HydrophobicContact CB-CD2 4.48Å; P431-F458 HydrophobicContact CB-CE2 4Å; P431-F458 HydrophobicContact CB-CZ 4.43Å; P431-F458 HydrophobicContact CG-CD2 4.09Å; P431-F458 HydrophobicContact CG-CE2 3.56Å; P431-F458 HydrophobicContact CG-CZ 4.35Å; A436-F458 HydrophobicContact CB-CD1 4.05Å; A436-F458 HydrophobicContact CB-CE1 3.41Å; A436-F458 VanDerWaalsContact CB-CE1 3.41Å; A436-F458 HydrophobicContact CB-CZ 3.77Å; L439-F458 HydrophobicContact CD1-CE2 4.37Å; L439-F458 HydrophobicContact CD1-CZ 4.08Å; V447-F458 HydrophobicContact CB-CE2 4.22Å; V447-F458 HydrophobicContact CG1-CE2 3.93Å; V447-F458 HydrophobicContact CG2-CE2 4.32Å; V447-F458 HydrophobicContact CG2-CZ 4.41Å; Y449-F458 HydrophobicContact CD1-CD2 4.43Å; Y449-F458 HydrophobicContact CE1-CB 4.31Å; F458-A462 CarbonylContact C-O 3.54Å; F458-A462 PolarHBondContact N-O 3.46Å; F458-L463 VanDerWaalsContact O-CD1 3.27Å; F458-L463 WeakPolarHBondContact O-CD1 3.42Å; F458-H465 HydrophobicContact CD1-CB 4.04Å; F458-H465 AromaticContact CD1-ND1 3.6Å; F458-H465 HydrophobicContact CE1-CB 4Å; F458-H465 PolarHBondContact O-CE1 3.41Å; F458-F474 AromaticContact CE1-CE2 3.85Å; F458-F474 HydrophobicContact CE1-CE2 3.85Å; F458-F474 AromaticContact CE1-CZ 3.65Å; F458-F474 HydrophobicContact CE1-CZ 3.65Å; F458-F474 HydrophobicContact CE2-CE2 4.49Å; F458-F474 AromaticContact CZ-CE2 3.72Å; F458-F474 HydrophobicContact CZ-CE2 3.72Å; F458-F474 AromaticContact CZ-CZ 3.75Å; F458-F474 HydrophobicContact CZ-CZ 3.75Å; F458-V476 HydrophobicContact CB-CG1 3.99Å; F458-V476 HydrophobicContact CD1-CG2 4.28Å; F458-V476 HydrophobicContact CD2-CG1 3.78Å; F458-V476 HydrophobicContact CD2-CG2 4.2Å; F458-V476 HydrophobicContact CE1-CG2 4.45Å; F458-V476 HydrophobicContact CE2-CG1 4.48Å; F458-V476 HydrophobicContact CE2-CG2 4.35Å; F458-V476 HydrophobicContact CG-CG1 4.03Å; F458-V476 HydrophobicContact CG-CG2 4.18Å; F458-V476 HydrophobicContact CZ-CG2 4.49Å
459	G	83.7	Confident	85	Confident	34 Å²	34	38.7 Å²	38.7	35%	0.351	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-160.8	-16.7	169.6	0	0	0	0	0	114.4	E430 A462	E430-G459 PolarHBondContact OE1-N 3.41Å; G459-A462 PolarHBondContact N-O 3.3Å; G459-A462 VanDerWaalsContact N-O 3.11Å
460	S	83	Confident	83.9	Confident	51 Å²	51	39.5 Å²	39.5	36%	0.357	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-51.3	-174.8	-64	0	0	0	0	113.3	E430 T453	E430-S460 PolarHBondContact OE1-N 3.43Å; E430-S460 VanDerWaalsContact OE1-N 3.16Å; E430-S460 WeakPolarHBondContact OE2-CB 3.36Å; E430-S460 PolarHBondContact OE2-OG 2.85Å; T453-S460 WeakPolarHBondContact O-CB 3.31Å; T453-S460 PolarHBondContact O-OG 3.29Å; T453-S460 VanDerWaalsContact O-OG 3.06Å
461	K	80.8	Confident	83.1	Confident	132 Å²	132	44.4 Å²	44.4	57%	0.574	25%	0.247	S	C	*	.	S	Bend	trans	-116	-24.2	178.4	-68.5	-70.8	-176.3	179.3	0	113.8	E454 G456	E454-K461 WeakPolarHBondContact O-CE 3.24Å; E454-K461 WeakPolarHBondContact O-CG 3.33Å; G456-K461 WeakPolarHBondContact O-CB 3.47Å; G456-K461 PolarHBondContact O-N 3.43Å
462	A	79	Confident	82.8	Confident	32 Å²	32	45.4 Å²	45.4	26%	0.264	25%	0.251	S	S	.	.			trans	-151.1	168.4	-177.3	0	0	0	0	0	110	A457 F458 G459 L464	A457-A462 CarbonylContact C-O 3.5Å; A457-A462 CarbonylContact O-C 3.5Å; F458-A462 CarbonylContact C-O 3.54Å; F458-A462 PolarHBondContact N-O 3.46Å; G459-A462 PolarHBondContact N-O 3.3Å; G459-A462 VanDerWaalsContact N-O 3.11Å; A462-L464 HydrophobicContact CB-CD2 3.9Å; A462-L464 HydrophobicContact CB-CG 3.9Å
463	L	86.5	Confident	82.7	Confident	48 Å²	48	48.5 Å²	48.5	25%	0.251	26%	0.256	S	S	.	.			trans	-124.8	56.2	178.5	-162.3	86.5	0	0	0	109.4	V180 P182 F458 H465 Q466	V180-L463 HydrophobicContact CG1-CD1 4.17Å; P182-L463 VanDerWaalsContact CA-CD2 3.49Å; P182-L463 HydrophobicContact CB-CD2 3.8Å; P182-L463 HydrophobicContact CG-CD2 3.72Å; F458-L463 VanDerWaalsContact O-CD1 3.27Å; F458-L463 WeakPolarHBondContact O-CD1 3.42Å; L463-H465 VanDerWaalsContact CD1-CE1 3.46Å; L463-H465 WeakPolarHBondContact CD1-CE1 3.28Å; L463-H465 PolarHBondContact O-N 2.93Å; L463-H465 VanDerWaalsContact O-N 3.16Å; L463-Q466 HydrophobicContact CD2-CB 3.67Å; L463-Q466 HydrophobicContact CD2-CG 4.28Å; L463-Q466 HydrophobicContact CG-CB 4.06Å; L463-Q466 HydrophobicContact CG-CG 4.5Å; L463-Q466 PolarHBondContact O-N 3.21Å; L463-Q466 VanDerWaalsContact O-N 3.14Å
464	L	84.7	Confident	83.1	Confident	11 Å²	11	47.5 Å²	47.5	6%	0.058	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-66.3	-21.2	-165.3	-62.6	-173.7	0	0	0	114.1	F151 P433 A436 V437 A457 A462 Q466 L467	F151-L464 HydrophobicContact CE1-CD2 4.32Å; P433-L464 HydrophobicContact CB-CD1 4.13Å; A436-L464 HydrophobicContact CB-CB 4.34Å; A436-L464 HydrophobicContact CB-CD1 4.06Å; V437-L464 HydrophobicContact CG2-CD1 3.78Å; A457-L464 HydrophobicContact CB-CD1 3.75Å; A457-L464 HydrophobicContact CB-CG 4.12Å; A457-L464 PolarHBondContact O-N 3.21Å; A462-L464 HydrophobicContact CB-CD2 3.9Å; A462-L464 HydrophobicContact CB-CG 3.9Å; L464-Q466 VanDerWaalsContact C-N 3.25Å; L464-Q466 PolarHBondContact O-N 3.36Å; L464-L467 HydrophobicContact CD2-CD1 3.72Å; L464-L467 HydrophobicContact CD2-CG 4.39Å
465	H	88.4	Confident	83.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-76.8	-8.5	178	62.7	-61.5	0	0	0	114.1	V180 F458 L463 F474 V476	V180-H465 PolarHBondContact O-NE2 3.15Å; F458-H465 HydrophobicContact CD1-CB 4.04Å; F458-H465 AromaticContact CD1-ND1 3.6Å; F458-H465 HydrophobicContact CE1-CB 4Å; F458-H465 PolarHBondContact O-CE1 3.41Å; L463-H465 VanDerWaalsContact CD1-CE1 3.46Å; L463-H465 WeakPolarHBondContact CD1-CE1 3.28Å; L463-H465 PolarHBondContact O-N 2.93Å; L463-H465 VanDerWaalsContact O-N 3.16Å; H465-F474 HydrophobicContact CB-CD1 4.18Å; H465-F474 HydrophobicContact CB-CD2 3.94Å; H465-F474 HydrophobicContact CB-CE1 3.77Å; H465-F474 HydrophobicContact CB-CE2 3.5Å; H465-F474 HydrophobicContact CB-CG 4.26Å; H465-F474 HydrophobicContact CB-CZ 3.43Å; H465-F474 VanDerWaalsContact CB-CZ 3.43Å; H465-F474 PolarHBondContact CD2-O 3.34Å; H465-V476 HydrophobicContact CB-CG2 3.84Å; H465-V476 WeakPolarHBondContact CD2-CG2 3.38Å; H465-V476 VanDerWaalsContact CG-CG2 3.47Å
466	Q	85.5	Confident	84.5	Confident	39 Å²	39	35.6 Å²	35.6	18%	0.182	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-129.8	14.7	-174.5	-67.8	-70.3	-29.9	0	0	113.4	P182 L463 L464 F474	P182-Q466 HydrophobicContact CG-CB 3.99Å; P182-Q466 HydrophobicContact CG-CG 4.09Å; L463-Q466 HydrophobicContact CD2-CB 3.67Å; L463-Q466 HydrophobicContact CD2-CG 4.28Å; L463-Q466 HydrophobicContact CG-CB 4.06Å; L463-Q466 HydrophobicContact CG-CG 4.5Å; L463-Q466 PolarHBondContact O-N 3.21Å; L463-Q466 VanDerWaalsContact O-N 3.14Å; L464-Q466 VanDerWaalsContact C-N 3.25Å; L464-Q466 PolarHBondContact O-N 3.36Å; Q466-F474 PolarHBondContact NE2-O 2.88Å
467	L	78.8	Confident	85	Confident	26 Å²	26	35.6 Å²	35.6	14%	0.136	19%	0.192	C	C	.	.			trans	-58.6	140.8	176.2	-67.8	172.4	0	0	0	111	L464 V470	L464-L467 HydrophobicContact CD2-CD1 3.72Å; L464-L467 HydrophobicContact CD2-CG 4.39Å; L467-V470 HydrophobicContact CB-CG1 4.04Å; L467-V470 HydrophobicContact CB-CG2 3.97Å; L467-V470 HydrophobicContact CD1-CG1 4.27Å; L467-V470 VanDerWaalsContact O-CG2 3.29Å; L467-V470 WeakPolarHBondContact O-CG2 3.03Å
468	D	73	Confident	85.3	Confident	51 Å²	51	37.1 Å²	37.1	27%	0.273	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-31	-178.3	-76.8	-32.5	0	0	0	113.2	V470 R473	D468-V470 VanDerWaalsContact C-N 3.26Å; D468-V470 PolarHBondContact O-N 3.33Å; D468-R473 PolarHBondContact O-NH2 3.29Å; D468-R473 IonicContact OD1-CZ 3.32Å; D468-R473 IonicContact OD1-NH1 3.08Å; D468-R473 PolarHBondContact OD1-NH1 3.47Å; D468-R473 IonicContact OD1-NH2 2.85Å; D468-R473 PolarHBondContact OD1-NH2 3.38Å
469	A	72.5	Confident	85.5	Confident	14 Å²	14	37.6 Å²	37.6	12%	0.116	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	0.4	-177.9	0	0	0	0	0	114.6	A58 Y89	A58-A469 HydrophobicContact CB-CB 4.09Å; A58-A469 VanDerWaalsContact O-CB 3.25Å; A58-A469 WeakPolarHBondContact O-CB 3.16Å; Y89-A469 HydrophobicContact CD2-CB 4.31Å; Y89-A469 HydrophobicContact CG-CB 4.17Å
470	V	72.7	Confident	86	Confident	17 Å²	17	36.1 Å²	36.1	10%	0.103	19%	0.186	C	C	.	.			trans	-104.3	137.2	179.9	-55	0	0	0	0	111.1	L440 L467 D468 H472	L440-V470 HydrophobicContact CD1-CB 4.43Å; L440-V470 HydrophobicContact CD1-CG2 4.01Å; L440-V470 HydrophobicContact CD2-CB 4.08Å; L440-V470 HydrophobicContact CD2-CG1 3.87Å; L440-V470 HydrophobicContact CD2-CG2 4.19Å; L467-V470 HydrophobicContact CB-CG1 4.04Å; L467-V470 HydrophobicContact CB-CG2 3.97Å; L467-V470 HydrophobicContact CD1-CG1 4.27Å; L467-V470 VanDerWaalsContact O-CG2 3.29Å; L467-V470 WeakPolarHBondContact O-CG2 3.03Å; D468-V470 VanDerWaalsContact C-N 3.26Å; D468-V470 PolarHBondContact O-N 3.33Å; V470-H472 VanDerWaalsContact C-N 3.29Å; V470-H472 WeakPolarHBondContact CG2-O 3.38Å; V470-H472 PolarHBondContact O-N 3.27Å
471	N	78.7	Confident	86.6	Confident	104 Å²	104	35.8 Å²	35.8	56%	0.556	18%	0.179	S	C	*	.	S	Bend	trans	-77.6	-13.3	-173.4	-58.1	-17.6	0	0	0	114	S84	S84-N471 PolarHBondContact O-ND2 2.81Å
472	H	85.8	Confident	87.2	Confident	44 Å²	44	31.3 Å²	31.3	20%	0.204	16%	0.161	C	C	.	.			trans	-118.8	133.4	-180	-175	68.5	0	0	0	109.3	L440 R443 I444 V470 F474	L440-H472 HydrophobicContact CD1-CB 4.18Å; L440-H472 WeakPolarHBondContact CD1-O 3.47Å; R443-H472 WeakPolarHBondContact CA-NE2 3.44Å; R443-H472 HydrophobicContact CG-CB 4.49Å; I444-H472 PolarHBondContact O-NE2 3.42Å; V470-H472 VanDerWaalsContact C-N 3.29Å; V470-H472 WeakPolarHBondContact CG2-O 3.38Å; V470-H472 PolarHBondContact O-N 3.27Å; H472-F474 AromaticContact CD2-CD1 3.89Å
473	R	89.2	Confident	87.8	Confident	111 Å²	111	32.7 Å²	32.7	42%	0.419	17%	0.172	S	C	.	.			trans	-129.5	142.3	176	-58.2	-179.1	-158.2	-132.2	5.7	108.4	D468	D468-R473 PolarHBondContact O-NH2 3.29Å; D468-R473 IonicContact OD1-CZ 3.32Å; D468-R473 IonicContact OD1-NH1 3.08Å; D468-R473 PolarHBondContact OD1-NH1 3.47Å; D468-R473 IonicContact OD1-NH2 2.85Å; D468-R473 PolarHBondContact OD1-NH2 3.38Å
474	F	94.2	Very high	88.2	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.018	18%	0.178	C	C	.	.			trans	-138.2	154.4	-178.3	57.6	-89.2	0	0	0	111	L439 L440 I444 R445 V447 F458 H465 Q466 H472 V476	L439-F474 HydrophobicContact CB-CZ 4.41Å; L440-F474 HydrophobicContact CB-CE1 3.99Å; L440-F474 HydrophobicContact CD1-CD1 4.29Å; L440-F474 HydrophobicContact CD1-CE1 3.9Å; I444-F474 HydrophobicContact CG2-CB 4.31Å; I444-F474 HydrophobicContact CG2-CD1 3.94Å; I444-F474 HydrophobicContact CG2-CD2 3.75Å; I444-F474 HydrophobicContact CG2-CE1 4.11Å; I444-F474 HydrophobicContact CG2-CE2 3.92Å; I444-F474 HydrophobicContact CG2-CG 3.74Å; I444-F474 HydrophobicContact CG2-CZ 4.08Å; I444-F474 VanDerWaalsContact O-CB 3.32Å; I444-F474 WeakPolarHBondContact O-CB 2.77Å; R445-F474 VanDerWaalsContact O-CB 3.27Å; R445-F474 WeakPolarHBondContact O-CB 3.21Å; V447-F474 HydrophobicContact CB-CE2 4.38Å; V447-F474 HydrophobicContact CG2-CD2 3.81Å; V447-F474 HydrophobicContact CG2-CE2 3.51Å; V447-F474 HydrophobicContact CG2-CZ 4.5Å; F458-F474 AromaticContact CE1-CE2 3.85Å; F458-F474 HydrophobicContact CE1-CE2 3.85Å; F458-F474 AromaticContact CE1-CZ 3.65Å; F458-F474 HydrophobicContact CE1-CZ 3.65Å; F458-F474 HydrophobicContact CE2-CE2 4.49Å; F458-F474 AromaticContact CZ-CE2 3.72Å; F458-F474 HydrophobicContact CZ-CE2 3.72Å; F458-F474 AromaticContact CZ-CZ 3.75Å; F458-F474 HydrophobicContact CZ-CZ 3.75Å; H465-F474 HydrophobicContact CB-CD1 4.18Å; H465-F474 HydrophobicContact CB-CD2 3.94Å; H465-F474 HydrophobicContact CB-CE1 3.77Å; H465-F474 HydrophobicContact CB-CE2 3.5Å; H465-F474 HydrophobicContact CB-CG 4.26Å; H465-F474 HydrophobicContact CB-CZ 3.43Å; H465-F474 VanDerWaalsContact CB-CZ 3.43Å; H465-F474 PolarHBondContact CD2-O 3.34Å; Q466-F474 PolarHBondContact NE2-O 2.88Å; H472-F474 AromaticContact CD2-CD1 3.89Å; F474-V476 HydrophobicContact CD2-CG2 3.67Å; F474-V476 HydrophobicContact CE2-CG2 3.5Å
475	D	95.1	Very high	88.6	Confident	27 Å²	27	33.7 Å²	33.7	14%	0.144	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135.8	-179.2	-58	-40.6	0	0	0	109.3	R309 L313 R446 V447 F477	R309-D475 IonicContact NH2-OD1 3.67Å; R309-D475 PolarHBondContact NH2-OD1 3.49Å; R309-D475 IonicContact NH2-OD2 3.81Å; R309-D475 PolarHBondContact NH2-OD2 2.74Å; R309-D475 VanDerWaalsContact NH2-OD2 3.08Å; L313-D475 HydrophobicContact CD2-CB 4.31Å; R446-D475 CarbonylContact C-O 3.57Å; R446-D475 WeakPolarHBondContact CA-O 3.23Å; R446-D475 HydrophobicContact CG-CB 4.16Å; V447-D475 PolarHBondContact N-O 3.44Å; D475-F477 HydrophobicContact CB-CE2 3.72Å; D475-F477 HydrophobicContact CB-CZ 4Å
476	V	96.9	Very high	88.7	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138	177.9	178.8	0	0	0	0	109.1	V180 V447 Y449 F458 H465 F474	V180-V476 HydrophobicContact CB-CB 4.19Å; V180-V476 HydrophobicContact CB-CG1 4.17Å; V180-V476 HydrophobicContact CG2-CB 4.45Å; V180-V476 HydrophobicContact CG2-CG1 3.95Å; V180-V476 PolarHBondContact N-O 2.97Å; V447-V476 HydrophobicContact CB-CG2 4.22Å; V447-V476 CarbonylContact O-C 3.58Å; V447-V476 VanDerWaalsContact O-CA 3.28Å; V447-V476 WeakPolarHBondContact O-CA 3.44Å; Y449-V476 HydrophobicContact CD1-CG1 3.86Å; Y449-V476 HydrophobicContact CE1-CG1 3.74Å; F458-V476 HydrophobicContact CB-CG1 3.99Å; F458-V476 HydrophobicContact CD1-CG2 4.28Å; F458-V476 HydrophobicContact CD2-CG1 3.78Å; F458-V476 HydrophobicContact CD2-CG2 4.2Å; F458-V476 HydrophobicContact CE1-CG2 4.45Å; F458-V476 HydrophobicContact CE2-CG1 4.48Å; F458-V476 HydrophobicContact CE2-CG2 4.35Å; F458-V476 HydrophobicContact CG-CG1 4.03Å; F458-V476 HydrophobicContact CG-CG2 4.18Å; F458-V476 HydrophobicContact CZ-CG2 4.49Å; H465-V476 HydrophobicContact CB-CG2 3.84Å; H465-V476 WeakPolarHBondContact CD2-CG2 3.38Å; H465-V476 VanDerWaalsContact CG-CG2 3.47Å; F474-V476 HydrophobicContact CD2-CG2 3.67Å; F474-V476 HydrophobicContact CE2-CG2 3.5Å
477	F	96.6	Very high	88.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.5	178.4	-56.9	-90.3	0	0	0	109.7	W177 Q178 A179 L313 L316 F319 V447 F448 Y449 D475 I480	W177-F477 HydrophobicContact CE3-CB 3.89Å; W177-F477 HydrophobicContact CE3-CD1 4.14Å; W177-F477 HydrophobicContact CE3-CG 4.25Å; W177-F477 HydrophobicContact CZ3-CB 4Å; W177-F477 AromaticContact CZ3-CD1 3.86Å; W177-F477 HydrophobicContact CZ3-CD1 3.86Å; W177-F477 AromaticContact CZ3-CG 3.95Å; W177-F477 HydrophobicContact CZ3-CG 3.95Å; Q178-F477 CarbonylContact O-C 3.6Å; Q178-F477 WeakPolarHBondContact O-CA 3.33Å; A179-F477 HydrophobicContact CB-CD1 4Å; A179-F477 HydrophobicContact CB-CE1 3.87Å; L313-F477 HydrophobicContact CD2-CE1 3.96Å; L313-F477 HydrophobicContact CD2-CZ 3.68Å; L316-F477 HydrophobicContact CD2-CD1 3.76Å; L316-F477 HydrophobicContact CD2-CE1 3.72Å; F319-F477 HydrophobicContact CE2-CD1 4.01Å; F319-F477 AromaticContact CE2-CE1 3.48Å; F319-F477 HydrophobicContact CE2-CE1 3.48Å; F319-F477 VanDerWaalsContact CE2-CE1 3.48Å; F319-F477 HydrophobicContact CE2-CE2 4.45Å; F319-F477 AromaticContact CE2-CZ 3.74Å; F319-F477 HydrophobicContact CE2-CZ 3.74Å; F319-F477 HydrophobicContact CZ-CD1 4.21Å; F319-F477 HydrophobicContact CZ-CD2 4.29Å; F319-F477 AromaticContact CZ-CE1 3.7Å; F319-F477 HydrophobicContact CZ-CE1 3.7Å; F319-F477 AromaticContact CZ-CE2 3.81Å; F319-F477 HydrophobicContact CZ-CE2 3.81Å; F319-F477 HydrophobicContact CZ-CG 4.5Å; F319-F477 AromaticContact CZ-CZ 3.48Å; F319-F477 HydrophobicContact CZ-CZ 3.48Å; F319-F477 VanDerWaalsContact CZ-CZ 3.48Å; V447-F477 PolarHBondContact O-N 3.4Å; F448-F477 CarbonylContact C-O 3.53Å; F448-F477 WeakPolarHBondContact CA-O 3Å; F448-F477 HydrophobicContact CD1-CB 3.7Å; F448-F477 AromaticContact CD1-CD2 3.83Å; F448-F477 HydrophobicContact CD1-CD2 3.83Å; F448-F477 AromaticContact CD1-CG 3.98Å; F448-F477 HydrophobicContact CD1-CG 3.98Å; F448-F477 HydrophobicContact CE1-CB 4.06Å; F448-F477 AromaticContact CE1-CD2 3.45Å; F448-F477 HydrophobicContact CE1-CD2 3.45Å; F448-F477 VanDerWaalsContact CE1-CD2 3.45Å; F448-F477 HydrophobicContact CE1-CE2 4.1Å; F448-F477 AromaticContact CE1-CG 3.81Å; F448-F477 HydrophobicContact CE1-CG 3.81Å; F448-F477 AromaticContact CZ-CD2 3.89Å; F448-F477 HydrophobicContact CZ-CD2 3.89Å; F448-F477 HydrophobicContact CZ-CE2 4.21Å; Y449-F477 WeakPolarHBondContact CD1-O 3.26Å; Y449-F477 PolarHBondContact N-O 3.14Å; D475-F477 HydrophobicContact CB-CE2 3.72Å; D475-F477 HydrophobicContact CB-CZ 4Å; F477-I480 HydrophobicContact CB-CD1 4.41Å
478	R	95.3	Very high	89.3	Confident	31 Å²	31	42.3 Å²	42.3	12%	0.117	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	156.7	-177.9	71.5	174.9	176.8	-165.8	-10.5	111.8	W177 Q178 V180 Y449	W177-R478 CarbonylContact C-O 3.58Å; W177-R478 WeakPolarHBondContact CA-O 3.37Å; W177-R478 WeakPolarHBondContact CB-O 3.46Å; Q178-R478 HydrophobicContact CG-CG 3.51Å; Q178-R478 PolarHBondContact N-O 2.99Å; Q178-R478 VanDerWaalsContact NE2-NH2 3.16Å; Q178-R478 PolarHBondContact O-N 3.48Å; V180-R478 HydrophobicContact CG2-CB 3.77Å; V180-R478 HydrophobicContact CG2-CG 3.79Å; Y449-R478 HydrophobicContact CD1-CB 4.14Å; Y449-R478 HydrophobicContact CD2-CB 4.19Å; Y449-R478 HydrophobicContact CE1-CB 3.47Å; Y449-R478 VanDerWaalsContact CE1-CB 3.47Å; Y449-R478 HydrophobicContact CE2-CB 3.53Å; Y449-R478 HydrophobicContact CG-CB 4.47Å; Y449-R478 CarbonylContact O-C 3.45Å; Y449-R478 WeakPolarHBondContact O-CA 3.17Å; Y449-R478 VanDerWaalsContact OH-CB 3.23Å; Y449-R478 WeakPolarHBondContact OH-CB 3.44Å; Y449-R478 WeakPolarHBondContact OH-CD 2.99Å
479	G	94	Very high	89.4	Confident	10 Å²	10	41.1 Å²	41.1	10%	0.103	21%	0.205	C	C	.	.			trans	91.1	16.8	174.1	0	0	0	0	0	113.9	Y449 G450 M481	Y449-G479 PolarHBondContact O-N 2.87Å; G450-G479 WeakPolarHBondContact O-CA 3.06Å; G450-G479 PolarHBondContact O-N 3.05Å; G450-G479 VanDerWaalsContact O-N 3.11Å; G479-M481 PolarHBondContact O-N 2.96Å
480	I	95.3	Very high	89.4	Confident	3 Å²	3	46 Å²	46	2%	0.015	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	115.2	-177.4	-40.6	-40.3	0	0	0	108.7	W177 I327 M331 F448 Y449 G450 F477 E482	W177-I480 HydrophobicContact CB-CD1 3.25Å; W177-I480 HydrophobicContact CD2-CD1 3.33Å; W177-I480 HydrophobicContact CE3-CD1 3.15Å; W177-I480 HydrophobicContact CG-CD1 3.45Å; W177-I480 VanDerWaalsContact CG-CD1 3.45Å; W177-I480 HydrophobicContact CZ3-CD1 4Å; I327-I480 HydrophobicContact CG2-CG1 4.45Å; I327-I480 HydrophobicContact CG2-CG2 3.79Å; M331-I480 HydrophobicContact CB-CB 4.49Å; M331-I480 HydrophobicContact CB-CG2 3.78Å; M331-I480 HydrophobicContact CE-CB 3.82Å; M331-I480 HydrophobicContact CE-CG1 4.15Å; M331-I480 HydrophobicContact CE-CG2 4.31Å; M331-I480 HydrophobicContact CG-CB 4.13Å; M331-I480 HydrophobicContact CG-CG2 3.87Å; F448-I480 HydrophobicContact CB-CG1 3.93Å; F448-I480 HydrophobicContact CD1-CD1 4.34Å; F448-I480 HydrophobicContact CD1-CG1 4.31Å; Y449-I480 PolarHBondContact O-N 3.19Å; G450-I480 VanDerWaalsContact CA-O 3.3Å; G450-I480 WeakPolarHBondContact CA-O 3.41Å; F477-I480 HydrophobicContact CB-CD1 4.41Å; I480-E482 PolarHBondContact O-N 3.5Å
481	M	94.8	Very high	88.8	Confident	44 Å²	44	48.9 Å²	48.9	22%	0.217	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	48.6	-175.9	-57.7	179.7	75.5	0	0	110.8	M331 S332 I335 G479 A483 E484 C485	M331-M481 HydrophobicContact CB-SD 3.97Å; M331-M481 HydrophobicContact CG-CB 4.12Å; M331-M481 HydrophobicContact CG-CG 4.25Å; M331-M481 HydrophobicContact CG-SD 4.05Å; S332-M481 WeakPolarHBondContact OG-CE 3.34Å; S332-M481 PolarHBondContact OG-SD 2.86Å; S332-M481 VanDerWaalsContact OG-SD 3.38Å; I335-M481 HydrophobicContact CD1-CB 4.08Å; I335-M481 HydrophobicContact CD1-CE 4.05Å; I335-M481 HydrophobicContact CD1-SD 4.08Å; G479-M481 PolarHBondContact O-N 2.96Å; M481-A483 VanDerWaalsContact C-N 3.33Å; M481-A483 PolarHBondContact O-N 3.49Å; M481-E484 WeakPolarHBondContact CA-OE2 3.37Å; M481-E484 HydrophobicContact CB-CB 4.46Å; M481-E484 WeakPolarHBondContact CB-OE2 3.46Å; M481-E484 HydrophobicContact CE-CG 4.3Å; M481-E484 PolarHBondContact O-N 3.44Å; M481-C485 VanDerWaalsContact O-CB 3.31Å; M481-C485 WeakPolarHBondContact O-CB 3.41Å; M481-C485 PolarHBondContact O-N 3.38Å; M481-C485 PolarHBondContact O-SG 3.49Å
482	E	93.9	Very high	87.9	Confident	38 Å²	38	45.9 Å²	45.9	18%	0.178	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-41.2	-168.3	-176.4	164.7	-168	0	0	112	H451 I480 C485 R486	H451-E482 HydrophobicContact CB-CG 3.94Å; I480-E482 PolarHBondContact O-N 3.5Å; E482-C485 PolarHBondContact O-N 2.78Å; E482-R486 HydrophobicContact CG-CG 4.37Å; E482-R486 WeakPolarHBondContact O-CG 3.33Å; E482-R486 PolarHBondContact O-N 3.04Å; E482-R486 IonicContact OE1-CZ 2.76Å; E482-R486 VanDerWaalsContact OE1-CZ 3.27Å; E482-R486 IonicContact OE1-NE 3.4Å; E482-R486 PolarHBondContact OE1-NE 3.49Å; E482-R486 VanDerWaalsContact OE1-NE 3.12Å; E482-R486 IonicContact OE1-NH2 3.21Å; E482-R486 PolarHBondContact OE1-NH2 3.36Å
483	A	92.1	Very high	86.6	Confident	61 Å²	61	52.6 Å²	52.6	50%	0.504	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-50.1	179.6	0	0	0	0	0	111.3	M481 C485 R486 M487	M481-A483 VanDerWaalsContact C-N 3.33Å; M481-A483 PolarHBondContact O-N 3.49Å; A483-C485 VanDerWaalsContact C-N 3.3Å; A483-C485 PolarHBondContact O-N 3.15Å; A483-R486 PolarHBondContact O-N 3.47Å; A483-M487 WeakPolarHBondContact O-CG 3.26Å; A483-M487 PolarHBondContact O-N 3.36Å
484	E	93.6	Very high	84.9	Confident	81 Å²	81	50.5 Å²	50.5	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-39.1	178.4	-59.4	91.7	150	0	0	111.6	I335 M481	I335-E484 HydrophobicContact CD1-CB 3.85Å; M481-E484 WeakPolarHBondContact CA-OE2 3.37Å; M481-E484 HydrophobicContact CB-CB 4.46Å; M481-E484 WeakPolarHBondContact CB-OE2 3.46Å; M481-E484 HydrophobicContact CE-CG 4.3Å; M481-E484 PolarHBondContact O-N 3.44Å
485	C	93.6	Very high	82.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-40.3	175.1	-75.1	0	0	0	0	112.9	T428 M481 E482 A483 L488	T428-C485 WeakPolarHBondContact O-CB 3.49Å; M481-C485 VanDerWaalsContact O-CB 3.31Å; M481-C485 WeakPolarHBondContact O-CB 3.41Å; M481-C485 PolarHBondContact O-N 3.38Å; M481-C485 PolarHBondContact O-SG 3.49Å; E482-C485 PolarHBondContact O-N 2.78Å; A483-C485 VanDerWaalsContact C-N 3.3Å; A483-C485 PolarHBondContact O-N 3.15Å; C485-L488 WeakPolarHBondContact O-CB 3.43Å
486	R	90.8	Very high	80.7	Confident	125 Å²	125	55.8 Å²	55.8	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-68.4	-41.8	177.3	-74.3	-177.8	-173.3	-169.1	6.4	111.8	H451 E482 A483 L488 N489	H451-R486 HydrophobicContact CB-CG 3.52Å; E482-R486 HydrophobicContact CG-CG 4.37Å; E482-R486 WeakPolarHBondContact O-CG 3.33Å; E482-R486 PolarHBondContact O-N 3.04Å; E482-R486 IonicContact OE1-CZ 2.76Å; E482-R486 VanDerWaalsContact OE1-CZ 3.27Å; E482-R486 IonicContact OE1-NE 3.4Å; E482-R486 PolarHBondContact OE1-NE 3.49Å; E482-R486 VanDerWaalsContact OE1-NE 3.12Å; E482-R486 IonicContact OE1-NH2 3.21Å; E482-R486 PolarHBondContact OE1-NH2 3.36Å; A483-R486 PolarHBondContact O-N 3.47Å; R486-L488 PolarHBondContact O-N 3.06Å; R486-L488 VanDerWaalsContact O-N 3.09Å; R486-N489 PolarHBondContact O-N 3.34Å
487	M	90	Very high	78.5	Confident	111 Å²	111	62.2 Å²	62.2	55%	0.547	33%	0.327	S	S	.	.	H	α-helix	trans	-60.2	-23.8	-178.5	-75.1	-156.5	-62.9	0	0	113.8	A483 N489 E490 S491	A483-M487 WeakPolarHBondContact O-CG 3.26Å; A483-M487 PolarHBondContact O-N 3.36Å; M487-N489 PolarHBondContact O-N 3.16Å; M487-E490 PolarHBondContact O-N 3.39Å; M487-S491 WeakPolarHBondContact O-CB 3.31Å; M487-S491 PolarHBondContact O-N 3.18Å; M487-S491 PolarHBondContact O-OG 2.76Å
488	L	87.6	Confident	76.2	Confident	10 Å²	10	65.2 Å²	65.2	5%	0.052	36%	0.358	C	S	.	.	H	α-helix	trans	-55.1	-32.3	176.8	-74.9	171.2	0	0	0	113.8	I335 A338 K339 A347 T428 C485 R486	I335-L488 HydrophobicContact CG1-CD1 4.42Å; I335-L488 HydrophobicContact CG2-CD1 4.35Å; I335-L488 HydrophobicContact CG2-CD2 4.14Å; I335-L488 HydrophobicContact CG2-CG 4.47Å; A338-L488 HydrophobicContact CB-CD1 3.74Å; A338-L488 HydrophobicContact CB-CD2 4.23Å; K339-L488 HydrophobicContact CG-CD2 3.68Å; A347-L488 HydrophobicContact CB-CB 4.06Å; T428-L488 HydrophobicContact CG2-CD1 3.85Å; C485-L488 WeakPolarHBondContact O-CB 3.43Å; R486-L488 PolarHBondContact O-N 3.06Å; R486-L488 VanDerWaalsContact O-N 3.09Å
489	N	75.1	Confident	73.9	Confident	25 Å²	25	70.4 Å²	70.4	13%	0.134	39%	0.388	C	S	.	.	H	α-helix	trans	-104.7	-27.1	-177.8	-71.2	-41.1	0	0	0	113.2	E346 A347 R486 M487 K492 R493	E346-N489 VanDerWaalsContact CG-OD1 3.28Å; E346-N489 WeakPolarHBondContact CG-OD1 3.15Å; A347-N489 PolarHBondContact N-OD1 3.09Å; R486-N489 PolarHBondContact O-N 3.34Å; M487-N489 PolarHBondContact O-N 3.16Å; N489-K492 PolarHBondContact O-N 3.33Å; N489-R493 PolarHBondContact O-N 3Å
490	E	73	Confident	71.5	Confident	118 Å²	118	78.4 Å²	78.4	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-65.1	-45.7	175.6	-69.4	173.4	175.2	0	0	111.6	M487 K492 R493 A494	M487-E490 PolarHBondContact O-N 3.39Å; E490-K492 PolarHBondContact O-N 3.11Å; E490-R493 PolarHBondContact O-N 2.92Å; E490-R493 VanDerWaalsContact O-N 3.1Å; E490-A494 PolarHBondContact O-N 3.06Å
491	S	60.1	Low	68.6	Low	76 Å²	76	88.4 Å²	88.4	53%	0.531	47%	0.473	S	S	.	.	H	α-helix	trans	-57.2	-33	176.5	48	0	0	0	0	112.9	M487 S495	M487-S491 WeakPolarHBondContact O-CB 3.31Å; M487-S491 PolarHBondContact O-N 3.18Å; M487-S491 PolarHBondContact O-OG 2.76Å; S491-S495 PolarHBondContact O-N 3.01Å; S491-S495 PolarHBondContact O-OG 2.96Å
492	K	59.6	Low	67.3	Low	41 Å²	41	90.6 Å²	90.6	18%	0.178	49%	0.486	C	S	.	.	H	α-helix	trans	-75.4	-38.8	176.2	-73	-171.3	173.6	-171.2	0	113.3	V341 N342 M345 A347 N489 E490 S495 S496	V341-K492 PolarHBondContact O-NZ 2.79Å; N342-K492 PolarHBondContact O-NZ 2.95Å; N342-K492 VanDerWaalsContact O-NZ 3.09Å; M345-K492 PolarHBondContact O-NZ 3.07Å; A347-K492 HydrophobicContact CB-CD 4.38Å; N489-K492 PolarHBondContact O-N 3.33Å; E490-K492 PolarHBondContact O-N 3.11Å; K492-S495 WeakPolarHBondContact CA-OG 3.47Å; K492-S495 PolarHBondContact O-N 3.45Å; K492-S495 PolarHBondContact O-OG 3.49Å; K492-S496 PolarHBondContact O-N 2.97Å; K492-S496 VanDerWaalsContact O-N 3.16Å; K492-S496 PolarHBondContact O-OG 3.17Å
493	R	56.8	Low	65.9	Low	185 Å²	185	93.4 Å²	93.4	70%	0.698	50%	0.502	S	S	*	.	H	α-helix	trans	-61.9	-45.4	177.9	-77.4	-177.2	178.7	175.9	-0.7	111.3	N489 E490 S495 S496 E497	N489-R493 PolarHBondContact O-N 3Å; E490-R493 PolarHBondContact O-N 2.92Å; E490-R493 VanDerWaalsContact O-N 3.1Å; R493-S495 VanDerWaalsContact C-N 3.33Å; R493-S495 PolarHBondContact O-N 3.39Å; R493-S496 WeakPolarHBondContact CA-OG 3.45Å; R493-S496 PolarHBondContact O-N 3.17Å; R493-S496 PolarHBondContact O-OG 3.31Å; R493-E497 PolarHBondContact O-N 2.73Å
494	A	54.3	Low	64.4	Low	68 Å²	68	95.2 Å²	95.2	56%	0.562	50%	0.502	S	S	*	.	H	α-helix	trans	-58.1	-42.7	176.7	0	0	0	0	0	112.4	E490 S496 E497 G498	E490-A494 PolarHBondContact O-N 3.06Å; A494-S496 VanDerWaalsContact C-N 3.3Å; A494-S496 PolarHBondContact O-N 3Å; A494-E497 PolarHBondContact O-N 3.24Å; A494-G498 PolarHBondContact O-N 3.23Å
495	S	51.3	Low	62.7	Low	71 Å²	71	96 Å²	96	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-70.2	-20.2	176.8	47.7	0	0	0	0	114.8	S491 K492 R493	S491-S495 PolarHBondContact O-N 3.01Å; S491-S495 PolarHBondContact O-OG 2.96Å; K492-S495 WeakPolarHBondContact CA-OG 3.47Å; K492-S495 PolarHBondContact O-N 3.45Å; K492-S495 PolarHBondContact O-OG 3.49Å; R493-S495 VanDerWaalsContact C-N 3.33Å; R493-S495 PolarHBondContact O-N 3.39Å
496	S	49.4	Very low	60.8	Low	71 Å²	71	102 Å²	102	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-88.1	-20.8	176.9	59.4	0	0	0	0	114.1	K492 R493 A494	K492-S496 PolarHBondContact O-N 2.97Å; K492-S496 VanDerWaalsContact O-N 3.16Å; K492-S496 PolarHBondContact O-OG 3.17Å; R493-S496 WeakPolarHBondContact CA-OG 3.45Å; R493-S496 PolarHBondContact O-N 3.17Å; R493-S496 PolarHBondContact O-OG 3.31Å; A494-S496 VanDerWaalsContact C-N 3.3Å; A494-S496 PolarHBondContact O-N 3Å
497	E	51.4	Low	58.8	Low	138 Å²	138	100.5 Å²	100.5	65%	0.645	55%	0.546	S	S	*	.	H	α-helix	trans	-84.3	-36.5	176.7	-74.6	177.3	169	0	0	111.8	R493 A494 N499 K500	R493-E497 PolarHBondContact O-N 2.73Å; A494-E497 PolarHBondContact O-N 3.24Å; E497-N499 PolarHBondContact O-N 3.37Å; E497-K500 PolarHBondContact O-N 2.82Å
498	G	48.2	Very low	56.6	Low	62 Å²	62	99.7 Å²	99.7	64%	0.639	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	5	176.3	0	0	0	0	0	116	A494	A494-G498 PolarHBondContact O-N 3.23Å
499	N	46.6	Very low	54.2	Low	141 Å²	141	106.6 Å²	106.6	75%	0.754	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	15.5	177.9	-142.9	22.8	0	0	0	111.8	E497	E497-N499 PolarHBondContact O-N 3.37Å
500	K	45	Very low	52.4	Low	178 Å²	178	113.4 Å²	113.4	77%	0.774	62%	0.622	S	S	*	*			trans	-108.7	0.2	177.2	-81	-171.3	176.3	-179.8	0	114.2	E497	E497-K500 PolarHBondContact O-N 2.82Å
501	D	33.6	Very low	50.6	Low	212 Å²	212	113 Å²	113	100%	1.134	63%	0.628	S	S	*	*			trans	-96.9	0	167.2	-61.2	-31.7	0	0	0	109.2

Retrieved 501 of 501 residues in 285.4 ms (Link to these results)

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