A0A077Z5L1_TRITR Loading...

PIP49 C domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z5L1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 466 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	39.1	Very low	29.7	Very low	234 Å²	234	164.5 Å²	164.5	100%	1.153	82%	0.818	S	S	*	*				0	122.8	0	-86.9	175.2	163.6	0	0	109.3
2	H	30.5	Very low	29.9	Very low	176 Å²	176	159.8 Å²	159.8	82%	0.815	81%	0.813	S	S	*	*			trans	51.5	119.3	144.8	-73.5	-62	0	0	0	122.9
3	R	34.4	Very low	29.8	Very low	231 Å²	231	160.6 Å²	160.6	87%	0.872	82%	0.819	S	S	*	*				146.7	107	112.2	-99.3	172.9	-178.4	-179	0.6	107.5
4	V	27.8	Very low	30.2	Very low	124 Å²	124	159.5 Å²	159.5	75%	0.752	82%	0.824	S	S	*	*				30.3	110.6	73.8	-170.5	0	0	0	0	114.4
5	S	30.7	Very low	30.3	Very low	104 Å²	104	162.6 Å²	162.6	73%	0.727	83%	0.829	S	S	*	*			trans	169.2	112.2	131.7	-75.1	0	0	0	0	107.7
6	R	26.9	Very low	30.4	Very low	210 Å²	210	160.1 Å²	160.1	79%	0.792	83%	0.826	S	S	*	*				72.9	145.1	85	-84.5	-166.4	179.7	177.2	0.6	114.5
7	F	28.2	Very low	30.7	Very low	168 Å²	168	158.1 Å²	158.1	74%	0.737	83%	0.828	S	S	*	*			trans	87.6	137.5	162.8	-69.7	-83.5	0	0	0	116.2
8	T	26	Very low	31	Very low	99 Å²	99	154.6 Å²	154.6	61%	0.607	83%	0.826	S	S	*	*			cis	-179.4	156.4	-15.9	16.6	0	0	0	0	107.2
9	F	24.8	Very low	31.6	Very low	200 Å²	200	154.4 Å²	154.4	88%	0.877	82%	0.823	S	S	*	*			trans	50.8	130.7	148.7	-82.9	-91.7	0	0	0	121.9
10	G	31.6	Very low	32	Very low	77 Å²	77	154.7 Å²	154.7	79%	0.794	82%	0.824	S	S	*	*			trans	175	91.1	162	0	0	0	0	0	112.8
11	E	26.6	Very low	32.3	Very low	187 Å²	187	151.9 Å²	151.9	87%	0.874	81%	0.813	S	S	*	*			trans	-65	139.8	167.5	-62.3	169.6	139	0	0	111.2
12	S	32.9	Very low	32.9	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	79%	0.787	S	S	*	*				170	114.2	118	78.8	0	0	0	0	112.1
13	L	28.1	Very low	33.8	Very low	170 Å²	170	141.9 Å²	141.9	89%	0.89	78%	0.779	S	S	*	*			trans	0.7	114.1	134.6	-79.2	128.9	0	0	0	118.1
14	T	35.1	Very low	34.7	Very low	145 Å²	145	134 Å²	134	89%	0.89	76%	0.763	S	S	*	*			trans	-153	143.2	132.3	43.8	0	0	0	0	110.5
15	K	31.5	Very low	36	Very low	206 Å²	206	132.1 Å²	132.1	90%	0.896	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65.6	161.2	-159.7	-74.7	169.9	174.4	174.1	0	116.7
16	P	32.4	Very low	37.3	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-92.1	132.8	-173.1	35.4	-28.6	0	0	0	112.2
17	C	35.8	Very low	38.7	Very low	127 Å²	127	125.9 Å²	125.9	86%	0.858	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-93.8	116.1	156.9	-92.6	0	0	0	0	107.9	I19	C17-I19 PolarHBondContact O-N 2.89Å
18	A	35.7	Very low	40.5	Very low	95 Å²	95	123.1 Å²	123.1	79%	0.785	72%	0.721	S	S	*	*			trans	-56.1	105.7	-179.1	0	0	0	0	0	111.4	L20	A18-L20 PolarHBondContact O-N 3.23Å
19	I	42.1	Very low	42.3	Very low	150 Å²	150	123.3 Å²	123.3	77%	0.769	72%	0.717	S	S	*	*			trans	-73.4	118.1	159.8	-63.7	170.8	0	0	0	105.4	C17 T21	C17-I19 PolarHBondContact O-N 2.89Å; I19-T21 PolarHBondContact O-N 3.15Å
20	L	40.9	Very low	44.2	Very low	160 Å²	160	118.5 Å²	118.5	84%	0.838	70%	0.699	S	S	*	*			trans	-52.2	100.1	171.9	-91.7	90.5	0	0	0	109.5	A18	A18-L20 PolarHBondContact O-N 3.23Å
21	T	37.5	Very low	45.9	Very low	97 Å²	97	119.2 Å²	119.2	60%	0.595	68%	0.683	S	S	*	*			trans	-74.2	147.7	169	46.9	0	0	0	0	109.6	I19 V23	I19-T21 PolarHBondContact O-N 3.15Å; T21-V23 PolarHBondContact O-N 3.5Å
22	P	51.4	Low	47.8	Very low	94 Å²	94	113.8 Å²	113.8	61%	0.61	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	14.2	-165.1	29.9	-37.2	0	0	0	115.5	A24 V25	P22-A24 VanDerWaalsContact C-N 3.29Å; P22-A24 PolarHBondContact O-N 2.92Å; P22-V25 PolarHBondContact O-N 3.27Å
23	V	49.5	Very low	49.2	Very low	106 Å²	106	113 Å²	113	64%	0.642	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-22.3	177.7	-174	0	0	0	0	111.9	T21 P27	T21-V23 PolarHBondContact O-N 3.5Å; V23-P27 WeakPolarHBondContact O-CD 3.36Å; V23-P27 WeakPolarHBondContact O-CG 3.48Å
24	A	52.3	Low	50.5	Low	66 Å²	66	111.5 Å²	111.5	55%	0.545	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	-18.6	174.8	0	0	0	0	0	113.6	P22	P22-A24 VanDerWaalsContact C-N 3.29Å; P22-A24 PolarHBondContact O-N 2.92Å
25	V	55.6	Low	51.8	Low	84 Å²	84	110.8 Å²	110.8	51%	0.509	63%	0.625	S	S	.	*	H	α-helix	trans	-80	-35	-178	178.2	0	0	0	0	110.9	P22 L28 L29	P22-V25 PolarHBondContact O-N 3.27Å; V25-L28 PolarHBondContact O-N 2.79Å; V25-L29 HydrophobicContact CG1-CD1 3.9Å; V25-L29 WeakPolarHBondContact O-CB 3.31Å; V25-L29 PolarHBondContact O-N 2.84Å
26	I	58.2	Low	53.1	Low	115 Å²	115	109 Å²	109	59%	0.59	62%	0.617	S	S	*	*	H	α-helix	trans	-64.9	-47.4	-178.1	-60.5	168.9	0	0	0	112.2	L28 L29 M30	I26-L28 VanDerWaalsContact C-N 3.32Å; I26-L28 PolarHBondContact O-N 2.9Å; I26-L29 PolarHBondContact O-N 3.17Å; I26-M30 HydrophobicContact CG2-CG 4.46Å; I26-M30 VanDerWaalsContact O-CG 3.27Å; I26-M30 WeakPolarHBondContact O-CG 2.98Å; I26-M30 PolarHBondContact O-N 3.08Å
27	P	56.5	Low	53.9	Low	67 Å²	67	107.6 Å²	107.6	44%	0.435	60%	0.603	S	S	.	*	H	α-helix	trans	-63.2	-38.3	175.9	-19.9	30.8	0	0	0	112.1	V23 M30 I31	V23-P27 WeakPolarHBondContact O-CD 3.36Å; V23-P27 WeakPolarHBondContact O-CG 3.48Å; P27-M30 PolarHBondContact O-N 3.08Å; P27-I31 WeakPolarHBondContact O-CB 3.39Å; P27-I31 WeakPolarHBondContact O-CD1 3.48Å; P27-I31 WeakPolarHBondContact O-CG1 3.35Å; P27-I31 PolarHBondContact O-N 2.67Å
28	L	65.2	Low	54.3	Low	111 Å²	111	102.8 Å²	102.8	58%	0.581	58%	0.575	S	S	*	*	H	α-helix	trans	-66.6	-41.5	179.2	-151.6	90.1	0	0	0	111.3	V25 I26 I31 I32	V25-L28 PolarHBondContact O-N 2.79Å; I26-L28 VanDerWaalsContact C-N 3.32Å; I26-L28 PolarHBondContact O-N 2.9Å; L28-I31 PolarHBondContact O-N 3.44Å; L28-I32 HydrophobicContact CD2-CD1 4.25Å; L28-I32 HydrophobicContact CG-CD1 4.33Å; L28-I32 WeakPolarHBondContact O-CB 3.36Å; L28-I32 WeakPolarHBondContact O-CD1 3.4Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.49Å
29	L	65.2	Low	55.1	Low	103 Å²	103	103.3 Å²	103.3	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-64.8	-38.6	174.8	-108.8	152	0	0	0	112	V25 I26 I32 L33	V25-L29 HydrophobicContact CG1-CD1 3.9Å; V25-L29 WeakPolarHBondContact O-CB 3.31Å; V25-L29 PolarHBondContact O-N 2.84Å; I26-L29 PolarHBondContact O-N 3.17Å; L29-I32 PolarHBondContact O-N 3.34Å; L29-L33 VanDerWaalsContact O-CB 3.31Å; L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 PolarHBondContact O-N 3.03Å
30	M	63.8	Low	55.3	Low	99 Å²	99	101.8 Å²	101.8	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-68.2	-41	176.2	-69.6	-64.5	-68.6	0	0	112	I26 P27 L33 E34	I26-M30 HydrophobicContact CG2-CG 4.46Å; I26-M30 VanDerWaalsContact O-CG 3.27Å; I26-M30 WeakPolarHBondContact O-CG 2.98Å; I26-M30 PolarHBondContact O-N 3.08Å; P27-M30 PolarHBondContact O-N 3.08Å; M30-L33 WeakPolarHBondContact O-CB 3.39Å; M30-L33 PolarHBondContact O-N 3.07Å; M30-E34 WeakPolarHBondContact O-CB 3.22Å; M30-E34 WeakPolarHBondContact O-CG 3.45Å; M30-E34 PolarHBondContact O-N 3.38Å
31	I	68	Low	55.5	Low	91 Å²	91	99.6 Å²	99.6	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-65.8	-40.3	175.2	-67.6	163.6	0	0	0	110.7	P27 L28 L33 E34 L35	P27-I31 WeakPolarHBondContact O-CB 3.39Å; P27-I31 WeakPolarHBondContact O-CD1 3.48Å; P27-I31 WeakPolarHBondContact O-CG1 3.35Å; P27-I31 PolarHBondContact O-N 2.67Å; L28-I31 PolarHBondContact O-N 3.44Å; I31-L33 VanDerWaalsContact C-N 3.34Å; I31-E34 PolarHBondContact O-N 2.92Å; I31-L35 HydrophobicContact CG2-CD1 3.76Å; I31-L35 HydrophobicContact CG2-CG 4.39Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.26Å; I31-L35 WeakPolarHBondContact O-CG 3.18Å; I31-L35 PolarHBondContact O-N 3Å
32	I	66.8	Low	55.5	Low	73 Å²	73	103.8 Å²	103.8	37%	0.374	56%	0.563	S	S	.	*	H	α-helix	trans	-63.4	-42.9	172.7	-70.5	167.7	0	0	0	109.7	L28 L29 E34 L35 F36	L28-I32 HydrophobicContact CD2-CD1 4.25Å; L28-I32 HydrophobicContact CG-CD1 4.33Å; L28-I32 WeakPolarHBondContact O-CB 3.36Å; L28-I32 WeakPolarHBondContact O-CD1 3.4Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.49Å; L29-I32 PolarHBondContact O-N 3.34Å; I32-E34 VanDerWaalsContact C-N 3.32Å; I32-E34 PolarHBondContact O-N 2.74Å; I32-L35 PolarHBondContact O-N 2.81Å; I32-F36 HydrophobicContact CB-CD2 4.41Å; I32-F36 HydrophobicContact CG2-CD2 3.5Å; I32-F36 VanDerWaalsContact CG2-CD2 3.5Å; I32-F36 HydrophobicContact CG2-CE2 3.8Å; I32-F36 WeakPolarHBondContact O-CB 3.41Å; I32-F36 VanDerWaalsContact O-CD2 3.26Å; I32-F36 WeakPolarHBondContact O-CD2 3.44Å; I32-F36 PolarHBondContact O-N 3.45Å
33	L	61	Low	54.8	Low	91 Å²	91	108.6 Å²	108.6	48%	0.476	57%	0.569	S	S	.	*	H	α-helix	trans	-62.8	-39.2	177.5	-150	82.6	0	0	0	111.7	L29 M30 I31 L37	L29-L33 VanDerWaalsContact O-CB 3.31Å; L29-L33 WeakPolarHBondContact O-CB 3.35Å; L29-L33 PolarHBondContact O-N 3.03Å; M30-L33 WeakPolarHBondContact O-CB 3.39Å; M30-L33 PolarHBondContact O-N 3.07Å; I31-L33 VanDerWaalsContact C-N 3.34Å; L33-L37 HydrophobicContact CD1-CD1 4.21Å; L33-L37 HydrophobicContact CD2-CD1 4.31Å; L33-L37 HydrophobicContact CG-CD1 3.83Å; L33-L37 WeakPolarHBondContact O-CA 3.39Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 WeakPolarHBondContact O-CG 3.32Å; L33-L37 PolarHBondContact O-N 3.11Å
34	E	56	Low	54.6	Low	139 Å²	139	105.5 Å²	105.5	65%	0.65	55%	0.554	S	S	*	*	H	α-helix	trans	-71	-33.5	176.4	-74.4	175.5	-176.4	0	0	113.1	M30 I31 I32 G38	M30-E34 WeakPolarHBondContact O-CB 3.22Å; M30-E34 WeakPolarHBondContact O-CG 3.45Å; M30-E34 PolarHBondContact O-N 3.38Å; I31-E34 PolarHBondContact O-N 2.92Å; I32-E34 VanDerWaalsContact C-N 3.32Å; I32-E34 PolarHBondContact O-N 2.74Å; E34-G38 PolarHBondContact O-N 2.83Å
35	L	62.3	Low	53.7	Low	131 Å²	131	103.9 Å²	103.9	69%	0.686	54%	0.544	S	S	*	.	H	α-helix	trans	-79.2	-37.1	177.4	-73.1	168.6	0	0	0	112.8	I31 I32	I31-L35 HydrophobicContact CG2-CD1 3.76Å; I31-L35 HydrophobicContact CG2-CG 4.39Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.26Å; I31-L35 WeakPolarHBondContact O-CG 3.18Å; I31-L35 PolarHBondContact O-N 3Å; I32-L35 PolarHBondContact O-N 2.81Å
36	F	58.7	Low	52.8	Low	168 Å²	168	105.7 Å²	105.7	74%	0.737	55%	0.547	S	S	*	.	H	α-helix	trans	-87	-27	180	-78.5	-85.6	0	0	0	113	I32 G38	I32-F36 HydrophobicContact CB-CD2 4.41Å; I32-F36 HydrophobicContact CG2-CD2 3.5Å; I32-F36 VanDerWaalsContact CG2-CD2 3.5Å; I32-F36 HydrophobicContact CG2-CE2 3.8Å; I32-F36 WeakPolarHBondContact O-CB 3.41Å; I32-F36 VanDerWaalsContact O-CD2 3.26Å; I32-F36 WeakPolarHBondContact O-CD2 3.44Å; I32-F36 PolarHBondContact O-N 3.45Å; F36-G38 VanDerWaalsContact C-N 3.27Å
37	L	50.1	Low	51.9	Low	93 Å²	93	107.2 Å²	107.2	49%	0.487	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.8	43.8	166.7	-54.4	174.6	0	0	0	110.4	L33 L41	L33-L37 HydrophobicContact CD1-CD1 4.21Å; L33-L37 HydrophobicContact CD2-CD1 4.31Å; L33-L37 HydrophobicContact CG-CD1 3.83Å; L33-L37 WeakPolarHBondContact O-CA 3.39Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 WeakPolarHBondContact O-CG 3.32Å; L33-L37 PolarHBondContact O-N 3.11Å; L37-L41 HydrophobicContact CD2-CD1 4.3Å
38	G	44.4	Very low	51.3	Low	26 Å²	26	110.1 Å²	110.1	27%	0.268	56%	0.559	S	S	.	*			trans	-56.1	173.7	163.1	0	0	0	0	0	112.4	E34 F36 T40	E34-G38 PolarHBondContact O-N 2.83Å; F36-G38 VanDerWaalsContact C-N 3.27Å; G38-T40 VanDerWaalsContact C-N 3.25Å; G38-T40 PolarHBondContact O-N 3.35Å; G38-T40 PolarHBondContact O-OG1 3.37Å
39	P	50.7	Low	49.8	Very low	106 Å²	106	108.9 Å²	108.9	69%	0.688	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn		-77.8	24	-119.8	32.6	-38.8	0	0	0	116.5
40	T	46.7	Very low	48.4	Very low	118 Å²	118	106.8 Å²	106.8	72%	0.724	55%	0.554	S	S	*	*	H	α-helix	trans	-79.2	-39.4	177.4	49.9	0	0	0	0	112.1	G38	G38-T40 VanDerWaalsContact C-N 3.25Å; G38-T40 PolarHBondContact O-N 3.35Å; G38-T40 PolarHBondContact O-OG1 3.37Å
41	L	45.4	Very low	47.5	Very low	114 Å²	114	106.4 Å²	106.4	60%	0.597	55%	0.549	S	S	*	.	H	α-helix	trans	-78.4	-34.2	176.2	-79.4	164	0	0	0	112.9	L37 R43 A44 G45	L37-L41 HydrophobicContact CD2-CD1 4.3Å; L41-R43 VanDerWaalsContact C-N 3.29Å; L41-R43 PolarHBondContact O-N 3.35Å; L41-A44 PolarHBondContact O-N 2.78Å; L41-G45 PolarHBondContact O-N 2.78Å; L41-G45 VanDerWaalsContact O-N 3.14Å
42	Y	37.9	Very low	46.4	Very low	184 Å²	184	108.4 Å²	108.4	72%	0.722	56%	0.56	S	S	*	*	H	α-helix	trans	-65.3	-32.4	179.1	-147.1	-94.4	0	0	0	112.3
43	R	36.7	Very low	45.5	Very low	196 Å²	196	116 Å²	116	74%	0.74	58%	0.584	S	S	*	*	H	α-helix	trans	-76.2	-36.4	175.8	-127.7	175.3	-170.6	171.6	2.5	113	L41 Q47	L41-R43 VanDerWaalsContact C-N 3.29Å; L41-R43 PolarHBondContact O-N 3.35Å; R43-Q47 PolarHBondContact O-N 3.25Å
44	A	44.6	Very low	45.5	Very low	40 Å²	40	119.3 Å²	119.3	33%	0.331	59%	0.591	S	S	.	*	H	α-helix	trans	-68.6	-41.4	179.5	0	0	0	0	0	112.2	L41 Q48	L41-A44 PolarHBondContact O-N 2.78Å; A44-Q48 WeakPolarHBondContact O-CG 3.25Å; A44-Q48 PolarHBondContact O-N 2.77Å
45	G	33.9	Very low	46.3	Very low	33 Å²	33	116.6 Å²	116.6	34%	0.34	59%	0.587	S	S	.	*	H	α-helix	trans	-68.8	-36.8	180	0	0	0	0	0	114.1	L41 Q48 T49	L41-G45 PolarHBondContact O-N 2.78Å; L41-G45 VanDerWaalsContact O-N 3.14Å; G45-Q48 PolarHBondContact O-N 2.99Å; G45-T49 WeakPolarHBondContact O-CG2 3.32Å; G45-T49 PolarHBondContact O-N 3.39Å; G45-T49 PolarHBondContact O-OG1 3.06Å
46	H	35.8	Very low	47.3	Very low	121 Å²	121	111.9 Å²	111.9	56%	0.56	56%	0.562	S	S	*	*	H	α-helix	trans	-77.2	-33.8	-179.5	-120.3	-58	0	0	0	113.2	Q48 A50	H46-Q48 VanDerWaalsContact C-N 3.31Å; H46-A50 WeakPolarHBondContact O-CB 3.2Å; H46-A50 PolarHBondContact O-N 2.99Å; H46-A50 VanDerWaalsContact O-N 3.1Å
47	Q	40.8	Very low	48.7	Very low	147 Å²	147	105.4 Å²	105.4	69%	0.687	54%	0.536	S	S	*	.	H	α-helix	trans	-65.9	-35	170.7	-81.7	-179.1	-34.2	0	0	111.5	R43 F51	R43-Q47 PolarHBondContact O-N 3.25Å; Q47-F51 WeakPolarHBondContact O-CB 3.32Å; Q47-F51 PolarHBondContact O-N 3.06Å
48	Q	43.8	Very low	50.5	Low	128 Å²	128	102 Å²	102	60%	0.598	52%	0.519	S	S	*	.	H	α-helix	trans	-76.7	-42.6	179.8	-73.3	175.1	2.7	0	0	113.5	A44 G45 H46 F51 L52	A44-Q48 WeakPolarHBondContact O-CG 3.25Å; A44-Q48 PolarHBondContact O-N 2.77Å; G45-Q48 PolarHBondContact O-N 2.99Å; H46-Q48 VanDerWaalsContact C-N 3.31Å; Q48-F51 PolarHBondContact O-N 3.33Å; Q48-L52 PolarHBondContact O-N 2.94Å
49	T	33	Very low	52.6	Low	85 Å²	85	106.8 Å²	106.8	52%	0.521	54%	0.538	S	S	.	.	H	α-helix	trans	-76.1	-34.5	-179.5	52.4	0	0	0	0	113.1	G45 F51	G45-T49 WeakPolarHBondContact O-CG2 3.32Å; G45-T49 PolarHBondContact O-N 3.39Å; G45-T49 PolarHBondContact O-OG1 3.06Å; T49-F51 VanDerWaalsContact C-N 3.28Å; T49-F51 PolarHBondContact O-N 3.3Å
50	A	36.2	Very low	54.3	Low	59 Å²	59	102.7 Å²	102.7	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-67.4	-31.2	172.5	0	0	0	0	0	112	H46 R53	H46-A50 WeakPolarHBondContact O-CB 3.2Å; H46-A50 PolarHBondContact O-N 2.99Å; H46-A50 VanDerWaalsContact O-N 3.1Å; A50-R53 PolarHBondContact O-N 3.25Å
51	F	44	Very low	56.2	Low	91 Å²	91	97.1 Å²	97.1	40%	0.399	48%	0.476	S	S	.	.	H	α-helix	trans	-75.2	-35.5	-178.9	-171.9	-99.2	0	0	0	113.2	Q47 Q48 T49 R53 R54 M66	Q47-F51 WeakPolarHBondContact O-CB 3.32Å; Q47-F51 PolarHBondContact O-N 3.06Å; Q48-F51 PolarHBondContact O-N 3.33Å; T49-F51 VanDerWaalsContact C-N 3.28Å; T49-F51 PolarHBondContact O-N 3.3Å; F51-R53 PolarHBondContact O-N 3.43Å; F51-R54 PolarHBondContact O-N 2.99Å; F51-M66 HydrophobicContact CE1-CE 4.23Å; F51-M66 HydrophobicContact CE1-CG 3.98Å; F51-M66 HydrophobicContact CE1-SD 3.97Å; F51-M66 HydrophobicContact CE2-CE 3.71Å; F51-M66 HydrophobicContact CE2-SD 4.47Å; F51-M66 HydrophobicContact CZ-CE 3.23Å; F51-M66 HydrophobicContact CZ-CG 3.9Å; F51-M66 HydrophobicContact CZ-SD 3.44Å; F51-M66 WeakPolarHBondContact CZ-SD 3.2Å
52	L	46	Very low	58	Low	133 Å²	133	93.7 Å²	93.7	70%	0.696	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.1	172.8	-73.7	171.5	0	0	0	114	Q48	Q48-L52 PolarHBondContact O-N 2.94Å
53	R	46.9	Very low	60.1	Low	233 Å²	233	86.5 Å²	86.5	88%	0.879	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-15.6	175.5	-79.4	-174.6	174	177.4	-0.8	114.5	A50 F51	A50-R53 PolarHBondContact O-N 3.25Å; F51-R53 PolarHBondContact O-N 3.43Å
54	R	62.5	Low	62.1	Low	161 Å²	161	80.4 Å²	80.4	61%	0.608	42%	0.419	S	S	*	.	S	Bend	trans	-79.6	133.5	179.6	-171.7	178.3	170.6	178.1	-4.4	109.3	F51 M56	F51-R54 PolarHBondContact O-N 2.99Å; R54-M56 PolarHBondContact O-N 3.33Å
55	S	72.4	Confident	63.8	Low	81 Å²	81	82.2 Å²	82.2	57%	0.566	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-62.3	131.9	168.7	-168.1	0	0	0	0	109.4	A240	S55-A240 PolarHBondContact OG-O 3.21Å
56	M	83.4	Confident	66.3	Low	33 Å²	33	82.6 Å²	82.6	16%	0.163	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-65.2	133.9	175.2	-173.7	169	67.6	0	0	109.6	R54 D60 L61 F67 F172 A240 L270	R54-M56 PolarHBondContact O-N 3.33Å; M56-D60 HydrophobicContact CG-CB 3.97Å; M56-L61 HydrophobicContact CE-CD2 3.78Å; M56-L61 HydrophobicContact SD-CD2 3.8Å; M56-F67 HydrophobicContact SD-CE1 4.4Å; M56-F67 HydrophobicContact SD-CZ 3.8Å; M56-F172 HydrophobicContact CE-CE1 3.99Å; M56-F172 HydrophobicContact CE-CE2 4.45Å; M56-F172 HydrophobicContact CE-CZ 3.5Å; M56-F172 VanDerWaalsContact CE-CZ 3.5Å; M56-A240 HydrophobicContact CE-CB 3.84Å; M56-L270 HydrophobicContact CB-CD1 4.34Å; M56-L270 HydrophobicContact CE-CD1 3.66Å; M56-L270 HydrophobicContact CG-CD1 3.97Å
57	T	88.1	Confident	68.8	Low	31 Å²	31	77.2 Å²	77.2	19%	0.19	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-97.6	166.9	175.3	67.1	0	0	0	0	111.4	D59 D60 L270 E271	T57-D59 VanDerWaalsContact C-N 3.27Å; T57-D59 PolarHBondContact O-N 3.1Å; T57-D60 PolarHBondContact N-OD2 3.39Å; T57-D60 WeakPolarHBondContact O-CB 3.24Å; T57-D60 PolarHBondContact O-N 3.33Å; T57-D60 PolarHBondContact OG1-N 3.13Å; T57-D60 VanDerWaalsContact OG1-N 3.14Å; T57-D60 PolarHBondContact OG1-OD1 3.02Å; T57-D60 PolarHBondContact OG1-OD2 3.09Å; T57-L270 WeakPolarHBondContact O-CD1 3.49Å; T57-E271 WeakPolarHBondContact CA-OE1 3.03Å; T57-E271 WeakPolarHBondContact CB-OE1 3.05Å
58	T	88.1	Confident	71.3	Confident	23 Å²	23	70.3 Å²	70.3	14%	0.141	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-41	173.3	-64.7	0	0	0	0	111.5	D60 L61 I268 G269 L270 E271	T58-D60 VanDerWaalsContact C-N 3.27Å; T58-D60 PolarHBondContact O-N 3.27Å; T58-L61 WeakPolarHBondContact O-CB 3.33Å; T58-L61 PolarHBondContact O-N 2.94Å; T58-I268 VanDerWaalsContact CG2-O 3.31Å; T58-I268 WeakPolarHBondContact CG2-O 3.38Å; T58-G269 VanDerWaalsContact OG1-CA 3.31Å; T58-G269 WeakPolarHBondContact OG1-CA 3.16Å; T58-L270 PolarHBondContact OG1-N 3.47Å; T58-E271 VanDerWaalsContact CB-OE2 3.31Å; T58-E271 WeakPolarHBondContact CB-OE2 3.29Å; T58-E271 PolarHBondContact N-OE1 3.43Å; T58-E271 PolarHBondContact N-OE2 2.86Å; T58-E271 PolarHBondContact OG1-OE2 2.85Å
59	D	86.7	Confident	73.6	Confident	125 Å²	125	67.7 Å²	67.7	67%	0.668	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-65.6	-32.2	178.2	-70.7	-16.5	0	0	0	112.1	T57 L61 E62	T57-D59 VanDerWaalsContact C-N 3.27Å; T57-D59 PolarHBondContact O-N 3.1Å; D59-L61 PolarHBondContact O-N 2.65Å; D59-E62 PolarHBondContact O-N 3.43Å; D59-E62 VanDerWaalsContact O-N 3.14Å
60	D	87.2	Confident	76.5	Confident	21 Å²	21	66.7 Å²	66.7	11%	0.112	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-58.9	-34.5	177.1	-73.2	-28.9	0	0	0	111	M56 T57 T58 E62 S63 M66 F67	M56-D60 HydrophobicContact CG-CB 3.97Å; T57-D60 PolarHBondContact N-OD2 3.39Å; T57-D60 WeakPolarHBondContact O-CB 3.24Å; T57-D60 PolarHBondContact O-N 3.33Å; T57-D60 PolarHBondContact OG1-N 3.13Å; T57-D60 VanDerWaalsContact OG1-N 3.14Å; T57-D60 PolarHBondContact OG1-OD1 3.02Å; T57-D60 PolarHBondContact OG1-OD2 3.09Å; T58-D60 VanDerWaalsContact C-N 3.27Å; T58-D60 PolarHBondContact O-N 3.27Å; D60-E62 PolarHBondContact O-N 3.23Å; D60-E62 VanDerWaalsContact O-N 3.11Å; D60-S63 WeakPolarHBondContact O-CA 3.48Å; D60-S63 WeakPolarHBondContact O-CB 3.25Å; D60-S63 PolarHBondContact O-N 2.04Å; D60-M66 HydrophobicContact CB-CE 3.65Å; D60-M66 HydrophobicContact CB-SD 3.91Å; D60-M66 WeakPolarHBondContact OD1-CE 3.45Å; D60-F67 VanDerWaalsContact O-CE2 3.26Å; D60-F67 WeakPolarHBondContact O-CE2 3.03Å
61	L	86.6	Confident	79.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-60.8	-20.8	179.7	-62.9	174.1	0	0	0	114.1	M56 T58 D59 K164 V167 F172 I268 L270	M56-L61 HydrophobicContact CE-CD2 3.78Å; M56-L61 HydrophobicContact SD-CD2 3.8Å; T58-L61 WeakPolarHBondContact O-CB 3.33Å; T58-L61 PolarHBondContact O-N 2.94Å; D59-L61 PolarHBondContact O-N 2.65Å; L61-K164 HydrophobicContact CB-CG 4.01Å; L61-V167 HydrophobicContact CD2-CG1 3.86Å; L61-F172 HydrophobicContact CD1-CE2 4.26Å; L61-F172 HydrophobicContact CD2-CE2 3.95Å; L61-F172 HydrophobicContact CD2-CZ 4.14Å; L61-I268 HydrophobicContact CD1-CD1 3.66Å; L61-I268 HydrophobicContact CD1-CG1 3.84Å; L61-L270 HydrophobicContact CD1-CD1 4.01Å; L61-L270 HydrophobicContact CD1-CD2 4.47Å; L61-L270 HydrophobicContact CD1-CG 4.21Å; L61-L270 HydrophobicContact CD2-CD1 4.4Å; L61-L270 HydrophobicContact CG-CD1 4.15Å
62	E	83.8	Confident	81.1	Confident	43 Å²	43	68.9 Å²	68.9	20%	0.201	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-90.4	-6.9	175.5	-58.5	-169.2	176.3	0	0	112.7	D59 D60 T64 R160 K164	D59-E62 PolarHBondContact O-N 3.43Å; D59-E62 VanDerWaalsContact O-N 3.14Å; D60-E62 PolarHBondContact O-N 3.23Å; D60-E62 VanDerWaalsContact O-N 3.11Å; E62-T64 PolarHBondContact O-N 2.8Å; E62-T64 VanDerWaalsContact O-N 3.14Å; E62-R160 IonicContact OE2-CZ 2.91Å; E62-R160 VanDerWaalsContact OE2-CZ 3.29Å; E62-R160 IonicContact OE2-NE 3.98Å; E62-R160 PolarHBondContact OE2-NE 3.04Å; E62-R160 VanDerWaalsContact OE2-NE 3.16Å; E62-R160 IonicContact OE2-NH2 2.72Å; E62-R160 PolarHBondContact OE2-NH2 2.86Å; E62-K164 HydrophobicContact CG-CB 4.14Å; E62-K164 HydrophobicContact CG-CD 3.79Å; E62-K164 HydrophobicContact CG-CG 4.12Å
63	S	82.6	Confident	83	Confident	33 Å²	33	64.2 Å²	64.2	23%	0.231	34%	0.342	C	S	.	.			trans	-75.6	101.8	-176.8	-175.2	0	0	0	0	111.8	D60 S65 M66 F67	D60-S63 WeakPolarHBondContact O-CA 3.48Å; D60-S63 WeakPolarHBondContact O-CB 3.25Å; D60-S63 PolarHBondContact O-N 2.04Å; S63-S65 VanDerWaalsContact C-N 3.28Å; S63-S65 PolarHBondContact O-N 3.01Å; S63-S65 PolarHBondContact OG-OG 2.87Å; S63-M66 PolarHBondContact O-N 3.27Å; S63-F67 WeakPolarHBondContact O-CD2 3.47Å
64	T	78	Confident	85	Confident	67 Å²	67	59.7 Å²	59.7	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-39.1	175.5	51.7	0	0	0	0	112.3	E62 M66 F67 F68 V163	E62-T64 PolarHBondContact O-N 2.8Å; E62-T64 VanDerWaalsContact O-N 3.14Å; T64-M66 VanDerWaalsContact C-N 3.27Å; T64-M66 PolarHBondContact O-N 2.66Å; T64-F67 PolarHBondContact O-N 2.74Å; T64-F68 WeakPolarHBondContact O-CA 3.33Å; T64-F68 WeakPolarHBondContact O-CB 3.08Å; T64-F68 PolarHBondContact O-N 2.81Å; T64-V163 HydrophobicContact CG2-CG1 4.11Å
65	S	80.8	Confident	86.5	Confident	78 Å²	78	53 Å²	53	55%	0.545	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-30.1	-176.5	63.4	0	0	0	0	113.2	S63 R79	S63-S65 VanDerWaalsContact C-N 3.28Å; S63-S65 PolarHBondContact O-N 3.01Å; S63-S65 PolarHBondContact OG-OG 2.87Å; S65-R79 PolarHBondContact O-NE 2.94Å; S65-R79 PolarHBondContact O-NH2 3.01Å
66	M	84.6	Confident	87.5	Confident	41 Å²	41	52.5 Å²	52.5	20%	0.202	29%	0.294	C	S	.	.	H	α-helix	trans	-72.2	-44.5	179	-174.8	179.9	-60.1	0	0	112	F51 D60 S63 T64	F51-M66 HydrophobicContact CE1-CE 4.23Å; F51-M66 HydrophobicContact CE1-CG 3.98Å; F51-M66 HydrophobicContact CE1-SD 3.97Å; F51-M66 HydrophobicContact CE2-CE 3.71Å; F51-M66 HydrophobicContact CE2-SD 4.47Å; F51-M66 HydrophobicContact CZ-CE 3.23Å; F51-M66 HydrophobicContact CZ-CG 3.9Å; F51-M66 HydrophobicContact CZ-SD 3.44Å; F51-M66 WeakPolarHBondContact CZ-SD 3.2Å; D60-M66 HydrophobicContact CB-CE 3.65Å; D60-M66 HydrophobicContact CB-SD 3.91Å; D60-M66 WeakPolarHBondContact OD1-CE 3.45Å; S63-M66 PolarHBondContact O-N 3.27Å; T64-M66 VanDerWaalsContact C-N 3.27Å; T64-M66 PolarHBondContact O-N 2.66Å
67	F	90	Very high	88	Confident	9 Å²	9	52 Å²	52	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-99.5	-28	-171.2	-65.4	-71.7	0	0	0	114	M56 D60 S63 T64 F78 R79 V82 V167 Q171	M56-F67 HydrophobicContact SD-CE1 4.4Å; M56-F67 HydrophobicContact SD-CZ 3.8Å; D60-F67 VanDerWaalsContact O-CE2 3.26Å; D60-F67 WeakPolarHBondContact O-CE2 3.03Å; S63-F67 WeakPolarHBondContact O-CD2 3.47Å; T64-F67 PolarHBondContact O-N 2.74Å; F67-F78 HydrophobicContact CB-CD1 4.13Å; F67-F78 HydrophobicContact CB-CE1 4.11Å; F67-F78 CarbonylContact O-C 3.6Å; F67-F78 VanDerWaalsContact O-CA 3.31Å; F67-F78 WeakPolarHBondContact O-CA 3.48Å; F67-R79 PolarHBondContact O-N 3.46Å; F67-V82 HydrophobicContact CD1-CG1 3.85Å; F67-V82 HydrophobicContact CD1-CG2 4.12Å; F67-V82 HydrophobicContact CE1-CG1 4.45Å; F67-V82 WeakPolarHBondContact O-CG2 3.42Å; F67-V167 HydrophobicContact CB-CG2 4.08Å; F67-V167 HydrophobicContact CD1-CG1 3.97Å; F67-V167 HydrophobicContact CD2-CB 4.39Å; F67-V167 HydrophobicContact CD2-CG1 3.63Å; F67-V167 HydrophobicContact CD2-CG2 3.77Å; F67-V167 HydrophobicContact CE1-CG1 3.87Å; F67-V167 HydrophobicContact CE2-CG1 3.53Å; F67-V167 HydrophobicContact CE2-CG2 4.44Å; F67-V167 HydrophobicContact CG-CG1 3.86Å; F67-V167 HydrophobicContact CG-CG2 3.94Å; F67-V167 HydrophobicContact CZ-CG1 3.66Å; F67-Q171 HydrophobicContact CE1-CG 4.14Å
68	F	92.4	Very high	88.2	Confident	1 Å²	1	51 Å²	51	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	155.8	-168.9	-56.2	-91.1	0	0	0	113.1	T64 W76 R77 F78 R79 V163 I166 V167 Y183 I185	T64-F68 WeakPolarHBondContact O-CA 3.33Å; T64-F68 WeakPolarHBondContact O-CB 3.08Å; T64-F68 PolarHBondContact O-N 2.81Å; F68-W76 HydrophobicContact CB-CB 4.13Å; F68-W76 HydrophobicContact CB-CE3 3.96Å; F68-W76 HydrophobicContact CD1-CB 4.32Å; F68-W76 HydrophobicContact CG-CB 4.41Å; F68-R77 CarbonylContact C-O 3.52Å; F68-R77 WeakPolarHBondContact CA-O 3.4Å; F68-F78 HydrophobicContact CD1-CD1 4.25Å; F68-F78 AromaticContact CE1-CD1 3.86Å; F68-F78 HydrophobicContact CE1-CD1 3.86Å; F68-F78 HydrophobicContact CE1-CD2 4.43Å; F68-F78 AromaticContact CE1-CE1 3.74Å; F68-F78 HydrophobicContact CE1-CE1 3.74Å; F68-F78 HydrophobicContact CE1-CE2 4.32Å; F68-F78 HydrophobicContact CE1-CG 4.22Å; F68-F78 AromaticContact CE1-CZ 3.98Å; F68-F78 HydrophobicContact CE1-CZ 3.98Å; F68-F78 HydrophobicContact CE2-CE1 4.3Å; F68-F78 HydrophobicContact CZ-CD1 4.15Å; F68-F78 AromaticContact CZ-CE1 3.62Å; F68-F78 HydrophobicContact CZ-CE1 3.62Å; F68-F78 AromaticContact CZ-CZ 3.93Å; F68-F78 HydrophobicContact CZ-CZ 3.93Å; F68-R79 PolarHBondContact O-NE 3.25Å; F68-R79 VanDerWaalsContact O-NE 3.09Å; F68-R79 PolarHBondContact O-NH2 3.42Å; F68-V163 HydrophobicContact CD2-CG1 4.43Å; F68-V163 HydrophobicContact CE2-CG1 3.58Å; F68-V163 HydrophobicContact CZ-CG1 4.11Å; F68-I166 HydrophobicContact CE1-CG2 4.34Å; F68-I166 HydrophobicContact CZ-CG2 4.12Å; F68-V167 HydrophobicContact CE2-CG2 3.44Å; F68-V167 VanDerWaalsContact CE2-CG2 3.44Å; F68-V167 HydrophobicContact CZ-CG2 3.68Å; F68-Y183 HydrophobicContact CD1-CE2 4.48Å; F68-Y183 AromaticContact CE1-CE2 3.91Å; F68-Y183 HydrophobicContact CE1-CE2 3.91Å; F68-I185 HydrophobicContact CD1-CD1 4.2Å; F68-I185 HydrophobicContact CE1-CD1 3.63Å; F68-I185 HydrophobicContact CE2-CD1 4.49Å; F68-I185 HydrophobicContact CZ-CD1 3.79Å
69	Q	92.6	Very high	88.3	Confident	74 Å²	74	54.8 Å²	54.8	35%	0.346	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.2	166.4	61.9	-175.1	31.6	0	0	108.7	E71 R77 R79	Q69-E71 PolarHBondContact O-N 3.14Å; Q69-R77 PolarHBondContact N-O 3.01Å; Q69-R77 PolarHBondContact O-N 2.9Å; Q69-R79 HydrophobicContact CB-CG 4Å; Q69-R79 HydrophobicContact CG-CG 4.13Å
70	L	92.6	Very high	88.2	Confident	64 Å²	64	52.3 Å²	52.3	34%	0.335	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	119.2	175.5	-168.6	69.4	0	0	0	109	W76 M187	L70-W76 HydrophobicContact CB-CE3 4.46Å; L70-W76 HydrophobicContact CB-CZ3 4.43Å; L70-W76 HydrophobicContact CD1-CD2 4.24Å; L70-W76 HydrophobicContact CD1-CG 4.41Å; L70-M187 HydrophobicContact CD1-CB 4.06Å; L70-M187 HydrophobicContact CD1-CG 3.93Å; L70-M187 HydrophobicContact CD2-CE 3.98Å; L70-M187 HydrophobicContact CD2-CG 4.16Å; L70-M187 HydrophobicContact CD2-SD 4.33Å
71	E	91.2	Very high	87.8	Confident	80 Å²	80	58.4 Å²	58.4	37%	0.374	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.4	177.7	-173.2	176.7	-106.7	0	0	109.6	Q69 G73 M74 Q75 R77	Q69-E71 PolarHBondContact O-N 3.14Å; E71-G73 PolarHBondContact O-N 3.42Å; E71-M74 PolarHBondContact O-N 3.18Å; E71-Q75 PolarHBondContact N-O 3.34Å; E71-Q75 PolarHBondContact O-N 3.14Å; E71-R77 HydrophobicContact CB-CB 4.2Å; E71-R77 HydrophobicContact CB-CG 3.7Å; E71-R77 HydrophobicContact CG-CG 4.41Å; E71-R77 WeakPolarHBondContact OE2-CG 3.45Å
72	S	87.5	Confident	87.5	Confident	115 Å²	115	59.2 Å²	59.2	80%	0.804	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	18.9	178.6	-55.6	0	0	0	0	115.3	M74	S72-M74 VanDerWaalsContact C-N 3.26Å; S72-M74 PolarHBondContact O-N 3.26Å
73	G	84.1	Confident	86.7	Confident	35 Å²	35	64.8 Å²	64.8	36%	0.361	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	13.2	-175.5	0	0	0	0	0	114.9	E71	E71-G73 PolarHBondContact O-N 3.42Å
74	M	89.8	Confident	85.8	Confident	138 Å²	138	64.9 Å²	64.9	68%	0.68	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-34.9	-169.7	-64.7	-63.6	-73.5	0	0	113.7	E71 S72 M187	E71-M74 PolarHBondContact O-N 3.18Å; S72-M74 VanDerWaalsContact C-N 3.26Å; S72-M74 PolarHBondContact O-N 3.26Å; M74-M187 PolarHBondContact O-N 3.38Å
75	Q	93.9	Very high	84.9	Confident	20 Å²	20	65.5 Å²	65.5	9%	0.093	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	152.2	-173	58.5	-178.6	-25.5	0	0	112.2	E71 R77 C94 I185	E71-Q75 PolarHBondContact N-O 3.34Å; E71-Q75 PolarHBondContact O-N 3.14Å; Q75-R77 HydrophobicContact CG-CG 4.06Å; Q75-C94 PolarHBondContact OE1-SG 3.42Å; Q75-C94 VanDerWaalsContact OE1-SG 3.34Å; Q75-I185 CarbonylContact C-O 3.48Å; Q75-I185 VanDerWaalsContact CA-O 3.3Å; Q75-I185 WeakPolarHBondContact CA-O 3.31Å; Q75-I185 WeakPolarHBondContact CB-O 3.35Å
76	W	94	Very high	84.1	Confident	71 Å²	71	64.9 Å²	64.9	27%	0.269	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.9	175.9	-64.7	89.9	0	0	0	110.3	F68 L70 Y183 I185 M187	F68-W76 HydrophobicContact CB-CB 4.13Å; F68-W76 HydrophobicContact CB-CE3 3.96Å; F68-W76 HydrophobicContact CD1-CB 4.32Å; F68-W76 HydrophobicContact CG-CB 4.41Å; L70-W76 HydrophobicContact CB-CE3 4.46Å; L70-W76 HydrophobicContact CB-CZ3 4.43Å; L70-W76 HydrophobicContact CD1-CD2 4.24Å; L70-W76 HydrophobicContact CD1-CG 4.41Å; W76-Y183 WeakPolarHBondContact O-CE2 3.5Å; W76-I185 HydrophobicContact CB-CB 4.03Å; W76-I185 HydrophobicContact CB-CG2 3.87Å; W76-I185 HydrophobicContact CG-CG2 4.08Å; W76-I185 PolarHBondContact N-O 2.87Å; W76-M187 PolarHBondContact NE1-O 3.01Å
77	R	93.5	Very high	82.9	Confident	24 Å²	24	66.7 Å²	66.7	9%	0.091	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150.4	179.5	-60.8	-56	-62.1	179.3	-9.8	111.4	F68 Q69 E71 Q75 R79 L91 L92 Y183	F68-R77 CarbonylContact C-O 3.52Å; F68-R77 WeakPolarHBondContact CA-O 3.4Å; Q69-R77 PolarHBondContact N-O 3.01Å; Q69-R77 PolarHBondContact O-N 2.9Å; E71-R77 HydrophobicContact CB-CB 4.2Å; E71-R77 HydrophobicContact CB-CG 3.7Å; E71-R77 HydrophobicContact CG-CG 4.41Å; E71-R77 WeakPolarHBondContact OE2-CG 3.45Å; Q75-R77 HydrophobicContact CG-CG 4.06Å; R77-R79 PolarHBondContact O-N 3.32Å; R77-L91 PolarHBondContact NH2-O 3.48Å; R77-L92 PolarHBondContact NH1-O 2.69Å; R77-L92 PolarHBondContact NH2-O 3.46Å; R77-Y183 VanDerWaalsContact CA-OH 3.29Å; R77-Y183 WeakPolarHBondContact CA-OH 3.38Å; R77-Y183 VanDerWaalsContact NH1-CZ 3.32Å; R77-Y183 PolarHBondContact NH1-O 3.2Å; R77-Y183 VanDerWaalsContact NH1-O 3.07Å
78	F	92.6	Very high	81.6	Confident	10 Å²	10	70.6 Å²	70.6	4%	0.044	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	135.9	176.8	-78.6	-64.1	0	0	0	110.2	F67 F68 V82 F85 L91 I166 V167 N170 Y183	F67-F78 HydrophobicContact CB-CD1 4.13Å; F67-F78 HydrophobicContact CB-CE1 4.11Å; F67-F78 CarbonylContact O-C 3.6Å; F67-F78 VanDerWaalsContact O-CA 3.31Å; F67-F78 WeakPolarHBondContact O-CA 3.48Å; F68-F78 HydrophobicContact CD1-CD1 4.25Å; F68-F78 AromaticContact CE1-CD1 3.86Å; F68-F78 HydrophobicContact CE1-CD1 3.86Å; F68-F78 HydrophobicContact CE1-CD2 4.43Å; F68-F78 AromaticContact CE1-CE1 3.74Å; F68-F78 HydrophobicContact CE1-CE1 3.74Å; F68-F78 HydrophobicContact CE1-CE2 4.32Å; F68-F78 HydrophobicContact CE1-CG 4.22Å; F68-F78 AromaticContact CE1-CZ 3.98Å; F68-F78 HydrophobicContact CE1-CZ 3.98Å; F68-F78 HydrophobicContact CE2-CE1 4.3Å; F68-F78 HydrophobicContact CZ-CD1 4.15Å; F68-F78 AromaticContact CZ-CE1 3.62Å; F68-F78 HydrophobicContact CZ-CE1 3.62Å; F68-F78 AromaticContact CZ-CZ 3.93Å; F68-F78 HydrophobicContact CZ-CZ 3.93Å; F78-V82 HydrophobicContact CD1-CG1 4.08Å; F78-F85 HydrophobicContact CB-CD2 4.26Å; F78-L91 HydrophobicContact CD2-CD1 3.99Å; F78-L91 HydrophobicContact CE2-CD1 3.97Å; F78-I166 HydrophobicContact CE2-CG2 3.88Å; F78-I166 HydrophobicContact CZ-CG2 3.71Å; F78-V167 HydrophobicContact CE1-CG2 4.23Å; F78-N170 HydrophobicContact CE1-CB 4.25Å; F78-N170 HydrophobicContact CE2-CB 3.66Å; F78-N170 HydrophobicContact CZ-CB 3.46Å; F78-N170 VanDerWaalsContact CZ-CB 3.46Å; F78-Y183 AromaticContact CD2-CE1 3.58Å; F78-Y183 HydrophobicContact CD2-CE1 3.58Å; F78-Y183 AromaticContact CD2-CZ 3.72Å; F78-Y183 VanDerWaalsContact CD2-OH 3.25Å; F78-Y183 WeakPolarHBondContact CD2-OH 3.48Å; F78-Y183 HydrophobicContact CE2-CD1 4.29Å; F78-Y183 AromaticContact CE2-CE1 3.55Å; F78-Y183 HydrophobicContact CE2-CE1 3.55Å; F78-Y183 AromaticContact CE2-CZ 3.89Å; F78-Y183 PolarHBondContact N-OH 2.71Å
79	R	90.2	Very high	80.9	Confident	101 Å²	101	76.6 Å²	76.6	38%	0.381	41%	0.412	S	S	.	.			trans	-62.5	143.7	169.6	-65.4	175.7	178.9	-85	3.2	108.9	S65 F67 F68 Q69 R77 N81 V82	S65-R79 PolarHBondContact O-NE 2.94Å; S65-R79 PolarHBondContact O-NH2 3.01Å; F67-R79 PolarHBondContact O-N 3.46Å; F68-R79 PolarHBondContact O-NE 3.25Å; F68-R79 VanDerWaalsContact O-NE 3.09Å; F68-R79 PolarHBondContact O-NH2 3.42Å; Q69-R79 HydrophobicContact CB-CG 4Å; Q69-R79 HydrophobicContact CG-CG 4.13Å; R77-R79 PolarHBondContact O-N 3.32Å; R79-N81 PolarHBondContact O-N 2.9Å; R79-N81 VanDerWaalsContact O-N 3.07Å; R79-V82 HydrophobicContact CB-CG2 3.98Å; R79-V82 WeakPolarHBondContact O-CB 3.3Å; R79-V82 WeakPolarHBondContact O-CG2 3.23Å; R79-V82 PolarHBondContact O-N 3.07Å; R79-V82 VanDerWaalsContact O-N 3.12Å
80	P	83.5	Confident	80.6	Confident	74 Å²	74	78 Å²	78	48%	0.481	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.4	-175.5	21.7	-32	0	0	0	114.2
81	N	79.8	Confident	80.7	Confident	149 Å²	149	75.7 Å²	75.7	80%	0.797	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	0.8	-178.5	-61.4	-14.3	0	0	0	113.8	R79	R79-N81 PolarHBondContact O-N 2.9Å; R79-N81 VanDerWaalsContact O-N 3.07Å
82	V	79.1	Confident	80.9	Confident	17 Å²	17	72.3 Å²	72.3	10%	0.103	40%	0.4	C	S	.	.	S	Bend	trans	-69.2	133.1	-179.8	168.8	0	0	0	0	109.9	F67 F78 R79 F85	F67-V82 HydrophobicContact CD1-CG1 3.85Å; F67-V82 HydrophobicContact CD1-CG2 4.12Å; F67-V82 HydrophobicContact CE1-CG1 4.45Å; F67-V82 WeakPolarHBondContact O-CG2 3.42Å; F78-V82 HydrophobicContact CD1-CG1 4.08Å; R79-V82 HydrophobicContact CB-CG2 3.98Å; R79-V82 WeakPolarHBondContact O-CB 3.3Å; R79-V82 WeakPolarHBondContact O-CG2 3.23Å; R79-V82 PolarHBondContact O-N 3.07Å; R79-V82 VanDerWaalsContact O-N 3.12Å; V82-F85 WeakPolarHBondContact O-CB 3.39Å; V82-F85 PolarHBondContact O-N 2.86Å; V82-F85 VanDerWaalsContact O-N 3.11Å
83	R	68.5	Low	81.3	Confident	160 Å²	160	68.1 Å²	68.1	60%	0.604	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	146.6	176.9	-72	-174.6	-170.8	-167.1	6	110.4	F85 Q171	R83-F85 PolarHBondContact O-N 2.8Å; R83-Q171 PolarHBondContact O-NE2 2.99Å; R83-Q171 PolarHBondContact O-OE1 3.35Å
84	G	63.9	Low	81.8	Confident	34 Å²	34	67.8 Å²	67.8	35%	0.351	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	-12.6	-174.8	0	0	0	0	0	114.4	N86 R173	G84-N86 PolarHBondContact O-N 2.97Å; G84-R173 PolarHBondContact O-NE 2.94Å; G84-R173 PolarHBondContact O-NH1 3.18Å; G84-R173 PolarHBondContact O-NH2 2.82Å
85	F	57.7	Low	82	Confident	81 Å²	81	66.5 Å²	66.5	36%	0.355	35%	0.353	S	S	.	.			trans	-63.2	107.1	171.6	-173.3	-100.8	0	0	0	109.7	F78 V82 R83 A87	F78-F85 HydrophobicContact CB-CD2 4.26Å; V82-F85 WeakPolarHBondContact O-CB 3.39Å; V82-F85 PolarHBondContact O-N 2.86Å; V82-F85 VanDerWaalsContact O-N 3.11Å; R83-F85 PolarHBondContact O-N 2.8Å; F85-A87 HydrophobicContact CE1-CB 4.15Å
86	N	65.3	Low	82.1	Confident	64 Å²	64	68.9 Å²	68.9	34%	0.342	36%	0.364	S	S	.	.			trans	-99.6	103.4	174	-174.6	-0.8	0	0	0	108.8	G84 S88 K89	G84-N86 PolarHBondContact O-N 2.97Å; N86-S88 PolarHBondContact ND2-OG 3.46Å; N86-S88 PolarHBondContact O-N 3.31Å; N86-S88 VanDerWaalsContact O-N 3.09Å; N86-S88 VanDerWaalsContact OD1-CB 3.31Å; N86-S88 WeakPolarHBondContact OD1-CB 3.3Å; N86-S88 PolarHBondContact OD1-N 3.45Å; N86-S88 PolarHBondContact OD1-OG 3.12Å; N86-K89 CarbonylContact O-C 3.59Å; N86-K89 PolarHBondContact O-N 3.3Å
87	A	59.7	Low	82.2	Confident	80 Å²	80	66.2 Å²	66.2	66%	0.661	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.8	176.5	0	0	0	0	0	113.1	F85 K89	F85-A87 HydrophobicContact CE1-CB 4.15Å; A87-K89 VanDerWaalsContact C-N 3.31Å; A87-K89 PolarHBondContact O-N 3.27Å
88	S	62.5	Low	82.2	Confident	91 Å²	91	69.2 Å²	69.2	64%	0.636	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13	179.2	89.9	0	0	0	0	114.1	N86	N86-S88 PolarHBondContact ND2-OG 3.46Å; N86-S88 PolarHBondContact O-N 3.31Å; N86-S88 VanDerWaalsContact O-N 3.09Å; N86-S88 VanDerWaalsContact OD1-CB 3.31Å; N86-S88 WeakPolarHBondContact OD1-CB 3.3Å; N86-S88 PolarHBondContact OD1-N 3.45Å; N86-S88 PolarHBondContact OD1-OG 3.12Å
89	K	77.7	Confident	82.3	Confident	127 Å²	127	76.4 Å²	76.4	55%	0.552	41%	0.407	S	S	*	.	S	Bend	trans	-135.7	80.6	176.5	-73.1	-170.6	178.2	-175.1	0	109	N86 A87 L91 E179	N86-K89 CarbonylContact O-C 3.59Å; N86-K89 PolarHBondContact O-N 3.3Å; A87-K89 VanDerWaalsContact C-N 3.31Å; A87-K89 PolarHBondContact O-N 3.27Å; K89-L91 PolarHBondContact O-N 2.88Å; K89-E179 IonicContact NZ-OE1 3.87Å
90	P	86.1	Confident	82.6	Confident	104 Å²	104	77.7 Å²	77.7	68%	0.675	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-63.8	134.3	179.9	26.4	-33.4	0	0	0	110.5
91	L	93.9	Very high	83.1	Confident	14 Å²	14	74.9 Å²	74.9	7%	0.073	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-70.7	141.3	175	-66.4	173.4	0	0	0	109.8	R77 F78 K89 L180 I181 Y183	R77-L91 PolarHBondContact NH2-O 3.48Å; F78-L91 HydrophobicContact CD2-CD1 3.99Å; F78-L91 HydrophobicContact CE2-CD1 3.97Å; K89-L91 PolarHBondContact O-N 2.88Å; L91-L180 HydrophobicContact CD1-CD2 3.84Å; L91-L180 HydrophobicContact CD1-CG 4.4Å; L91-L180 HydrophobicContact CD2-CB 4.44Å; L91-L180 HydrophobicContact CD2-CD2 4.26Å; L91-L180 HydrophobicContact CD2-CG 3.95Å; L91-L180 WeakPolarHBondContact CD2-O 3.5Å; L91-I181 WeakPolarHBondContact CA-O 3.39Å; L91-Y183 HydrophobicContact CB-CD1 4.34Å; L91-Y183 HydrophobicContact CB-CE1 4.19Å; L91-Y183 HydrophobicContact CD1-CD1 3.97Å; L91-Y183 HydrophobicContact CD1-CE1 3.65Å
92	L	95.6	Very high	83.9	Confident	9 Å²	9	75 Å²	75	5%	0.047	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-59.1	144.4	175.2	-53.9	172.9	0	0	0	111.2	R77 Q96 I97 L120 I181 Y183	R77-L92 PolarHBondContact NH1-O 2.69Å; R77-L92 PolarHBondContact NH2-O 3.46Å; L92-Q96 VanDerWaalsContact CA-OE1 3.32Å; L92-Q96 HydrophobicContact CB-CB 4.2Å; L92-Q96 HydrophobicContact CD2-CB 4.12Å; L92-I97 HydrophobicContact CB-CD1 4.49Å; L92-I97 HydrophobicContact CB-CG1 3.92Å; L92-I97 HydrophobicContact CD1-CG1 4.45Å; L92-L120 HydrophobicContact CD1-CD1 3.87Å; L92-L120 HydrophobicContact CD1-CD2 3.75Å; L92-L120 HydrophobicContact CD1-CG 4.46Å; L92-I181 HydrophobicContact CD1-CG2 4.07Å; L92-I181 HydrophobicContact CG-CG2 4.31Å; L92-I181 PolarHBondContact N-O 3.34Å; L92-Y183 PolarHBondContact O-N 2.01Å; L92-Y183 VanDerWaalsContact O-N 3.13Å; L92-Y183 VanDerWaalsContact O-O 3.09Å
93	D	95.2	Very high	84.6	Confident	28 Å²	28	78.4 Å²	78.4	15%	0.15	41%	0.406	C	S	.	.			trans	-98.4	176.3	174.5	66.7	43.7	0	0	0	112.2	E95 Q96 I97	D93-E95 VanDerWaalsContact C-N 3.32Å; D93-E95 PolarHBondContact O-N 3.22Å; D93-E95 WeakPolarHBondContact OD1-CA 3.22Å; D93-E95 WeakPolarHBondContact OD1-CB 3.17Å; D93-E95 PolarHBondContact OD1-N 3.35Å; D93-Q96 PolarHBondContact O-N 2.64Å; D93-Q96 WeakPolarHBondContact OD1-CB 3.36Å; D93-Q96 VanDerWaalsContact OD1-CG 3.31Å; D93-Q96 WeakPolarHBondContact OD1-CG 3.49Å; D93-Q96 PolarHBondContact OD1-N 2.98Å; D93-Q96 VanDerWaalsContact OD2-CD 3.3Å; D93-Q96 PolarHBondContact OD2-NE2 3.3Å; D93-I97 WeakPolarHBondContact O-CB 3.49Å; D93-I97 WeakPolarHBondContact O-CD1 3.2Å; D93-I97 WeakPolarHBondContact O-CG1 3.24Å; D93-I97 PolarHBondContact O-N 2.95Å
94	C	95.4	Very high	85.8	Confident	28 Å²	28	76.4 Å²	76.4	19%	0.189	41%	0.405	C	S	.	.	H	α-helix	trans	-57.2	-41.4	-179.2	-65.9	0	0	0	0	113.4	Q75 S98 C184	Q75-C94 PolarHBondContact OE1-SG 3.42Å; Q75-C94 VanDerWaalsContact OE1-SG 3.34Å; C94-S98 PolarHBondContact O-N 3.34Å; C94-S98 PolarHBondContact O-OG 3.11Å; C94-S98 VanDerWaalsContact O-OG 3.09Å; C94-C184 HydrophobicContact CB-CB 3.91Å; C94-C184 WeakPolarHBondContact CB-SG 3.07Å; C94-C184 WeakPolarHBondContact SG-CA 3.34Å; C94-C184 WeakPolarHBondContact SG-CB 3.49Å; C94-C184 CovalentContact SG-SG 2.04Å; C94-C184 PolarHBondContact SG-SG 3.44Å
95	E	94.4	Very high	87.4	Confident	110 Å²	110	77.2 Å²	77.2	51%	0.514	41%	0.408	S	S	.	.	H	α-helix	trans	-68.8	-44.7	-179.8	-170.3	-168.8	157.5	0	0	110.6	D93 I97 S98 R99	D93-E95 VanDerWaalsContact C-N 3.32Å; D93-E95 PolarHBondContact O-N 3.22Å; D93-E95 WeakPolarHBondContact OD1-CA 3.22Å; D93-E95 WeakPolarHBondContact OD1-CB 3.17Å; D93-E95 PolarHBondContact OD1-N 3.35Å; E95-I97 VanDerWaalsContact C-N 3.35Å; E95-I97 PolarHBondContact O-N 2.78Å; E95-S98 PolarHBondContact O-N 2.91Å; E95-S98 PolarHBondContact O-OG 2.92Å; E95-R99 HydrophobicContact CG-CG 4.27Å; E95-R99 VanDerWaalsContact O-CB 3.32Å; E95-R99 WeakPolarHBondContact O-CB 3.44Å; E95-R99 VanDerWaalsContact O-CG 3.31Å; E95-R99 WeakPolarHBondContact O-CG 3.39Å; E95-R99 PolarHBondContact O-N 2.84Å; E95-R99 WeakPolarHBondContact OE1-CD 3.49Å; E95-R99 IonicContact OE1-CZ 3.88Å; E95-R99 IonicContact OE1-NE 3.95Å; E95-R99 IonicContact OE1-NH1 2.9Å; E95-R99 PolarHBondContact OE1-NH1 3.26Å
96	Q	95.2	Very high	89.3	Confident	70 Å²	70	78.9 Å²	78.9	33%	0.327	42%	0.415	S	S	.	.	H	α-helix	trans	-64.4	-40.3	178.1	-69.1	176	-4.3	0	0	111.8	L92 D93 R100	L92-Q96 VanDerWaalsContact CA-OE1 3.32Å; L92-Q96 HydrophobicContact CB-CB 4.2Å; L92-Q96 HydrophobicContact CD2-CB 4.12Å; D93-Q96 PolarHBondContact O-N 2.64Å; D93-Q96 WeakPolarHBondContact OD1-CB 3.36Å; D93-Q96 VanDerWaalsContact OD1-CG 3.31Å; D93-Q96 WeakPolarHBondContact OD1-CG 3.49Å; D93-Q96 PolarHBondContact OD1-N 2.98Å; D93-Q96 VanDerWaalsContact OD2-CD 3.3Å; D93-Q96 PolarHBondContact OD2-NE2 3.3Å; Q96-R100 WeakPolarHBondContact O-CB 3.43Å; Q96-R100 VanDerWaalsContact O-CG 3.28Å; Q96-R100 WeakPolarHBondContact O-CG 3.44Å; Q96-R100 PolarHBondContact O-N 3.19Å
97	I	96.1	Very high	90.7	Very high	16 Å²	16	79.9 Å²	79.9	8%	0.082	42%	0.42	C	S	.	.	H	α-helix	trans	-59.2	-52.9	174.9	-73.2	170.2	0	0	0	109.8	L92 D93 E95 R99 L101 C184 V201	L92-I97 HydrophobicContact CB-CD1 4.49Å; L92-I97 HydrophobicContact CB-CG1 3.92Å; L92-I97 HydrophobicContact CD1-CG1 4.45Å; D93-I97 WeakPolarHBondContact O-CB 3.49Å; D93-I97 WeakPolarHBondContact O-CD1 3.2Å; D93-I97 WeakPolarHBondContact O-CG1 3.24Å; D93-I97 PolarHBondContact O-N 2.95Å; E95-I97 VanDerWaalsContact C-N 3.35Å; E95-I97 PolarHBondContact O-N 2.78Å; I97-R99 PolarHBondContact O-N 3.47Å; I97-L101 HydrophobicContact CB-CD1 4.38Å; I97-L101 HydrophobicContact CG2-CD1 3.66Å; I97-L101 WeakPolarHBondContact O-CB 3.35Å; I97-L101 WeakPolarHBondContact O-CD1 3.45Å; I97-L101 VanDerWaalsContact O-CG 3.27Å; I97-L101 WeakPolarHBondContact O-CG 3.21Å; I97-L101 PolarHBondContact O-N 3.37Å; I97-C184 HydrophobicContact CD1-CB 4.08Å; I97-V201 HydrophobicContact CD1-CG2 3.84Å; I97-V201 HydrophobicContact CG1-CG2 3.87Å; I97-V201 HydrophobicContact CG2-CG2 4.36Å
98	S	93.3	Very high	92.3	Very high	87 Å²	87	79.8 Å²	79.8	61%	0.608	41%	0.411	S	S	*	.	H	α-helix	trans	-64.2	-37.1	-179.2	59.4	0	0	0	0	113.5	C94 E95	C94-S98 PolarHBondContact O-N 3.34Å; C94-S98 PolarHBondContact O-OG 3.11Å; C94-S98 VanDerWaalsContact O-OG 3.09Å; E95-S98 PolarHBondContact O-N 2.91Å; E95-S98 PolarHBondContact O-OG 2.92Å
99	R	95.4	Very high	93.7	Very high	161 Å²	161	79.5 Å²	79.5	61%	0.608	40%	0.403	S	S	*	.	H	α-helix	trans	-88.7	-32.4	-174.4	-67.4	-178	70.5	-170.2	-0.2	114.4	E95 I97 R102	E95-R99 HydrophobicContact CG-CG 4.27Å; E95-R99 VanDerWaalsContact O-CB 3.32Å; E95-R99 WeakPolarHBondContact O-CB 3.44Å; E95-R99 VanDerWaalsContact O-CG 3.31Å; E95-R99 WeakPolarHBondContact O-CG 3.39Å; E95-R99 PolarHBondContact O-N 2.84Å; E95-R99 WeakPolarHBondContact OE1-CD 3.49Å; E95-R99 IonicContact OE1-CZ 3.88Å; E95-R99 IonicContact OE1-NE 3.95Å; E95-R99 IonicContact OE1-NH1 2.9Å; E95-R99 PolarHBondContact OE1-NH1 3.26Å; I97-R99 PolarHBondContact O-N 3.47Å; R99-R102 PolarHBondContact O-NH1 3.45Å; R99-R102 PolarHBondContact O-NH2 2.89Å
100	R	95.9	Very high	94.2	Very high	127 Å²	127	75.3 Å²	75.3	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-98.9	-24.9	-170	-59.1	177.3	62.5	-175.5	-1.7	114.1	Q96 L120	Q96-R100 WeakPolarHBondContact O-CB 3.43Å; Q96-R100 VanDerWaalsContact O-CG 3.28Å; Q96-R100 WeakPolarHBondContact O-CG 3.44Å; Q96-R100 PolarHBondContact O-N 3.19Å; R100-L120 HydrophobicContact CB-CD1 3.77Å
101	L	95.4	Very high	94.3	Very high	15 Å²	15	77.9 Å²	77.9	8%	0.079	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.9	177.1	-65.5	175.3	0	0	0	110.5	I97 A118 H119 L120 V125 V127 V201	I97-L101 HydrophobicContact CB-CD1 4.38Å; I97-L101 HydrophobicContact CG2-CD1 3.66Å; I97-L101 WeakPolarHBondContact O-CB 3.35Å; I97-L101 WeakPolarHBondContact O-CD1 3.45Å; I97-L101 VanDerWaalsContact O-CG 3.27Å; I97-L101 WeakPolarHBondContact O-CG 3.21Å; I97-L101 PolarHBondContact O-N 3.37Å; L101-A118 HydrophobicContact CB-CB 4.5Å; L101-A118 HydrophobicContact CD2-CB 4.24Å; L101-H119 WeakPolarHBondContact CA-O 3.23Å; L101-L120 HydrophobicContact CD2-CB 4.19Å; L101-L120 HydrophobicContact CD2-CD1 4.33Å; L101-V125 HydrophobicContact CD2-CG2 3.69Å; L101-V127 HydrophobicContact CD1-CG1 4.4Å; L101-V127 HydrophobicContact CD1-CG2 3.73Å; L101-V127 HydrophobicContact CD2-CG2 4.44Å; L101-V201 HydrophobicContact CD1-CG2 4.22Å
102	R	95.3	Very high	94.2	Very high	153 Å²	153	77.8 Å²	77.8	58%	0.577	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	156.3	-179.9	-61	-65	-179.7	-123.3	0.1	110.2	R99 M104 A118 H119	R99-R102 PolarHBondContact O-NH1 3.45Å; R99-R102 PolarHBondContact O-NH2 2.89Å; R102-M104 PolarHBondContact O-N 3.12Å; R102-A118 WeakPolarHBondContact O-CA 3.45Å; R102-H119 PolarHBondContact N-O 2.61Å; R102-H119 PolarHBondContact O-N 2.61Å
103	S	93.6	Very high	94.1	Very high	88 Å²	88	78.1 Å²	78.1	62%	0.615	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.7	51.8	173.3	-48.4	0	0	0	0	113.3	A105	S103-A105 PolarHBondContact O-N 3.09Å; S103-A105 VanDerWaalsContact O-N 3.09Å
104	M	94.5	Very high	94.1	Very high	118 Å²	118	77.3 Å²	77.3	58%	0.581	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	109.8	174.1	-70	-160.4	-57.8	0	0	110	R102 H117 A118	R102-M104 PolarHBondContact O-N 3.12Å; M104-H117 CarbonylContact C-O 3.54Å; M104-H117 VanDerWaalsContact CA-O 3.28Å; M104-H117 WeakPolarHBondContact CA-O 3.12Å; M104-A118 HydrophobicContact CG-CB 4.22Å
105	A	97.1	Very high	94.2	Very high	50 Å²	50	77.2 Å²	77.2	41%	0.413	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.6	175.1	0	0	0	0	0	109.4	S103 L107 Y116 H117	S103-A105 PolarHBondContact O-N 3.09Å; S103-A105 VanDerWaalsContact O-N 3.09Å; A105-L107 PolarHBondContact O-N 3.34Å; A105-Y116 CarbonylContact O-C 3.45Å; A105-Y116 WeakPolarHBondContact O-CA 3.4Å; A105-H117 HydrophobicContact CB-CB 4.35Å; A105-H117 PolarHBondContact N-O 3Å; A105-H117 PolarHBondContact O-N 3.41Å
106	F	97	Very high	94.3	Very high	117 Å²	117	75 Å²	75	51%	0.513	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	136.6	177.2	172.3	-93.7	0	0	0	111	T114 Y116	F106-T114 HydrophobicContact CD2-CG2 3.84Å; F106-T114 HydrophobicContact CE2-CG2 3.77Å; F106-Y116 HydrophobicContact CB-CD1 4.31Å; F106-Y116 HydrophobicContact CB-CE1 4.24Å; F106-Y116 HydrophobicContact CD2-CE1 4.4Å
107	L	94.5	Very high	94.4	Very high	84 Å²	84	73.7 Å²	73.7	44%	0.44	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-58.1	171.9	-68.1	177.4	0	0	0	111.5	A105 V115 H117 L204	A105-L107 PolarHBondContact O-N 3.34Å; L107-V115 WeakPolarHBondContact CB-O 3.37Å; L107-V115 HydrophobicContact CD1-CG1 4.25Å; L107-V115 PolarHBondContact N-O 2.55Å; L107-H117 HydrophobicContact CD1-CB 3.91Å; L107-H117 HydrophobicContact CD2-CB 3.95Å; L107-H117 HydrophobicContact CG-CB 3.87Å; L107-L204 HydrophobicContact CD1-CD1 4.01Å
108	T	93.3	Very high	94.5	Very high	78 Å²	78	73 Å²	73	48%	0.479	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	156.7	-174.4	-163.5	0	0	0	0	112.7	V115	T108-V115 HydrophobicContact CG2-CB 4.04Å; T108-V115 HydrophobicContact CG2-CG2 3.99Å; T108-V115 PolarHBondContact N-O 2.9Å; T108-V115 PolarHBondContact O-N 3Å
109	D	92.9	Very high	94.8	Very high	86 Å²	86	71.9 Å²	71.9	46%	0.46	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.7	168.4	-82.6	-38.1	0	0	0	110.5	T114 N131	D109-T114 VanDerWaalsContact OD1-CB 3.31Å; D109-T114 WeakPolarHBondContact OD1-CB 3.49Å; D109-T114 WeakPolarHBondContact OD1-CG2 3.29Å; D109-T114 PolarHBondContact OD1-OG1 2.8Å; D109-N131 PolarHBondContact OD1-ND2 3.1Å
110	G	87.2	Confident	94.8	Very high	38 Å²	38	65.2 Å²	65.2	39%	0.392	33%	0.326	S	S	.	.			trans	-103.3	-172.2	168	0	0	0	0	0	112.1	M112 K113	G110-M112 VanDerWaalsContact C-N 3.31Å; G110-M112 PolarHBondContact O-N 3.4Å; G110-K113 WeakPolarHBondContact CA-O 3.35Å; G110-K113 PolarHBondContact N-O 3.44Å
111	W	89	Confident	94.7	Very high	159 Å²	159	62 Å²	62	60%	0.602	33%	0.332	S	S	*	.	S	Bend	trans	-63.1	-34	-179.1	-88.1	63.2	0	0	0	114.3	E135 M136 R139	W111-E135 HydrophobicContact CD2-CB 4.23Å; W111-E135 HydrophobicContact CD2-CG 4.09Å; W111-E135 HydrophobicContact CE3-CB 4.04Å; W111-E135 HydrophobicContact CE3-CG 3.65Å; W111-E135 HydrophobicContact CH2-CG 4.09Å; W111-E135 HydrophobicContact CZ2-CG 4.46Å; W111-E135 HydrophobicContact CZ3-CG 3.66Å; W111-E135 PolarHBondContact O-N 2.92Å; W111-M136 PolarHBondContact O-N 3.06Å; W111-M136 VanDerWaalsContact O-N 3.09Å; W111-R139 VanDerWaalsContact CH2-CZ 3.49Å
112	M	91.6	Very high	94.6	Very high	12 Å²	12	69.7 Å²	69.7	6%	0.059	37%	0.373	C	S	.	.	S	Bend	trans	-136.7	-5.8	-178.7	78.4	179	-152.1	0	0	114.1	G110 N131 M136 V158 K161 F162	G110-M112 VanDerWaalsContact C-N 3.31Å; G110-M112 PolarHBondContact O-N 3.4Å; M112-N131 PolarHBondContact O-N 3Å; M112-M136 HydrophobicContact CB-CB 4.05Å; M112-M136 HydrophobicContact CB-SD 4.07Å; M112-M136 HydrophobicContact SD-SD 3.88Å; M112-V158 HydrophobicContact CB-CG1 4.31Å; M112-K161 HydrophobicContact CE-CB 3.48Å; M112-K161 VanDerWaalsContact CE-CB 3.48Å; M112-K161 HydrophobicContact SD-CB 3.75Å; M112-K161 HydrophobicContact SD-CD 3.88Å; M112-K161 HydrophobicContact SD-CG 4.46Å; M112-F162 HydrophobicContact CE-CB 4.49Å; M112-F162 HydrophobicContact CE-CD2 4.24Å
113	K	94	Very high	94.6	Very high	16 Å²	16	66.7 Å²	66.7	7%	0.07	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.6	-173.4	-46.8	171.5	-163.5	158.8	0	109.2	G110 K128 L129 F162 E165 D264 D266	G110-K113 WeakPolarHBondContact CA-O 3.35Å; G110-K113 PolarHBondContact N-O 3.44Å; K113-K128 HydrophobicContact CD-CD 4.12Å; K113-L129 CarbonylContact C-O 3.55Å; K113-L129 WeakPolarHBondContact CA-O 3.23Å; K113-F162 HydrophobicContact CD-CE2 4.3Å; K113-F162 HydrophobicContact CG-CD2 4.28Å; K113-F162 HydrophobicContact CG-CE2 4Å; K113-E165 WeakPolarHBondContact CD-OE2 3.42Å; K113-E165 WeakPolarHBondContact CE-OE2 3.48Å; K113-E165 IonicContact NZ-OE1 3.29Å; K113-E165 IonicContact NZ-OE2 2.89Å; K113-E165 PolarHBondContact NZ-OE2 3.19Å; K113-D264 IonicContact NZ-OD1 3.92Å; K113-D264 PolarHBondContact NZ-OD1 3.07Å; K113-D266 IonicContact NZ-OD2 3.82Å; K113-D266 PolarHBondContact NZ-OD2 2.81Å
114	T	95.8	Very high	94.7	Very high	10 Å²	10	64.8 Å²	64.8	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.1	164.9	-58.1	0	0	0	0	108.1	F106 D109 Y116 K128 L129 N131	F106-T114 HydrophobicContact CD2-CG2 3.84Å; F106-T114 HydrophobicContact CE2-CG2 3.77Å; D109-T114 VanDerWaalsContact OD1-CB 3.31Å; D109-T114 WeakPolarHBondContact OD1-CB 3.49Å; D109-T114 WeakPolarHBondContact OD1-CG2 3.29Å; D109-T114 PolarHBondContact OD1-OG1 2.8Å; T114-Y116 HydrophobicContact CG2-CD2 4.2Å; T114-Y116 HydrophobicContact CG2-CE1 4.35Å; T114-Y116 HydrophobicContact CG2-CE2 3.42Å; T114-Y116 VanDerWaalsContact CG2-CE2 3.42Å; T114-Y116 WeakPolarHBondContact CG2-OH 3.27Å; T114-K128 CarbonylContact O-C 3.6Å; T114-K128 WeakPolarHBondContact O-CA 3.4Å; T114-L129 PolarHBondContact N-O 3.11Å; T114-L129 PolarHBondContact O-N 3.19Å; T114-N131 WeakPolarHBondContact OG1-CB 3.22Å; T114-N131 PolarHBondContact OG1-ND2 2.76Å
115	V	96.1	Very high	94.9	Very high	27 Å²	27	59.2 Å²	59.2	16%	0.164	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.2	-177.4	-168.2	0	0	0	0	109.6	L107 T108 A126 V127 K128	L107-V115 WeakPolarHBondContact CB-O 3.37Å; L107-V115 HydrophobicContact CD1-CG1 4.25Å; L107-V115 PolarHBondContact N-O 2.55Å; T108-V115 HydrophobicContact CG2-CB 4.04Å; T108-V115 HydrophobicContact CG2-CG2 3.99Å; T108-V115 PolarHBondContact N-O 2.9Å; T108-V115 PolarHBondContact O-N 3Å; V115-A126 HydrophobicContact CG1-CB 4.24Å; V115-V127 CarbonylContact C-O 3.47Å; V115-V127 WeakPolarHBondContact CA-O 3.31Å; V115-K128 HydrophobicContact CG1-CG 4.44Å; V115-K128 HydrophobicContact CG2-CG 4.22Å
116	Y	97.6	Very high	94.9	Very high	64 Å²	64	57.3 Å²	57.3	25%	0.251	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.7	175.5	-59.4	-94.4	0	0	0	110.5	A105 F106 T114 A126 V127 L129	A105-Y116 CarbonylContact O-C 3.45Å; A105-Y116 WeakPolarHBondContact O-CA 3.4Å; F106-Y116 HydrophobicContact CB-CD1 4.31Å; F106-Y116 HydrophobicContact CB-CE1 4.24Å; F106-Y116 HydrophobicContact CD2-CE1 4.4Å; T114-Y116 HydrophobicContact CG2-CD2 4.2Å; T114-Y116 HydrophobicContact CG2-CE1 4.35Å; T114-Y116 HydrophobicContact CG2-CE2 3.42Å; T114-Y116 VanDerWaalsContact CG2-CE2 3.42Å; T114-Y116 WeakPolarHBondContact CG2-OH 3.27Å; Y116-A126 CarbonylContact O-C 3.53Å; Y116-A126 WeakPolarHBondContact O-CA 3.34Å; Y116-V127 PolarHBondContact N-O 2.5Å; Y116-V127 PolarHBondContact O-N 3.17Å; Y116-L129 HydrophobicContact CD2-CD1 4.1Å; Y116-L129 HydrophobicContact CD2-CG 4.25Å; Y116-L129 HydrophobicContact CE2-CB 4.34Å; Y116-L129 HydrophobicContact CE2-CD1 3.77Å; Y116-L129 HydrophobicContact CE2-CG 4.17Å
117	H	97.9	Very high	95	Very high	42 Å²	42	51.8 Å²	51.8	19%	0.194	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	135.4	160.3	-179.6	-90.5	0	0	0	108.6	M104 A105 L107 H119 L204	M104-H117 CarbonylContact C-O 3.54Å; M104-H117 VanDerWaalsContact CA-O 3.28Å; M104-H117 WeakPolarHBondContact CA-O 3.12Å; A105-H117 HydrophobicContact CB-CB 4.35Å; A105-H117 PolarHBondContact N-O 3Å; A105-H117 PolarHBondContact O-N 3.41Å; L107-H117 HydrophobicContact CD1-CB 3.91Å; L107-H117 HydrophobicContact CD2-CB 3.95Å; L107-H117 HydrophobicContact CG-CB 3.87Å; H117-H119 AromaticContact CE1-CE1 3.38Å; H117-H119 PolarHBondContact CE1-CE1 2.8Å; H117-H119 AromaticContact CE1-ND1 3.91Å; H117-H119 AromaticContact CE1-NE2 3.89Å; H117-L204 WeakPolarHBondContact CD2-CD2 3.43Å; H117-L204 WeakPolarHBondContact NE2-CD2 3.4Å
118	A	98.1	Very high	95.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	168.4	171.5	0	0	0	0	0	110.9	L101 R102 M104 S124 V125 V127	L101-A118 HydrophobicContact CB-CB 4.5Å; L101-A118 HydrophobicContact CD2-CB 4.24Å; R102-A118 WeakPolarHBondContact O-CA 3.45Å; M104-A118 HydrophobicContact CG-CB 4.22Å; A118-S124 WeakPolarHBondContact O-CA 3.27Å; A118-V125 HydrophobicContact CB-CG2 4.04Å; A118-V125 PolarHBondContact N-O 3.39Å; A118-V125 WeakPolarHBondContact O-CG2 3.23Å; A118-V125 PolarHBondContact O-N 2.55Å; A118-V127 HydrophobicContact CB-CG2 3.75Å
119	H	97.6	Very high	95.2	Very high	64 Å²	64	46.7 Å²	46.7	30%	0.296	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.6	173	-68.1	84.6	0	0	0	110.9	L101 R102 H117 R123	L101-H119 WeakPolarHBondContact CA-O 3.23Å; R102-H119 PolarHBondContact N-O 2.61Å; R102-H119 PolarHBondContact O-N 2.61Å; H117-H119 AromaticContact CE1-CE1 3.38Å; H117-H119 PolarHBondContact CE1-CE1 2.8Å; H117-H119 AromaticContact CE1-ND1 3.91Å; H117-H119 AromaticContact CE1-NE2 3.89Å; H119-R123 WeakPolarHBondContact CA-O 3.48Å
120	L	96	Very high	95.3	Very high	22 Å²	22	43.2 Å²	43.2	12%	0.115	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	90.6	168.4	-178.8	70.1	0	0	0	108.2	L92 R100 L101 N122 R123 V125 I181	L92-L120 HydrophobicContact CD1-CD1 3.87Å; L92-L120 HydrophobicContact CD1-CD2 3.75Å; L92-L120 HydrophobicContact CD1-CG 4.46Å; R100-L120 HydrophobicContact CB-CD1 3.77Å; L101-L120 HydrophobicContact CD2-CB 4.19Å; L101-L120 HydrophobicContact CD2-CD1 4.33Å; L120-N122 PolarHBondContact O-N 3.06Å; L120-R123 PolarHBondContact N-O 3.37Å; L120-R123 WeakPolarHBondContact O-CB 2.95Å; L120-R123 PolarHBondContact O-N 3.5Å; L120-R123 VanDerWaalsContact O-N 3.14Å; L120-V125 HydrophobicContact CB-CG1 4.03Å; L120-V125 HydrophobicContact CB-CG2 4.37Å; L120-I181 HydrophobicContact CD2-CG2 3.88Å
121	G	93.3	Very high	95.6	Very high	59 Å²	59	42.5 Å²	42.5	61%	0.608	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	-125.9	-165.7	0	0	0	0	0	110.2	R123	G121-R123 VanDerWaalsContact C-N 3.31Å
122	N	93.6	Very high	95.7	Very high	177 Å²	177	36.5 Å²	36.5	95%	0.947	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	3.1	177.3	-65.1	-9.7	0	0	0	113.6	L120	L120-N122 PolarHBondContact O-N 3.06Å
123	R	95.1	Very high	95.6	Very high	90 Å²	90	43.2 Å²	43.2	34%	0.34	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124	-178.1	-174.3	178.5	-175.3	171.5	7.3	110.1	H119 L120 G121 V125 E179 E203	H119-R123 WeakPolarHBondContact CA-O 3.48Å; L120-R123 PolarHBondContact N-O 3.37Å; L120-R123 WeakPolarHBondContact O-CB 2.95Å; L120-R123 PolarHBondContact O-N 3.5Å; L120-R123 VanDerWaalsContact O-N 3.14Å; G121-R123 VanDerWaalsContact C-N 3.31Å; R123-V125 HydrophobicContact CG-CG1 4.12Å; R123-E179 IonicContact CZ-OE2 3.22Å; R123-E179 IonicContact NH1-OE2 3.16Å; R123-E179 PolarHBondContact NH1-OE2 2.65Å; R123-E179 VanDerWaalsContact NH1-OE2 3.08Å; R123-E179 IonicContact NH2-OE2 2.65Å; R123-E179 PolarHBondContact NH2-OE2 2.76Å; R123-E203 VanDerWaalsContact NH2-CB 3.29Å
124	S	97.3	Very high	95.5	Very high	48 Å²	48	42.6 Å²	42.6	34%	0.336	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	136	166.4	-54	0	0	0	0	110.5	A118	A118-S124 WeakPolarHBondContact O-CA 3.27Å
125	V	98	Very high	95.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	154	-176.8	-61.5	0	0	0	0	110.4	L101 A118 L120 R123 V127 I181 V201 S202	L101-V125 HydrophobicContact CD2-CG2 3.69Å; A118-V125 HydrophobicContact CB-CG2 4.04Å; A118-V125 PolarHBondContact N-O 3.39Å; A118-V125 WeakPolarHBondContact O-CG2 3.23Å; A118-V125 PolarHBondContact O-N 2.55Å; L120-V125 HydrophobicContact CB-CG1 4.03Å; L120-V125 HydrophobicContact CB-CG2 4.37Å; R123-V125 HydrophobicContact CG-CG1 4.12Å; V125-V127 HydrophobicContact CG2-CG2 4.26Å; V125-I181 HydrophobicContact CB-CD1 4.39Å; V125-I181 HydrophobicContact CG1-CD1 3.55Å; V125-V201 HydrophobicContact CB-CG1 3.99Å; V125-V201 HydrophobicContact CG1-CG1 4.41Å; V125-V201 HydrophobicContact CG2-CG1 3.99Å; V125-S202 WeakPolarHBondContact CA-O 3.5Å; V125-S202 WeakPolarHBondContact CB-O 3.36Å
126	A	97.7	Very high	95.1	Very high	10 Å²	10	44.8 Å²	44.8	8%	0.083	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132	168	0	0	0	0	0	109.1	V115 Y116 V201 S202 L204	V115-A126 HydrophobicContact CG1-CB 4.24Å; Y116-A126 CarbonylContact O-C 3.53Å; Y116-A126 WeakPolarHBondContact O-CA 3.34Å; A126-V201 WeakPolarHBondContact O-CA 3.33Å; A126-S202 PolarHBondContact N-O 2.86Å; A126-S202 PolarHBondContact O-N 2.9Å; A126-L204 HydrophobicContact CB-CD1 4.09Å
127	V	97.7	Very high	94.9	Very high	1 Å²	1	42 Å²	42	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	109.9	177.2	-174.4	0	0	0	0	107.3	L101 V115 Y116 A118 V125 L129 V200 V201	L101-V127 HydrophobicContact CD1-CG1 4.4Å; L101-V127 HydrophobicContact CD1-CG2 3.73Å; L101-V127 HydrophobicContact CD2-CG2 4.44Å; V115-V127 CarbonylContact C-O 3.47Å; V115-V127 WeakPolarHBondContact CA-O 3.31Å; Y116-V127 PolarHBondContact N-O 2.5Å; Y116-V127 PolarHBondContact O-N 3.17Å; A118-V127 HydrophobicContact CB-CG2 3.75Å; V125-V127 HydrophobicContact CG2-CG2 4.26Å; V127-L129 HydrophobicContact CG1-CD2 3.97Å; V127-L129 HydrophobicContact CG1-CG 4.19Å; V127-V200 WeakPolarHBondContact CA-O 3.29Å; V127-V201 HydrophobicContact CG1-CG2 4.48Å; V127-V201 HydrophobicContact CG2-CG2 4.48Å
128	K	96.6	Very high	94.7	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.07	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.8	172.5	-51.3	-173.9	-174.2	178.1	0	107.7	K113 T114 V115 F162 E165 A199 V200 V263	K113-K128 HydrophobicContact CD-CD 4.12Å; T114-K128 CarbonylContact O-C 3.6Å; T114-K128 WeakPolarHBondContact O-CA 3.4Å; V115-K128 HydrophobicContact CG1-CG 4.44Å; V115-K128 HydrophobicContact CG2-CG 4.22Å; K128-F162 WeakPolarHBondContact O-CZ 3.29Å; K128-E165 WeakPolarHBondContact CD-OE1 3.33Å; K128-E165 IonicContact NZ-OE1 2.67Å; K128-E165 PolarHBondContact NZ-OE1 3.27Å; K128-A199 CarbonylContact O-C 3.53Å; K128-A199 VanDerWaalsContact O-CA 3.29Å; K128-A199 WeakPolarHBondContact O-CA 3.48Å; K128-V200 HydrophobicContact CB-CB 4.26Å; K128-V200 PolarHBondContact N-O 3.33Å; K128-V200 PolarHBondContact O-N 2.76Å; K128-V263 PolarHBondContact NZ-O 2.97Å
129	L	96	Very high	94.6	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	156.9	171.2	-60.4	-178.2	0	0	0	109.2	K113 T114 Y116 V127 N131 A199	K113-L129 CarbonylContact C-O 3.55Å; K113-L129 WeakPolarHBondContact CA-O 3.23Å; T114-L129 PolarHBondContact N-O 3.11Å; T114-L129 PolarHBondContact O-N 3.19Å; Y116-L129 HydrophobicContact CD2-CD1 4.1Å; Y116-L129 HydrophobicContact CD2-CG 4.25Å; Y116-L129 HydrophobicContact CE2-CB 4.34Å; Y116-L129 HydrophobicContact CE2-CD1 3.77Å; Y116-L129 HydrophobicContact CE2-CG 4.17Å; V127-L129 HydrophobicContact CG1-CD2 3.97Å; V127-L129 HydrophobicContact CG1-CG 4.19Å; L129-N131 PolarHBondContact O-N 3.49Å; L129-A199 HydrophobicContact CD2-CB 3.52Å
130	V	94.9	Very high	94.3	Very high	13 Å²	13	51 Å²	51	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.6	173.7	177.7	0	0	0	0	110.5	A132 V158 F162 F195 L198	V130-A132 PolarHBondContact O-N 2.94Å; V130-V158 HydrophobicContact CG1-CG1 3.8Å; V130-F162 HydrophobicContact CG2-CD2 3.56Å; V130-F162 HydrophobicContact CG2-CE2 3.63Å; V130-F162 HydrophobicContact CG2-CG 4.07Å; V130-F162 HydrophobicContact CG2-CZ 4.19Å; V130-F195 HydrophobicContact CB-CZ 4.43Å; V130-F195 HydrophobicContact CG1-CD1 4.29Å; V130-F195 HydrophobicContact CG1-CD2 4.42Å; V130-F195 HydrophobicContact CG1-CE1 3.56Å; V130-F195 HydrophobicContact CG1-CE2 3.7Å; V130-F195 HydrophobicContact CG1-CZ 3.23Å; V130-L198 HydrophobicContact CG2-CB 3.53Å; V130-L198 HydrophobicContact CG2-CD1 3.9Å; V130-L198 HydrophobicContact CG2-CG 4.36Å; V130-L198 PolarHBondContact N-O 3.47Å
131	N	94.3	Very high	94.2	Very high	23 Å²	23	53.5 Å²	53.5	12%	0.123	28%	0.281	C	S	.	.			trans	-89.1	95.3	172.8	-170.6	-16.2	0	0	0	109.5	D109 M112 T114 L129 N133 G134	D109-N131 PolarHBondContact OD1-ND2 3.1Å; M112-N131 PolarHBondContact O-N 3Å; T114-N131 WeakPolarHBondContact OG1-CB 3.22Å; T114-N131 PolarHBondContact OG1-ND2 2.76Å; L129-N131 PolarHBondContact O-N 3.49Å; N131-N133 PolarHBondContact O-N 3.39Å; N131-N133 PolarHBondContact OD1-N 2.82Å; N131-G134 PolarHBondContact O-N 3.14Å; N131-G134 PolarHBondContact OD1-N 3.35Å
132	A	90.2	Very high	94.1	Very high	33 Å²	33	54.5 Å²	54.5	27%	0.273	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.8	179.5	0	0	0	0	0	113.6	V130 M137 F195	V130-A132 PolarHBondContact O-N 2.94Å; A132-M137 WeakPolarHBondContact O-CB 3.22Å; A132-F195 HydrophobicContact CB-CD1 4.5Å; A132-F195 HydrophobicContact CB-CE1 4.02Å
133	N	90	Very high	93.9	Very high	152 Å²	152	51.3 Å²	51.3	81%	0.813	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	6.2	176.6	-61.1	-35.5	0	0	0	112.5	N131	N131-N133 PolarHBondContact O-N 3.39Å; N131-N133 PolarHBondContact OD1-N 2.82Å
134	G	91.4	Very high	93.4	Very high	4 Å²	4	53.3 Å²	53.3	4%	0.041	29%	0.291	C	S	.	.	S	Bend	trans	-68.5	164.2	-176.6	0	0	0	0	0	113.1	N131 M136 M137 R138	N131-G134 PolarHBondContact O-N 3.14Å; N131-G134 PolarHBondContact OD1-N 3.35Å; G134-M136 PolarHBondContact O-N 3.34Å; G134-M136 VanDerWaalsContact O-N 3.17Å; G134-M137 PolarHBondContact O-N 2.98Å; G134-M137 VanDerWaalsContact O-N 3.13Å; G134-R138 PolarHBondContact O-N 3.11Å
135	E	93.3	Very high	92.6	Very high	50 Å²	50	53.3 Å²	53.3	23%	0.234	30%	0.298	C	S	.	.	H	α-helix	trans	-54.2	-38.2	-177.6	-178.1	64.5	-175	0	0	112.8	W111 R138 R139	W111-E135 HydrophobicContact CD2-CB 4.23Å; W111-E135 HydrophobicContact CD2-CG 4.09Å; W111-E135 HydrophobicContact CE3-CB 4.04Å; W111-E135 HydrophobicContact CE3-CG 3.65Å; W111-E135 HydrophobicContact CH2-CG 4.09Å; W111-E135 HydrophobicContact CZ2-CG 4.46Å; W111-E135 HydrophobicContact CZ3-CG 3.66Å; W111-E135 PolarHBondContact O-N 2.92Å; E135-R138 PolarHBondContact O-N 3.48Å; E135-R138 IonicContact OE1-CZ 2.7Å; E135-R138 IonicContact OE1-NH2 2.93Å; E135-R138 PolarHBondContact OE1-NH2 3.02Å; E135-R138 IonicContact OE2-CZ 2.83Å; E135-R138 VanDerWaalsContact OE2-CZ 3.22Å; E135-R138 IonicContact OE2-NE 2.83Å; E135-R138 PolarHBondContact OE2-NE 3.39Å; E135-R138 IonicContact OE2-NH2 2.63Å; E135-R138 PolarHBondContact OE2-NH2 3.37Å; E135-R139 WeakPolarHBondContact O-CB 3.37Å; E135-R139 WeakPolarHBondContact O-CG 3.38Å; E135-R139 PolarHBondContact O-N 3.46Å; E135-R139 IonicContact OE1-CZ 3.45Å; E135-R139 VanDerWaalsContact OE1-CZ 3.25Å; E135-R139 IonicContact OE1-NE 2.68Å; E135-R139 PolarHBondContact OE1-NE 2.94Å; E135-R139 IonicContact OE1-NH2 3.87Å; E135-R139 PolarHBondContact OE1-NH2 3.04Å
136	M	91.5	Very high	92	Very high	32 Å²	32	57.9 Å²	57.9	16%	0.158	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-44.9	179.6	-173.6	169.3	173.4	0	0	112.6	W111 M112 G134 C140 T157 V158 K161	W111-M136 PolarHBondContact O-N 3.06Å; W111-M136 VanDerWaalsContact O-N 3.09Å; M112-M136 HydrophobicContact CB-CB 4.05Å; M112-M136 HydrophobicContact CB-SD 4.07Å; M112-M136 HydrophobicContact SD-SD 3.88Å; G134-M136 PolarHBondContact O-N 3.34Å; G134-M136 VanDerWaalsContact O-N 3.17Å; M136-C140 WeakPolarHBondContact O-CB 3.23Å; M136-C140 PolarHBondContact O-N 2.93Å; M136-T157 HydrophobicContact CE-CG2 3.85Å; M136-V158 HydrophobicContact CB-CG2 4.46Å; M136-V158 HydrophobicContact CE-CG2 3.9Å; M136-V158 HydrophobicContact CG-CG2 3.84Å; M136-V158 HydrophobicContact SD-CG2 3.88Å; M136-K161 HydrophobicContact CE-CD 3.73Å; M136-K161 HydrophobicContact CE-CG 4.34Å; M136-K161 HydrophobicContact SD-CD 3.95Å
137	M	93.2	Very high	91.3	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.03	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-46.4	175.7	-79.7	-62.6	-70.3	0	0	110.7	A132 G134 R139 C140 L141 C154 R155 V158 F195	A132-M137 WeakPolarHBondContact O-CB 3.22Å; G134-M137 PolarHBondContact O-N 2.98Å; G134-M137 VanDerWaalsContact O-N 3.13Å; M137-R139 VanDerWaalsContact C-N 3.35Å; M137-R139 PolarHBondContact O-N 2.93Å; M137-C140 PolarHBondContact O-N 2.84Å; M137-L141 HydrophobicContact CE-CD1 4.33Å; M137-L141 WeakPolarHBondContact O-CB 2.9Å; M137-L141 VanDerWaalsContact O-CG 3.29Å; M137-L141 WeakPolarHBondContact O-CG 3.29Å; M137-L141 PolarHBondContact O-N 3.31Å; M137-C154 HydrophobicContact CE-CB 4.11Å; M137-C154 HydrophobicContact SD-CB 3.98Å; M137-R155 HydrophobicContact CE-CG 4.03Å; M137-V158 HydrophobicContact CG-CG2 4.1Å; M137-V158 HydrophobicContact SD-CB 4.43Å; M137-V158 HydrophobicContact SD-CG2 3.72Å; M137-F195 HydrophobicContact CE-CE1 4.22Å; M137-F195 HydrophobicContact CE-CZ 4.25Å; M137-F195 HydrophobicContact CG-CE1 4.47Å; M137-F195 HydrophobicContact CG-CZ 4.16Å; M137-F195 HydrophobicContact SD-CE1 4.23Å; M137-F195 HydrophobicContact SD-CZ 3.72Å
138	R	93.4	Very high	90.5	Very high	144 Å²	144	69.3 Å²	69.3	54%	0.543	39%	0.393	S	S	.	.	H	α-helix	trans	-57.9	-44.1	178.8	-169.1	-176.8	69.7	80	-3.8	112.5	G134 E135 A142	G134-R138 PolarHBondContact O-N 3.11Å; E135-R138 PolarHBondContact O-N 3.48Å; E135-R138 IonicContact OE1-CZ 2.7Å; E135-R138 IonicContact OE1-NH2 2.93Å; E135-R138 PolarHBondContact OE1-NH2 3.02Å; E135-R138 IonicContact OE2-CZ 2.83Å; E135-R138 VanDerWaalsContact OE2-CZ 3.22Å; E135-R138 IonicContact OE2-NE 2.83Å; E135-R138 PolarHBondContact OE2-NE 3.39Å; E135-R138 IonicContact OE2-NH2 2.63Å; E135-R138 PolarHBondContact OE2-NH2 3.37Å; R138-A142 WeakPolarHBondContact O-CB 3.24Å; R138-A142 PolarHBondContact O-N 2.8Å; R138-A142 VanDerWaalsContact O-N 3.09Å
139	R	94.5	Very high	90	Very high	134 Å²	134	71.7 Å²	71.7	51%	0.506	41%	0.411	S	S	.	.	H	α-helix	trans	-67.8	-38.1	177	-75.2	-176.8	-175.8	-160.8	1.8	113	W111 E135 M137 A142	W111-R139 VanDerWaalsContact CH2-CZ 3.49Å; E135-R139 WeakPolarHBondContact O-CB 3.37Å; E135-R139 WeakPolarHBondContact O-CG 3.38Å; E135-R139 PolarHBondContact O-N 3.46Å; E135-R139 IonicContact OE1-CZ 3.45Å; E135-R139 VanDerWaalsContact OE1-CZ 3.25Å; E135-R139 IonicContact OE1-NE 2.68Å; E135-R139 PolarHBondContact OE1-NE 2.94Å; E135-R139 IonicContact OE1-NH2 3.87Å; E135-R139 PolarHBondContact OE1-NH2 3.04Å; M137-R139 VanDerWaalsContact C-N 3.35Å; M137-R139 PolarHBondContact O-N 2.93Å; R139-A142 PolarHBondContact O-N 3.01Å
140	C	93.1	Very high	89.8	Confident	17 Å²	17	70.5 Å²	70.5	12%	0.115	41%	0.405	C	S	.	.	H	α-helix	trans	-67	-44.1	177.3	-175.6	0	0	0	0	111.1	M136 M137 A142 Q143 C154	M136-C140 WeakPolarHBondContact O-CB 3.23Å; M136-C140 PolarHBondContact O-N 2.93Å; M137-C140 PolarHBondContact O-N 2.84Å; C140-A142 PolarHBondContact O-N 3.18Å; C140-Q143 VanDerWaalsContact O-CB 3.31Å; C140-Q143 WeakPolarHBondContact O-CB 3.18Å; C140-Q143 VanDerWaalsContact O-CG 3.32Å; C140-Q143 WeakPolarHBondContact O-CG 3.38Å; C140-Q143 PolarHBondContact O-N 3.21Å; C140-Q143 VanDerWaalsContact O-N 3.16Å; C140-C154 HydrophobicContact CB-CB 3.76Å; C140-C154 WeakPolarHBondContact CB-SG 3.5Å; C140-C154 WeakPolarHBondContact SG-CA 3.29Å; C140-C154 WeakPolarHBondContact SG-CB 3.45Å; C140-C154 CovalentContact SG-SG 2.03Å; C140-C154 PolarHBondContact SG-SG 3.43Å
141	L	92.8	Very high	89.7	Confident	74 Å²	74	73.5 Å²	73.5	39%	0.387	42%	0.419	S	S	.	.	H	α-helix	trans	-69.9	-18	178.2	-67.6	171.7	0	0	0	113.7	M137 Q143 L150 Q151 C154	M137-L141 HydrophobicContact CE-CD1 4.33Å; M137-L141 WeakPolarHBondContact O-CB 2.9Å; M137-L141 VanDerWaalsContact O-CG 3.29Å; M137-L141 WeakPolarHBondContact O-CG 3.29Å; M137-L141 PolarHBondContact O-N 3.31Å; L141-Q143 PolarHBondContact O-N 3.16Å; L141-L150 HydrophobicContact CD2-CG 4.32Å; L141-Q151 HydrophobicContact CD2-CB 4.3Å; L141-C154 HydrophobicContact CD2-CB 4.46Å
142	A	92	Very high	89.5	Confident	81 Å²	81	76.1 Å²	76.1	67%	0.669	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.1	173	0	0	0	0	0	113.4	R138 R139 C140	R138-A142 WeakPolarHBondContact O-CB 3.24Å; R138-A142 PolarHBondContact O-N 2.8Å; R138-A142 VanDerWaalsContact O-N 3.09Å; R139-A142 PolarHBondContact O-N 3.01Å; C140-A142 PolarHBondContact O-N 3.18Å
143	Q	89.3	Confident	89.7	Confident	110 Å²	110	80.1 Å²	80.1	51%	0.514	44%	0.441	S	S	.	.	S	Bend	trans	-74.7	154	175.2	-60.8	176.2	21.8	0	0	111	C140 L141 L150	C140-Q143 VanDerWaalsContact O-CB 3.31Å; C140-Q143 WeakPolarHBondContact O-CB 3.18Å; C140-Q143 VanDerWaalsContact O-CG 3.32Å; C140-Q143 WeakPolarHBondContact O-CG 3.38Å; C140-Q143 PolarHBondContact O-N 3.21Å; C140-Q143 VanDerWaalsContact O-N 3.16Å; L141-Q143 PolarHBondContact O-N 3.16Å; Q143-L150 HydrophobicContact CB-CD1 4.36Å; Q143-L150 VanDerWaalsContact O-CD2 3.24Å; Q143-L150 WeakPolarHBondContact O-CD2 3.37Å
144	S	84.2	Confident	89.9	Confident	131 Å²	131	72.9 Å²	72.9	92%	0.916	40%	0.403	S	S	*	.	S	Bend	trans	-74.6	132.7	175.8	-51.9	0	0	0	0	111.4
145	G	81.4	Confident	90	Very high	48 Å²	48	73.8 Å²	73.8	50%	0.495	41%	0.405	S	S	.	.	S	Bend	trans	169.6	170.3	173.9	0	0	0	0	0	112.6	A147	G145-A147 PolarHBondContact O-N 3.44Å
146	P	84.7	Confident	90	Very high	97 Å²	97	75.5 Å²	75.5	63%	0.63	41%	0.413	S	S	*	.			trans	-63.3	129.2	173.2	-14.7	27.2	0	0	0	110.6	E148 S149 L150	P146-E148 PolarHBondContact O-N 3.45Å; P146-S149 WeakPolarHBondContact CB-OG 3.41Å; P146-S149 WeakPolarHBondContact CD-OG 3.28Å; P146-S149 PolarHBondContact O-N 3.33Å; P146-S149 PolarHBondContact O-OG 3.23Å; P146-L150 WeakPolarHBondContact O-CB 3.22Å; P146-L150 PolarHBondContact O-N 2.83Å
147	A	82	Confident	89.9	Confident	77 Å²	77	77 Å²	77	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-53.2	-51	-167.1	0	0	0	0	0	114.3	G145 L150 Q151	G145-A147 PolarHBondContact O-N 3.44Å; A147-L150 PolarHBondContact O-N 3.23Å; A147-Q151 PolarHBondContact O-N 3.01Å
148	E	80.6	Confident	89.9	Confident	173 Å²	173	76.7 Å²	76.7	81%	0.808	42%	0.422	S	S	*	.	H	α-helix	trans	-64.1	-46.5	-179.1	-68.9	-177.3	169.9	0	0	112.2	P146 L150 Q151 H152	P146-E148 PolarHBondContact O-N 3.45Å; E148-L150 VanDerWaalsContact C-N 3.27Å; E148-L150 PolarHBondContact O-N 3.02Å; E148-Q151 PolarHBondContact O-N 3.06Å; E148-H152 PolarHBondContact O-N 3.46Å; E148-H152 VanDerWaalsContact O-N 3.09Å
149	S	86.9	Confident	89.8	Confident	66 Å²	66	70.2 Å²	70.2	46%	0.462	40%	0.4	S	S	.	.	H	α-helix	trans	-63.4	-35.4	177.8	71.7	0	0	0	0	112.2	P146 K153	P146-S149 WeakPolarHBondContact CB-OG 3.41Å; P146-S149 WeakPolarHBondContact CD-OG 3.28Å; P146-S149 PolarHBondContact O-N 3.33Å; P146-S149 PolarHBondContact O-OG 3.23Å; S149-K153 VanDerWaalsContact O-CB 3.29Å; S149-K153 WeakPolarHBondContact O-CB 3.32Å; S149-K153 PolarHBondContact O-N 2.65Å; S149-K153 VanDerWaalsContact O-N 3.07Å
150	L	92.1	Very high	89.6	Confident	16 Å²	16	70.5 Å²	70.5	8%	0.084	40%	0.401	C	S	.	.	H	α-helix	trans	-68.9	-44.7	178.2	-176.9	62.9	0	0	0	110.4	L141 Q143 P146 A147 E148 H152 K153 C154	L141-L150 HydrophobicContact CD2-CG 4.32Å; Q143-L150 HydrophobicContact CB-CD1 4.36Å; Q143-L150 VanDerWaalsContact O-CD2 3.24Å; Q143-L150 WeakPolarHBondContact O-CD2 3.37Å; P146-L150 WeakPolarHBondContact O-CB 3.22Å; P146-L150 PolarHBondContact O-N 2.83Å; A147-L150 PolarHBondContact O-N 3.23Å; E148-L150 VanDerWaalsContact C-N 3.27Å; E148-L150 PolarHBondContact O-N 3.02Å; L150-H152 PolarHBondContact O-N 3.44Å; L150-K153 PolarHBondContact O-N 3.08Å; L150-C154 WeakPolarHBondContact O-CB 3.48Å; L150-C154 PolarHBondContact O-N 3.02Å; L150-C154 PolarHBondContact O-SG 3.49Å
151	Q	92	Very high	89.4	Confident	76 Å²	76	74.1 Å²	74.1	36%	0.355	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-46	179.2	-170.2	165.8	5.2	0	0	112	L141 A147 E148 C154 R155	L141-Q151 HydrophobicContact CD2-CB 4.3Å; A147-Q151 PolarHBondContact O-N 3.01Å; E148-Q151 PolarHBondContact O-N 3.06Å; Q151-C154 PolarHBondContact O-N 3.13Å; Q151-R155 WeakPolarHBondContact O-CG 3.33Å; Q151-R155 PolarHBondContact O-N 2.82Å
152	H	91.7	Very high	89.3	Confident	78 Å²	78	70.6 Å²	70.6	36%	0.361	40%	0.396	S	S	.	.	H	α-helix	trans	-59.4	-49.7	175.2	-176.6	-87.4	0	0	0	111.7	E148 L150 C154 R155 E156 S190	E148-H152 PolarHBondContact O-N 3.46Å; E148-H152 VanDerWaalsContact O-N 3.09Å; L150-H152 PolarHBondContact O-N 3.44Å; H152-C154 VanDerWaalsContact C-N 3.29Å; H152-C154 PolarHBondContact O-N 3.06Å; H152-R155 PolarHBondContact O-N 2.85Å; H152-R155 VanDerWaalsContact O-N 3.16Å; H152-E156 IonicContact CE1-OE1 2.63Å; H152-E156 PolarHBondContact CE1-OE1 3.09Å; H152-E156 IonicContact CE1-OE2 2.76Å; H152-E156 IonicContact ND1-OE1 3.22Å; H152-E156 IonicContact ND1-OE2 2.81Å; H152-E156 PolarHBondContact O-N 2.88Å; H152-S190 WeakPolarHBondContact NE2-CB 2.97Å
153	K	93	Very high	89.2	Confident	117 Å²	117	67.1 Å²	67.1	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-59.3	-38.3	178.2	-176.8	-178.7	178.7	-174.3	0	112.7	S149 L150 T157	S149-K153 VanDerWaalsContact O-CB 3.29Å; S149-K153 WeakPolarHBondContact O-CB 3.32Å; S149-K153 PolarHBondContact O-N 2.65Å; S149-K153 VanDerWaalsContact O-N 3.07Å; L150-K153 PolarHBondContact O-N 3.08Å; K153-T157 PolarHBondContact O-N 3.35Å; K153-T157 PolarHBondContact O-OG1 3.38Å
154	C	94.1	Very high	89.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.3	-42.8	176.6	-68.5	0	0	0	0	112	M137 C140 L141 L150 Q151 H152 T157 V158	M137-C154 HydrophobicContact CE-CB 4.11Å; M137-C154 HydrophobicContact SD-CB 3.98Å; C140-C154 HydrophobicContact CB-CB 3.76Å; C140-C154 WeakPolarHBondContact CB-SG 3.5Å; C140-C154 WeakPolarHBondContact SG-CA 3.29Å; C140-C154 WeakPolarHBondContact SG-CB 3.45Å; C140-C154 CovalentContact SG-SG 2.03Å; C140-C154 PolarHBondContact SG-SG 3.43Å; L141-C154 HydrophobicContact CD2-CB 4.46Å; L150-C154 WeakPolarHBondContact O-CB 3.48Å; L150-C154 PolarHBondContact O-N 3.02Å; L150-C154 PolarHBondContact O-SG 3.49Å; Q151-C154 PolarHBondContact O-N 3.13Å; H152-C154 VanDerWaalsContact C-N 3.29Å; H152-C154 PolarHBondContact O-N 3.06Å; C154-T157 PolarHBondContact O-N 2.97Å; C154-V158 WeakPolarHBondContact O-CG2 3.47Å; C154-V158 PolarHBondContact O-N 2.78Å
155	R	94.9	Very high	89.7	Confident	23 Å²	23	56.3 Å²	56.3	9%	0.087	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-42.7	174.6	-71.2	179.5	179.8	162.1	0.2	111.8	M137 Q151 H152 T157 V158 G159 S190 E192 F195	M137-R155 HydrophobicContact CE-CG 4.03Å; Q151-R155 WeakPolarHBondContact O-CG 3.33Å; Q151-R155 PolarHBondContact O-N 2.82Å; H152-R155 PolarHBondContact O-N 2.85Å; H152-R155 VanDerWaalsContact O-N 3.16Å; R155-T157 VanDerWaalsContact C-N 3.33Å; R155-T157 PolarHBondContact O-N 2.83Å; R155-V158 PolarHBondContact O-N 2.95Å; R155-G159 PolarHBondContact O-N 3.06Å; R155-S190 WeakPolarHBondContact CD-O 3.03Å; R155-E192 VanDerWaalsContact CZ-CA 3.44Å; R155-E192 IonicContact CZ-OE2 2.65Å; R155-E192 VanDerWaalsContact NH1-CB 3.33Å; R155-E192 VanDerWaalsContact NH2-CD 3.26Å; R155-E192 IonicContact NH2-OE2 3.85Å; R155-E192 PolarHBondContact NH2-OE2 2.97Å; R155-F195 HydrophobicContact CB-CD2 3.62Å; R155-F195 HydrophobicContact CB-CE2 3.81Å; R155-F195 HydrophobicContact CB-CG 4.02Å; R155-F195 HydrophobicContact CB-CZ 4.34Å; R155-F195 HydrophobicContact CG-CB 4.26Å; R155-F195 HydrophobicContact CG-CD1 3.78Å; R155-F195 HydrophobicContact CG-CD2 3.73Å; R155-F195 HydrophobicContact CG-CE1 3.92Å; R155-F195 HydrophobicContact CG-CE2 3.88Å; R155-F195 HydrophobicContact CG-CG 3.66Å; R155-F195 HydrophobicContact CG-CZ 3.94Å; R155-F195 WeakPolarHBondContact O-CE2 3.16Å
156	E	92.2	Very high	90.3	Very high	86 Å²	86	54 Å²	54	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-57.9	-45	173.5	-76.2	-177.9	142.2	0	0	112.1	H152 G159 R160 S190	H152-E156 IonicContact CE1-OE1 2.63Å; H152-E156 PolarHBondContact CE1-OE1 3.09Å; H152-E156 IonicContact CE1-OE2 2.76Å; H152-E156 IonicContact ND1-OE1 3.22Å; H152-E156 IonicContact ND1-OE2 2.81Å; H152-E156 PolarHBondContact O-N 2.88Å; E156-G159 PolarHBondContact O-N 2.85Å; E156-R160 WeakPolarHBondContact O-CB 3.45Å; E156-R160 VanDerWaalsContact O-CG 3.31Å; E156-R160 WeakPolarHBondContact O-CG 3.24Å; E156-R160 PolarHBondContact O-N 3.23Å; E156-S190 WeakPolarHBondContact CG-OG 3.4Å
157	T	90.7	Very high	90.7	Very high	62 Å²	62	49.4 Å²	49.4	38%	0.38	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-43.6	-178.5	-56	0	0	0	0	111.7	M136 K153 C154 R155	M136-T157 HydrophobicContact CE-CG2 3.85Å; K153-T157 PolarHBondContact O-N 3.35Å; K153-T157 PolarHBondContact O-OG1 3.38Å; C154-T157 PolarHBondContact O-N 2.97Å; R155-T157 VanDerWaalsContact C-N 3.33Å; R155-T157 PolarHBondContact O-N 2.83Å
158	V	91.8	Very high	91.1	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-69.7	-44.2	176.6	173.2	0	0	0	0	111	M112 V130 M136 M137 C154 R155 R160 K161 F162 F195	M112-V158 HydrophobicContact CB-CG1 4.31Å; V130-V158 HydrophobicContact CG1-CG1 3.8Å; M136-V158 HydrophobicContact CB-CG2 4.46Å; M136-V158 HydrophobicContact CE-CG2 3.9Å; M136-V158 HydrophobicContact CG-CG2 3.84Å; M136-V158 HydrophobicContact SD-CG2 3.88Å; M137-V158 HydrophobicContact CG-CG2 4.1Å; M137-V158 HydrophobicContact SD-CB 4.43Å; M137-V158 HydrophobicContact SD-CG2 3.72Å; C154-V158 WeakPolarHBondContact O-CG2 3.47Å; C154-V158 PolarHBondContact O-N 2.78Å; R155-V158 PolarHBondContact O-N 2.95Å; V158-R160 VanDerWaalsContact C-N 3.3Å; V158-R160 PolarHBondContact O-N 3.45Å; V158-K161 PolarHBondContact O-N 3.09Å; V158-F162 PolarHBondContact O-N 3.36Å; V158-F162 VanDerWaalsContact O-N 3.14Å; V158-F195 HydrophobicContact CB-CE2 3.88Å; V158-F195 HydrophobicContact CB-CZ 4.05Å; V158-F195 HydrophobicContact CG1-CE2 3.89Å; V158-F195 HydrophobicContact CG1-CZ 3.91Å
159	G	91.6	Very high	91.8	Very high	8 Å²	8	37.7 Å²	37.7	8%	0.082	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-40.5	178	0	0	0	0	0	112.4	R155 E156 K161 F162 V163	R155-G159 PolarHBondContact O-N 3.06Å; E156-G159 PolarHBondContact O-N 2.85Å; G159-K161 PolarHBondContact O-N 2.91Å; G159-F162 WeakPolarHBondContact O-CB 3.36Å; G159-F162 PolarHBondContact O-N 3.36Å; G159-F162 VanDerWaalsContact O-N 3.14Å; G159-V163 WeakPolarHBondContact O-CG2 3.31Å; G159-V163 PolarHBondContact O-N 3.25Å
160	R	89.9	Confident	92	Very high	140 Å²	140	34.6 Å²	34.6	53%	0.528	16%	0.159	S	C	.	.	H	α-helix	trans	-58.4	-44.2	175.2	-79.3	175	64	170.7	3.1	113.2	E62 E156 V158 F162 V163 K164	E62-R160 IonicContact OE2-CZ 2.91Å; E62-R160 VanDerWaalsContact OE2-CZ 3.29Å; E62-R160 IonicContact OE2-NE 3.98Å; E62-R160 PolarHBondContact OE2-NE 3.04Å; E62-R160 VanDerWaalsContact OE2-NE 3.16Å; E62-R160 IonicContact OE2-NH2 2.72Å; E62-R160 PolarHBondContact OE2-NH2 2.86Å; E156-R160 WeakPolarHBondContact O-CB 3.45Å; E156-R160 VanDerWaalsContact O-CG 3.31Å; E156-R160 WeakPolarHBondContact O-CG 3.24Å; E156-R160 PolarHBondContact O-N 3.23Å; V158-R160 VanDerWaalsContact C-N 3.3Å; V158-R160 PolarHBondContact O-N 3.45Å; R160-F162 VanDerWaalsContact C-N 3.29Å; R160-F162 PolarHBondContact O-N 3.1Å; R160-V163 PolarHBondContact O-N 3.34Å; R160-K164 PolarHBondContact O-N 3.33Å
161	K	89.7	Confident	91.8	Very high	92 Å²	92	35 Å²	35	40%	0.4	16%	0.16	S	C	.	.	H	α-helix	trans	-64.4	-36.9	175.8	-69.7	-163.5	175.7	-169.2	0	112.2	M112 M136 V158 G159 K164 E165	M112-K161 HydrophobicContact CE-CB 3.48Å; M112-K161 VanDerWaalsContact CE-CB 3.48Å; M112-K161 HydrophobicContact SD-CB 3.75Å; M112-K161 HydrophobicContact SD-CD 3.88Å; M112-K161 HydrophobicContact SD-CG 4.46Å; M136-K161 HydrophobicContact CE-CD 3.73Å; M136-K161 HydrophobicContact CE-CG 4.34Å; M136-K161 HydrophobicContact SD-CD 3.95Å; V158-K161 PolarHBondContact O-N 3.09Å; G159-K161 PolarHBondContact O-N 2.91Å; K161-K164 WeakPolarHBondContact O-CB 3.41Å; K161-K164 PolarHBondContact O-N 3.3Å; K161-E165 PolarHBondContact O-N 2.98Å
162	F	90.6	Very high	91.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.1	-41.2	176.9	-148.6	-89.9	0	0	0	111.7	M112 K113 K128 V130 V158 G159 R160 E165 I166 L198 A199 V200	M112-F162 HydrophobicContact CE-CB 4.49Å; M112-F162 HydrophobicContact CE-CD2 4.24Å; K113-F162 HydrophobicContact CD-CE2 4.3Å; K113-F162 HydrophobicContact CG-CD2 4.28Å; K113-F162 HydrophobicContact CG-CE2 4Å; K128-F162 WeakPolarHBondContact O-CZ 3.29Å; V130-F162 HydrophobicContact CG2-CD2 3.56Å; V130-F162 HydrophobicContact CG2-CE2 3.63Å; V130-F162 HydrophobicContact CG2-CG 4.07Å; V130-F162 HydrophobicContact CG2-CZ 4.19Å; V158-F162 PolarHBondContact O-N 3.36Å; V158-F162 VanDerWaalsContact O-N 3.14Å; G159-F162 WeakPolarHBondContact O-CB 3.36Å; G159-F162 PolarHBondContact O-N 3.36Å; G159-F162 VanDerWaalsContact O-N 3.14Å; R160-F162 VanDerWaalsContact C-N 3.29Å; R160-F162 PolarHBondContact O-N 3.1Å; F162-E165 WeakPolarHBondContact O-CB 3.48Å; F162-E165 PolarHBondContact O-N 3.02Å; F162-I166 HydrophobicContact CD1-CD1 4.04Å; F162-I166 HydrophobicContact CE1-CD1 4.4Å; F162-I166 WeakPolarHBondContact O-CG1 3.41Å; F162-I166 PolarHBondContact O-N 3.06Å; F162-L198 HydrophobicContact CD1-CB 4.09Å; F162-L198 HydrophobicContact CE1-CB 4.04Å; F162-A199 VanDerWaalsContact CE1-C 3.47Å; F162-V200 HydrophobicContact CD1-CG2 4Å; F162-V200 HydrophobicContact CE1-CB 4.43Å; F162-V200 HydrophobicContact CE1-CG2 3.4Å; F162-V200 HydrophobicContact CZ-CB 4.49Å; F162-V200 HydrophobicContact CZ-CG2 3.75Å
163	V	90.2	Very high	91.8	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.048	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-43.7	172.3	172.7	0	0	0	0	111.1	T64 F68 G159 R160 E165 I166 V167 I185	T64-V163 HydrophobicContact CG2-CG1 4.11Å; F68-V163 HydrophobicContact CD2-CG1 4.43Å; F68-V163 HydrophobicContact CE2-CG1 3.58Å; F68-V163 HydrophobicContact CZ-CG1 4.11Å; G159-V163 WeakPolarHBondContact O-CG2 3.31Å; G159-V163 PolarHBondContact O-N 3.25Å; R160-V163 PolarHBondContact O-N 3.34Å; V163-E165 VanDerWaalsContact C-N 3.29Å; V163-E165 PolarHBondContact O-N 2.9Å; V163-I166 PolarHBondContact O-N 3.3Å; V163-I166 VanDerWaalsContact O-N 3.1Å; V163-V167 HydrophobicContact CG1-CG2 4.16Å; V163-V167 WeakPolarHBondContact O-CG2 3.4Å; V163-V167 PolarHBondContact O-N 3.46Å; V163-I185 HydrophobicContact CG2-CD1 4.03Å
164	K	91.2	Very high	91.9	Very high	15 Å²	15	28.9 Å²	28.9	7%	0.065	13%	0.129	C	C	.	.	H	α-helix	trans	-55.8	-44.2	176.9	-169.2	176.9	174.7	-168.6	0	111.5	L61 E62 R160 K161 V167 A168 D266 I268	L61-K164 HydrophobicContact CB-CG 4.01Å; E62-K164 HydrophobicContact CG-CB 4.14Å; E62-K164 HydrophobicContact CG-CD 3.79Å; E62-K164 HydrophobicContact CG-CG 4.12Å; R160-K164 PolarHBondContact O-N 3.33Å; K161-K164 WeakPolarHBondContact O-CB 3.41Å; K161-K164 PolarHBondContact O-N 3.3Å; K164-V167 PolarHBondContact O-N 2.98Å; K164-A168 WeakPolarHBondContact O-CB 3.5Å; K164-A168 PolarHBondContact O-N 3.33Å; K164-D266 WeakPolarHBondContact CD-O 3.41Å; K164-D266 WeakPolarHBondContact CE-O 3.4Å; K164-D266 PolarHBondContact NZ-O 3.13Å; K164-I268 PolarHBondContact NZ-O 3.2Å
165	E	92.9	Very high	92	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58	-49	174.3	-171.5	178.9	174.8	0	0	112.1	K113 K128 K161 F162 V163 V167 A168 L169 D266	K113-E165 WeakPolarHBondContact CD-OE2 3.42Å; K113-E165 WeakPolarHBondContact CE-OE2 3.48Å; K113-E165 IonicContact NZ-OE1 3.29Å; K113-E165 IonicContact NZ-OE2 2.89Å; K113-E165 PolarHBondContact NZ-OE2 3.19Å; K128-E165 WeakPolarHBondContact CD-OE1 3.33Å; K128-E165 IonicContact NZ-OE1 2.67Å; K128-E165 PolarHBondContact NZ-OE1 3.27Å; K161-E165 PolarHBondContact O-N 2.98Å; F162-E165 WeakPolarHBondContact O-CB 3.48Å; F162-E165 PolarHBondContact O-N 3.02Å; V163-E165 VanDerWaalsContact C-N 3.29Å; V163-E165 PolarHBondContact O-N 2.9Å; E165-V167 PolarHBondContact O-N 3.45Å; E165-A168 PolarHBondContact O-N 2.85Å; E165-L169 HydrophobicContact CG-CD1 3.96Å; E165-L169 HydrophobicContact CG-CG 4.33Å; E165-L169 WeakPolarHBondContact O-CB 3.49Å; E165-L169 WeakPolarHBondContact O-CG 3.26Å; E165-L169 PolarHBondContact O-N 3.34Å; E165-D266 HydrophobicContact CB-CB 4.09Å
166	I	93.5	Very high	92.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-47.6	-179.2	-67.9	163.4	0	0	0	110.8	F68 F78 F162 V163 A168 N170 L180 Y183 I185 V200	F68-I166 HydrophobicContact CE1-CG2 4.34Å; F68-I166 HydrophobicContact CZ-CG2 4.12Å; F78-I166 HydrophobicContact CE2-CG2 3.88Å; F78-I166 HydrophobicContact CZ-CG2 3.71Å; F162-I166 HydrophobicContact CD1-CD1 4.04Å; F162-I166 HydrophobicContact CE1-CD1 4.4Å; F162-I166 WeakPolarHBondContact O-CG1 3.41Å; F162-I166 PolarHBondContact O-N 3.06Å; V163-I166 PolarHBondContact O-N 3.3Å; V163-I166 VanDerWaalsContact O-N 3.1Å; I166-A168 VanDerWaalsContact C-N 3.34Å; I166-A168 PolarHBondContact O-N 3.34Å; I166-N170 WeakPolarHBondContact O-CB 3.28Å; I166-N170 PolarHBondContact O-N 2.95Å; I166-N170 VanDerWaalsContact O-N 3.15Å; I166-L180 HydrophobicContact CG2-CD2 4.47Å; I166-Y183 HydrophobicContact CD1-CD2 4.12Å; I166-Y183 HydrophobicContact CD1-CG 4.22Å; I166-Y183 HydrophobicContact CG1-CG 4.44Å; I166-Y183 HydrophobicContact CG2-CD1 3.87Å; I166-Y183 HydrophobicContact CG2-CD2 3.95Å; I166-Y183 HydrophobicContact CG2-CE1 4.25Å; I166-Y183 HydrophobicContact CG2-CE2 4.3Å; I166-Y183 HydrophobicContact CG2-CG 3.71Å; I166-I185 HydrophobicContact CD1-CD1 3.78Å; I166-I185 HydrophobicContact CD1-CG1 3.8Å; I166-V200 HydrophobicContact CD1-CG2 4.08Å; I166-V200 HydrophobicContact CG1-CG2 3.61Å
167	V	92.4	Very high	92.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-49.8	177	172.4	0	0	0	0	109.9	L61 F67 F68 F78 V163 K164 E165 N170 Q171	L61-V167 HydrophobicContact CD2-CG1 3.86Å; F67-V167 HydrophobicContact CB-CG2 4.08Å; F67-V167 HydrophobicContact CD1-CG1 3.97Å; F67-V167 HydrophobicContact CD2-CB 4.39Å; F67-V167 HydrophobicContact CD2-CG1 3.63Å; F67-V167 HydrophobicContact CD2-CG2 3.77Å; F67-V167 HydrophobicContact CE1-CG1 3.87Å; F67-V167 HydrophobicContact CE2-CG1 3.53Å; F67-V167 HydrophobicContact CE2-CG2 4.44Å; F67-V167 HydrophobicContact CG-CG1 3.86Å; F67-V167 HydrophobicContact CG-CG2 3.94Å; F67-V167 HydrophobicContact CZ-CG1 3.66Å; F68-V167 HydrophobicContact CE2-CG2 3.44Å; F68-V167 VanDerWaalsContact CE2-CG2 3.44Å; F68-V167 HydrophobicContact CZ-CG2 3.68Å; F78-V167 HydrophobicContact CE1-CG2 4.23Å; V163-V167 HydrophobicContact CG1-CG2 4.16Å; V163-V167 WeakPolarHBondContact O-CG2 3.4Å; V163-V167 PolarHBondContact O-N 3.46Å; K164-V167 PolarHBondContact O-N 2.98Å; E165-V167 PolarHBondContact O-N 3.45Å; V167-N170 PolarHBondContact O-N 3.01Å; V167-N170 VanDerWaalsContact O-N 3.15Å; V167-Q171 HydrophobicContact CG1-CG 4.02Å; V167-Q171 WeakPolarHBondContact O-CG 3.31Å; V167-Q171 PolarHBondContact O-N 3.13Å
168	A	92.2	Very high	92.6	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.9	-43	-172.1	0	0	0	0	0	111.9	K164 E165 I166 N170 Q171 F172 F265 I268	K164-A168 WeakPolarHBondContact O-CB 3.5Å; K164-A168 PolarHBondContact O-N 3.33Å; E165-A168 PolarHBondContact O-N 2.85Å; I166-A168 VanDerWaalsContact C-N 3.34Å; I166-A168 PolarHBondContact O-N 3.34Å; A168-N170 PolarHBondContact O-N 3.06Å; A168-Q171 PolarHBondContact O-N 3.11Å; A168-F172 HydrophobicContact CB-CD2 3.83Å; A168-F172 HydrophobicContact CB-CE2 3.93Å; A168-F172 WeakPolarHBondContact O-CB 3.12Å; A168-F172 WeakPolarHBondContact O-CD2 3.48Å; A168-F172 PolarHBondContact O-N 3.05Å; A168-F265 HydrophobicContact CB-CD1 3.55Å; A168-F265 HydrophobicContact CB-CE1 4.24Å; A168-F265 WeakPolarHBondContact CB-O 3.45Å; A168-I268 HydrophobicContact CB-CD1 3.97Å
169	L	93.8	Very high	92.8	Very high	4 Å²	4	27 Å²	27	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-60	-30.2	171.9	-69.2	177.2	0	0	0	112.9	E165 I177 I178 L180 V200 F265	E165-L169 HydrophobicContact CG-CD1 3.96Å; E165-L169 HydrophobicContact CG-CG 4.33Å; E165-L169 WeakPolarHBondContact O-CB 3.49Å; E165-L169 WeakPolarHBondContact O-CG 3.26Å; E165-L169 PolarHBondContact O-N 3.34Å; L169-I177 HydrophobicContact CD2-CG2 3.78Å; L169-I178 HydrophobicContact CD1-CG2 4.22Å; L169-I178 HydrophobicContact CD2-CG2 3.68Å; L169-L180 HydrophobicContact CB-CB 4.1Å; L169-L180 HydrophobicContact CB-CD2 4.37Å; L169-L180 HydrophobicContact CD1-CD1 4.39Å; L169-V200 HydrophobicContact CD1-CG1 4.22Å; L169-F265 HydrophobicContact CD2-CB 3.96Å; L169-F265 HydrophobicContact CG-CB 4.43Å
170	N	91.6	Very high	93	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-78.2	-40.6	174.9	-175	59.8	0	0	0	113.2	F78 I166 V167 A168 R173 L180	F78-N170 HydrophobicContact CE1-CB 4.25Å; F78-N170 HydrophobicContact CE2-CB 3.66Å; F78-N170 HydrophobicContact CZ-CB 3.46Å; F78-N170 VanDerWaalsContact CZ-CB 3.46Å; I166-N170 WeakPolarHBondContact O-CB 3.28Å; I166-N170 PolarHBondContact O-N 2.95Å; I166-N170 VanDerWaalsContact O-N 3.15Å; V167-N170 PolarHBondContact O-N 3.01Å; V167-N170 VanDerWaalsContact O-N 3.15Å; A168-N170 PolarHBondContact O-N 3.06Å; N170-R173 WeakPolarHBondContact O-CG 3.46Å; N170-R173 PolarHBondContact O-NE 3.23Å; N170-R173 PolarHBondContact OD1-NH2 2.62Å; N170-L180 HydrophobicContact CB-CD2 4.16Å
171	Q	88.2	Confident	93.3	Very high	24 Å²	24	21.4 Å²	21.4	11%	0.112	10%	0.102	C	C	.	.	H	α-helix	trans	-73	-40	-178.6	-70.1	-42.4	-76.5	0	0	112.4	F67 R83 V167 A168 R173	F67-Q171 HydrophobicContact CE1-CG 4.14Å; R83-Q171 PolarHBondContact O-NE2 2.99Å; R83-Q171 PolarHBondContact O-OE1 3.35Å; V167-Q171 HydrophobicContact CG1-CG 4.02Å; V167-Q171 WeakPolarHBondContact O-CG 3.31Å; V167-Q171 PolarHBondContact O-N 3.13Å; A168-Q171 PolarHBondContact O-N 3.11Å; Q171-R173 PolarHBondContact O-N 3.09Å
172	F	91.8	Very high	93.6	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	-108.2	56.1	-167.3	-52	-68.4	0	0	0	111.3	M56 L61 A168 H174 I177 F234 H238 A240 I243 F265 I268 L270	M56-F172 HydrophobicContact CE-CE1 3.99Å; M56-F172 HydrophobicContact CE-CE2 4.45Å; M56-F172 HydrophobicContact CE-CZ 3.5Å; M56-F172 VanDerWaalsContact CE-CZ 3.5Å; L61-F172 HydrophobicContact CD1-CE2 4.26Å; L61-F172 HydrophobicContact CD2-CE2 3.95Å; L61-F172 HydrophobicContact CD2-CZ 4.14Å; A168-F172 HydrophobicContact CB-CD2 3.83Å; A168-F172 HydrophobicContact CB-CE2 3.93Å; A168-F172 WeakPolarHBondContact O-CB 3.12Å; A168-F172 WeakPolarHBondContact O-CD2 3.48Å; A168-F172 PolarHBondContact O-N 3.05Å; F172-H174 PolarHBondContact O-N 2.98Å; F172-I177 HydrophobicContact CB-CD1 4.39Å; F172-I177 WeakPolarHBondContact O-CD1 3.43Å; F172-F234 HydrophobicContact CB-CE1 4.25Å; F172-F234 HydrophobicContact CB-CZ 4.24Å; F172-H238 AromaticContact CD1-CD2 3.99Å; F172-H238 AromaticContact CD1-CE1 3.43Å; F172-H238 VanDerWaalsContact CD1-CE1 3.43Å; F172-H238 WeakPolarHBondContact CD1-CE1 3.08Å; F172-H238 AromaticContact CD1-ND1 3.83Å; F172-H238 AromaticContact CD1-NE2 3.54Å; F172-H238 AromaticContact CE1-CE1 3.39Å; F172-H238 WeakPolarHBondContact CE1-CE1 3.49Å; F172-H238 AromaticContact CE1-ND1 3.62Å; F172-A240 HydrophobicContact CE1-CB 4.44Å; F172-I243 HydrophobicContact CD1-CD1 3.37Å; F172-I243 HydrophobicContact CE1-CD1 3.47Å; F172-I243 VanDerWaalsContact CE1-CD1 3.47Å; F172-I243 HydrophobicContact CE1-CG1 4.44Å; F172-I243 HydrophobicContact CG-CD1 4.04Å; F172-I243 HydrophobicContact CZ-CD1 4.21Å; F172-F265 HydrophobicContact CB-CE1 3.75Å; F172-F265 HydrophobicContact CB-CZ 4.01Å; F172-F265 AromaticContact CD2-CD1 3.99Å; F172-F265 HydrophobicContact CD2-CD1 3.99Å; F172-F265 AromaticContact CD2-CE1 3.33Å; F172-F265 HydrophobicContact CD2-CE1 3.33Å; F172-F265 HydrophobicContact CD2-CZ 4.29Å; F172-F265 HydrophobicContact CE2-CE1 4.12Å; F172-F265 AromaticContact CG-CE1 3.73Å; F172-F265 HydrophobicContact CG-CE1 3.73Å; F172-F265 HydrophobicContact CG-CZ 4.29Å; F172-I268 HydrophobicContact CD2-CD1 3.94Å; F172-I268 HydrophobicContact CE2-CD1 3.5Å; F172-I268 VanDerWaalsContact CE2-CD1 3.5Å; F172-I268 HydrophobicContact CZ-CD1 4.2Å; F172-L270 HydrophobicContact CE1-CD2 4.18Å; F172-L270 HydrophobicContact CE2-CD2 4.46Å; F172-L270 HydrophobicContact CZ-CD1 4.28Å; F172-L270 HydrophobicContact CZ-CD2 3.67Å
173	R	92.3	Very high	93.9	Very high	96 Å²	96	17.1 Å²	17.1	36%	0.362	8%	0.083	S	C	.	.			trans	-72.3	125.8	-179.7	-65.1	179.2	-177.8	-161.9	-4.3	111	G84 N170 Q171	G84-R173 PolarHBondContact O-NE 2.94Å; G84-R173 PolarHBondContact O-NH1 3.18Å; G84-R173 PolarHBondContact O-NH2 2.82Å; N170-R173 WeakPolarHBondContact O-CG 3.46Å; N170-R173 PolarHBondContact O-NE 3.23Å; N170-R173 PolarHBondContact OD1-NH2 2.62Å; Q171-R173 PolarHBondContact O-N 3.09Å
174	H	95.2	Very high	94.2	Very high	47 Å²	47	17 Å²	17	22%	0.218	8%	0.083	C	C	.	.			trans	-152.3	156.5	178.1	-177.2	-104.7	0	0	0	110.1	F172 S176 I177 F234	F172-H174 PolarHBondContact O-N 2.98Å; H174-S176 WeakPolarHBondContact ND1-CB 3.5Å; H174-S176 PolarHBondContact ND1-N 2.9Å; H174-S176 VanDerWaalsContact ND1-N 3.11Å; H174-S176 PolarHBondContact O-N 3.37Å; H174-S176 VanDerWaalsContact O-N 3.13Å; H174-I177 HydrophobicContact CB-CB 4.38Å; H174-I177 HydrophobicContact CB-CD1 3.95Å; H174-I177 HydrophobicContact CB-CG1 4.14Å; H174-I177 PolarHBondContact O-N 3.28Å; H174-I177 VanDerWaalsContact O-N 3.09Å; H174-F234 HydrophobicContact CB-CD1 3.98Å; H174-F234 HydrophobicContact CB-CD2 4.26Å; H174-F234 HydrophobicContact CB-CE1 3.97Å; H174-F234 HydrophobicContact CB-CE2 4.24Å; H174-F234 HydrophobicContact CB-CG 4.12Å; H174-F234 HydrophobicContact CB-CZ 4.1Å; H174-F234 AromaticContact CD2-CD2 3.74Å; H174-F234 AromaticContact CD2-CG 3.65Å; H174-F234 AromaticContact CG-CG 3.85Å
175	S	95.7	Very high	94.4	Very high	58 Å²	58	16.5 Å²	16.5	41%	0.406	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.4	-179.5	57.5	0	0	0	0	113.6	K261	S175-K261 VanDerWaalsContact O-CE 3.31Å; S175-K261 WeakPolarHBondContact O-CE 3.34Å
176	S	97.1	Very high	94.4	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.007	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	19.5	179.4	-53.6	0	0	0	0	113.4	H174 S227 F260 K261 L262	H174-S176 WeakPolarHBondContact ND1-CB 3.5Å; H174-S176 PolarHBondContact ND1-N 2.9Å; H174-S176 VanDerWaalsContact ND1-N 3.11Å; H174-S176 PolarHBondContact O-N 3.37Å; H174-S176 VanDerWaalsContact O-N 3.13Å; S176-S227 PolarHBondContact OG-O 2.68Å; S176-S227 VanDerWaalsContact OG-O 3.05Å; S176-F260 VanDerWaalsContact CA-O 3.31Å; S176-F260 WeakPolarHBondContact CA-O 3.49Å; S176-F260 WeakPolarHBondContact CB-O 3.5Å; S176-K261 WeakPolarHBondContact O-CA 3.35Å; S176-L262 PolarHBondContact O-N 3.07Å
177	I	96.9	Very high	94.4	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	-120.6	141.4	169.6	-66.7	172.9	0	0	0	107.1	L169 F172 H174 E179 L231 F234 L262 F265	L169-I177 HydrophobicContact CD2-CG2 3.78Å; F172-I177 HydrophobicContact CB-CD1 4.39Å; F172-I177 WeakPolarHBondContact O-CD1 3.43Å; H174-I177 HydrophobicContact CB-CB 4.38Å; H174-I177 HydrophobicContact CB-CD1 3.95Å; H174-I177 HydrophobicContact CB-CG1 4.14Å; H174-I177 PolarHBondContact O-N 3.28Å; H174-I177 VanDerWaalsContact O-N 3.09Å; I177-E179 PolarHBondContact O-N 2.8Å; I177-L231 HydrophobicContact CD1-CD1 3.89Å; I177-L231 HydrophobicContact CG1-CD1 3.74Å; I177-F234 HydrophobicContact CD1-CD1 4.34Å; I177-F234 HydrophobicContact CD1-CE1 3.83Å; I177-L262 HydrophobicContact CG1-CB 4.45Å; I177-F265 HydrophobicContact CD1-CD2 4.36Å; I177-F265 HydrophobicContact CD1-CE2 3.68Å; I177-F265 HydrophobicContact CD1-CZ 3.98Å; I177-F265 HydrophobicContact CG1-CE2 4.29Å
178	I	96.7	Very high	94.4	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-60.6	134.2	-176.4	-157.1	69.8	0	0	0	111.2	L169 L180 E203 V254 V256 K261 L262 V263	L169-I178 HydrophobicContact CD1-CG2 4.22Å; L169-I178 HydrophobicContact CD2-CG2 3.68Å; I178-L180 PolarHBondContact O-N 2.82Å; I178-E203 HydrophobicContact CD1-CG 3.23Å; I178-E203 HydrophobicContact CG1-CG 3.69Å; I178-V254 HydrophobicContact CD1-CG2 3.85Å; I178-V256 HydrophobicContact CD1-CG2 4.48Å; I178-K261 HydrophobicContact CD1-CB 4.14Å; I178-K261 HydrophobicContact CD1-CD 4.3Å; I178-L262 WeakPolarHBondContact CB-O 3.4Å; I178-L262 PolarHBondContact N-O 3.33Å; I178-V263 HydrophobicContact CB-CG1 4.22Å; I178-V263 HydrophobicContact CD1-CG1 4.01Å; I178-V263 HydrophobicContact CG1-CG1 4.12Å
179	E	95.4	Very high	94.4	Very high	65 Å²	65	28.4 Å²	28.4	30%	0.304	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-69	120.3	178.5	-175.6	-176.2	-158.4	0	0	110.4	K89 R123 I177 I181 S202 E203	K89-E179 IonicContact NZ-OE1 3.87Å; R123-E179 IonicContact CZ-OE2 3.22Å; R123-E179 IonicContact NH1-OE2 3.16Å; R123-E179 PolarHBondContact NH1-OE2 2.65Å; R123-E179 VanDerWaalsContact NH1-OE2 3.08Å; R123-E179 IonicContact NH2-OE2 2.65Å; R123-E179 PolarHBondContact NH2-OE2 2.76Å; I177-E179 PolarHBondContact O-N 2.8Å; E179-I181 HydrophobicContact CG-CG1 4.49Å; E179-I181 PolarHBondContact O-N 2.94Å; E179-S202 CarbonylContact O-C 3.6Å; E179-S202 WeakPolarHBondContact O-CA 3.42Å; E179-S202 WeakPolarHBondContact O-CB 3.36Å; E179-E203 HydrophobicContact CB-CB 4.29Å; E179-E203 HydrophobicContact CB-CG 4.16Å; E179-E203 PolarHBondContact N-OE1 3.46Å; E179-E203 PolarHBondContact O-N 2.97Å
180	L	95.9	Very high	94.3	Very high	13 Å²	13	29.1 Å²	29.1	7%	0.068	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	117.7	165.4	-177.5	66.3	0	0	0	109.7	L91 I166 L169 N170 I178 G182 Y183 V200	L91-L180 HydrophobicContact CD1-CD2 3.84Å; L91-L180 HydrophobicContact CD1-CG 4.4Å; L91-L180 HydrophobicContact CD2-CB 4.44Å; L91-L180 HydrophobicContact CD2-CD2 4.26Å; L91-L180 HydrophobicContact CD2-CG 3.95Å; L91-L180 WeakPolarHBondContact CD2-O 3.5Å; I166-L180 HydrophobicContact CG2-CD2 4.47Å; L169-L180 HydrophobicContact CB-CB 4.1Å; L169-L180 HydrophobicContact CB-CD2 4.37Å; L169-L180 HydrophobicContact CD1-CD1 4.39Å; N170-L180 HydrophobicContact CB-CD2 4.16Å; I178-L180 PolarHBondContact O-N 2.82Å; L180-G182 WeakPolarHBondContact CD1-O 3.5Å; L180-Y183 HydrophobicContact CD2-CD1 4.46Å; L180-V200 HydrophobicContact CD1-CG1 3.56Å
181	I	96	Very high	94.4	Very high	17 Å²	17	33 Å²	33	9%	0.087	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-33.4	179.6	-62.2	174.5	0	0	0	110.8	L91 L92 L120 V125 E179 V201 S202 E203	L91-I181 WeakPolarHBondContact CA-O 3.39Å; L92-I181 HydrophobicContact CD1-CG2 4.07Å; L92-I181 HydrophobicContact CG-CG2 4.31Å; L92-I181 PolarHBondContact N-O 3.34Å; L120-I181 HydrophobicContact CD2-CG2 3.88Å; V125-I181 HydrophobicContact CB-CD1 4.39Å; V125-I181 HydrophobicContact CG1-CD1 3.55Å; E179-I181 HydrophobicContact CG-CG1 4.49Å; E179-I181 PolarHBondContact O-N 2.94Å; I181-V201 WeakPolarHBondContact CA-O 3.25Å; I181-V201 HydrophobicContact CB-CG1 4.19Å; I181-V201 WeakPolarHBondContact CB-O 3.34Å; I181-V201 HydrophobicContact CG2-CG1 4.33Å; I181-V201 PolarHBondContact N-O 2.87Å; I181-S202 VanDerWaalsContact CD1-C 3.46Å; I181-E203 HydrophobicContact CD1-CB 4.33Å
182	G	96.3	Very high	94.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	166.2	-175.7	0	0	0	0	0	112.3	L180 V201	L180-G182 WeakPolarHBondContact CD1-O 3.5Å; G182-V201 PolarHBondContact N-O 3.28Å; G182-V201 PolarHBondContact O-N 3.49Å
183	Y	96.7	Very high	94.5	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.4	172.9	66.3	-86.6	0	0	0	110.7	F68 W76 R77 F78 L91 L92 I166 L180 I185 A199	F68-Y183 HydrophobicContact CD1-CE2 4.48Å; F68-Y183 AromaticContact CE1-CE2 3.91Å; F68-Y183 HydrophobicContact CE1-CE2 3.91Å; W76-Y183 WeakPolarHBondContact O-CE2 3.5Å; R77-Y183 VanDerWaalsContact CA-OH 3.29Å; R77-Y183 WeakPolarHBondContact CA-OH 3.38Å; R77-Y183 VanDerWaalsContact NH1-CZ 3.32Å; R77-Y183 PolarHBondContact NH1-O 3.2Å; R77-Y183 VanDerWaalsContact NH1-O 3.07Å; F78-Y183 AromaticContact CD2-CE1 3.58Å; F78-Y183 HydrophobicContact CD2-CE1 3.58Å; F78-Y183 AromaticContact CD2-CZ 3.72Å; F78-Y183 VanDerWaalsContact CD2-OH 3.25Å; F78-Y183 WeakPolarHBondContact CD2-OH 3.48Å; F78-Y183 HydrophobicContact CE2-CD1 4.29Å; F78-Y183 AromaticContact CE2-CE1 3.55Å; F78-Y183 HydrophobicContact CE2-CE1 3.55Å; F78-Y183 AromaticContact CE2-CZ 3.89Å; F78-Y183 PolarHBondContact N-OH 2.71Å; L91-Y183 HydrophobicContact CB-CD1 4.34Å; L91-Y183 HydrophobicContact CB-CE1 4.19Å; L91-Y183 HydrophobicContact CD1-CD1 3.97Å; L91-Y183 HydrophobicContact CD1-CE1 3.65Å; L92-Y183 PolarHBondContact O-N 2.01Å; L92-Y183 VanDerWaalsContact O-N 3.13Å; L92-Y183 VanDerWaalsContact O-O 3.09Å; I166-Y183 HydrophobicContact CD1-CD2 4.12Å; I166-Y183 HydrophobicContact CD1-CG 4.22Å; I166-Y183 HydrophobicContact CG1-CG 4.44Å; I166-Y183 HydrophobicContact CG2-CD1 3.87Å; I166-Y183 HydrophobicContact CG2-CD2 3.95Å; I166-Y183 HydrophobicContact CG2-CE1 4.25Å; I166-Y183 HydrophobicContact CG2-CE2 4.3Å; I166-Y183 HydrophobicContact CG2-CG 3.71Å; L180-Y183 HydrophobicContact CD2-CD1 4.46Å; Y183-I185 HydrophobicContact CD2-CD1 3.93Å; Y183-I185 HydrophobicContact CD2-CG1 3.94Å; Y183-I185 HydrophobicContact CE2-CD1 3.92Å; Y183-I185 HydrophobicContact CE2-CG1 4.27Å; Y183-A199 CarbonylContact C-O 3.56Å; Y183-A199 WeakPolarHBondContact CA-O 3.33Å; Y183-A199 WeakPolarHBondContact CB-O 3.42Å
184	C	95.9	Very high	94.5	Very high	7 Å²	7	35.6 Å²	35.6	5%	0.047	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.3	170.8	-179.5	0	0	0	0	109.9	C94 I97 S197 L198 A199	C94-C184 HydrophobicContact CB-CB 3.91Å; C94-C184 WeakPolarHBondContact CB-SG 3.07Å; C94-C184 WeakPolarHBondContact SG-CA 3.34Å; C94-C184 WeakPolarHBondContact SG-CB 3.49Å; C94-C184 CovalentContact SG-SG 2.04Å; C94-C184 PolarHBondContact SG-SG 3.44Å; I97-C184 HydrophobicContact CD1-CB 4.08Å; C184-S197 PolarHBondContact SG-O 3.29Å; C184-L198 WeakPolarHBondContact O-CA 3.48Å; C184-A199 HydrophobicContact CB-CB 4.06Å; C184-A199 PolarHBondContact N-O 3.14Å; C184-A199 PolarHBondContact O-N 2.99Å
185	I	95.5	Very high	94.5	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	19%	0.187	C	C	.	.			trans	-126.5	102.7	166	-57.5	163.4	0	0	0	106	F68 Q75 W76 V163 I166 Y183 P189 L198	F68-I185 HydrophobicContact CD1-CD1 4.2Å; F68-I185 HydrophobicContact CE1-CD1 3.63Å; F68-I185 HydrophobicContact CE2-CD1 4.49Å; F68-I185 HydrophobicContact CZ-CD1 3.79Å; Q75-I185 CarbonylContact C-O 3.48Å; Q75-I185 VanDerWaalsContact CA-O 3.3Å; Q75-I185 WeakPolarHBondContact CA-O 3.31Å; Q75-I185 WeakPolarHBondContact CB-O 3.35Å; W76-I185 HydrophobicContact CB-CB 4.03Å; W76-I185 HydrophobicContact CB-CG2 3.87Å; W76-I185 HydrophobicContact CG-CG2 4.08Å; W76-I185 PolarHBondContact N-O 2.87Å; V163-I185 HydrophobicContact CG2-CD1 4.03Å; I166-I185 HydrophobicContact CD1-CD1 3.78Å; I166-I185 HydrophobicContact CD1-CG1 3.8Å; Y183-I185 HydrophobicContact CD2-CD1 3.93Å; Y183-I185 HydrophobicContact CD2-CG1 3.94Å; Y183-I185 HydrophobicContact CE2-CD1 3.92Å; Y183-I185 HydrophobicContact CE2-CG1 4.27Å; I185-P189 HydrophobicContact CG2-CB 4.32Å; I185-P189 HydrophobicContact CG2-CG 4.47Å; I185-L198 HydrophobicContact CB-CD2 4.37Å; I185-L198 HydrophobicContact CG1-CD2 4.24Å; I185-L198 HydrophobicContact CG2-CD2 4.19Å
186	P	94.4	Very high	94.4	Very high	18 Å²	18	35.7 Å²	35.7	12%	0.117	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-70	165.1	-179.1	33.9	-40	0	0	0	110.9	Y188 P189 G194 S197	P186-Y188 PolarHBondContact O-N 2.79Å; P186-P189 HydrophobicContact CG-CB 4.32Å; P186-P189 WeakPolarHBondContact O-CD 3.31Å; P186-G194 VanDerWaalsContact CG-CA 3.49Å; P186-G194 WeakPolarHBondContact CG-O 3.47Å; P186-S197 WeakPolarHBondContact CG-OG 3.5Å
187	M	93.2	Very high	94.2	Very high	63 Å²	63	37.8 Å²	37.8	31%	0.31	21%	0.206	S	C	.	.	S	Bend	trans	-49.5	-44.2	179.1	-177.1	178.7	-176.1	0	0	113.1	L70 M74 W76 P189	L70-M187 HydrophobicContact CD1-CB 4.06Å; L70-M187 HydrophobicContact CD1-CG 3.93Å; L70-M187 HydrophobicContact CD2-CE 3.98Å; L70-M187 HydrophobicContact CD2-CG 4.16Å; L70-M187 HydrophobicContact CD2-SD 4.33Å; M74-M187 PolarHBondContact O-N 3.38Å; W76-M187 PolarHBondContact NE1-O 3.01Å; M187-P189 VanDerWaalsContact O-CD 3.29Å; M187-P189 WeakPolarHBondContact O-CD 3.42Å
188	Y	92.3	Very high	94.2	Very high	136 Å²	136	37.5 Å²	37.5	53%	0.533	21%	0.205	S	C	.	.			trans	-116.4	78.3	-179.4	-54.7	-72.7	0	0	0	110.9	P186 S190 D191 G194	P186-Y188 PolarHBondContact O-N 2.79Å; Y188-S190 PolarHBondContact O-N 3.04Å; Y188-D191 VanDerWaalsContact CB-OD2 3.24Å; Y188-D191 WeakPolarHBondContact CB-OD2 3.49Å; Y188-D191 PolarHBondContact O-N 2.96Å; Y188-G194 WeakPolarHBondContact O-CA 3.27Å
189	P	92.3	Very high	94.1	Very high	33 Å²	33	37.4 Å²	37.4	21%	0.214	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.3	-174.7	30.8	-35.6	0	0	0	113.9	I185 P186 M187 F195 L198	I185-P189 HydrophobicContact CG2-CB 4.32Å; I185-P189 HydrophobicContact CG2-CG 4.47Å; P186-P189 HydrophobicContact CG-CB 4.32Å; P186-P189 WeakPolarHBondContact O-CD 3.31Å; M187-P189 VanDerWaalsContact O-CD 3.29Å; M187-P189 WeakPolarHBondContact O-CD 3.42Å; P189-F195 WeakPolarHBondContact O-CA 3.34Å; P189-F195 WeakPolarHBondContact O-CB 3.43Å; P189-F195 PolarHBondContact O-N 2.99Å; P189-L198 HydrophobicContact CB-CD1 4.38Å; P189-L198 HydrophobicContact CB-CD2 4.01Å; P189-L198 HydrophobicContact CB-CG 4.43Å
190	S	91.2	Very high	94.2	Very high	19 Å²	19	34.3 Å²	34.3	13%	0.133	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-18.2	178	-50.2	0	0	0	0	113.2	H152 R155 E156 Y188	H152-S190 WeakPolarHBondContact NE2-CB 2.97Å; R155-S190 WeakPolarHBondContact CD-O 3.03Å; E156-S190 WeakPolarHBondContact CG-OG 3.4Å; Y188-S190 PolarHBondContact O-N 3.04Å
191	D	92.8	Very high	94.3	Very high	80 Å²	80	33.7 Å²	33.7	43%	0.428	19%	0.187	S	C	.	.	S	Bend	trans	-71.8	159.7	173.8	-69.2	-5.6	0	0	0	110	Y188 G193 G194 F195	Y188-D191 VanDerWaalsContact CB-OD2 3.24Å; Y188-D191 WeakPolarHBondContact CB-OD2 3.49Å; Y188-D191 PolarHBondContact O-N 2.96Å; D191-G193 PolarHBondContact O-N 3.45Å; D191-G194 PolarHBondContact O-N 3.46Å; D191-F195 WeakPolarHBondContact O-CB 3.44Å; D191-F195 PolarHBondContact O-N 3.13Å
192	E	90.4	Very high	94.3	Very high	108 Å²	108	33 Å²	33	51%	0.505	18%	0.184	S	C	.	.	H	α-helix	trans	-60.9	-54.2	-172.1	-175.1	152.9	164.3	0	0	113.7	R155 G194 F195 Q196	R155-E192 VanDerWaalsContact CZ-CA 3.44Å; R155-E192 IonicContact CZ-OE2 2.65Å; R155-E192 VanDerWaalsContact NH1-CB 3.33Å; R155-E192 VanDerWaalsContact NH2-CD 3.26Å; R155-E192 IonicContact NH2-OE2 3.85Å; R155-E192 PolarHBondContact NH2-OE2 2.97Å; E192-G194 VanDerWaalsContact C-N 3.28Å; E192-G194 PolarHBondContact O-N 3.34Å; E192-F195 PolarHBondContact O-N 2.95Å; E192-Q196 WeakPolarHBondContact O-CG 3.38Å; E192-Q196 PolarHBondContact O-N 2.81Å; E192-Q196 VanDerWaalsContact O-N 3.1Å
193	G	91.3	Very high	94.3	Very high	55 Å²	55	33.8 Å²	33.8	57%	0.567	19%	0.187	S	C	*	.	H	α-helix	trans	-63.1	-38.4	178.3	0	0	0	0	0	111.7	D191 S197	D191-G193 PolarHBondContact O-N 3.45Å; G193-S197 PolarHBondContact O-N 2.83Å; G193-S197 PolarHBondContact O-OG 3.37Å
194	G	93.1	Very high	94.4	Very high	12 Å²	12	35.5 Å²	35.5	12%	0.124	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-48.2	177.9	0	0	0	0	0	112.4	P186 Y188 D191 E192 Q196 S197 L198	P186-G194 VanDerWaalsContact CG-CA 3.49Å; P186-G194 WeakPolarHBondContact CG-O 3.47Å; Y188-G194 WeakPolarHBondContact O-CA 3.27Å; D191-G194 PolarHBondContact O-N 3.46Å; E192-G194 VanDerWaalsContact C-N 3.28Å; E192-G194 PolarHBondContact O-N 3.34Å; G194-Q196 VanDerWaalsContact C-N 3.33Å; G194-Q196 PolarHBondContact O-N 2.94Å; G194-S197 PolarHBondContact O-N 3.49Å; G194-S197 PolarHBondContact O-OG 3.11Å; G194-L198 PolarHBondContact O-N 3.05Å
195	F	94.5	Very high	94.4	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-57.7	-43.5	178.3	-178.6	-109.3	0	0	0	112.6	V130 A132 M137 R155 V158 P189 D191 E192 S197 L198	V130-F195 HydrophobicContact CB-CZ 4.43Å; V130-F195 HydrophobicContact CG1-CD1 4.29Å; V130-F195 HydrophobicContact CG1-CD2 4.42Å; V130-F195 HydrophobicContact CG1-CE1 3.56Å; V130-F195 HydrophobicContact CG1-CE2 3.7Å; V130-F195 HydrophobicContact CG1-CZ 3.23Å; A132-F195 HydrophobicContact CB-CD1 4.5Å; A132-F195 HydrophobicContact CB-CE1 4.02Å; M137-F195 HydrophobicContact CE-CE1 4.22Å; M137-F195 HydrophobicContact CE-CZ 4.25Å; M137-F195 HydrophobicContact CG-CE1 4.47Å; M137-F195 HydrophobicContact CG-CZ 4.16Å; M137-F195 HydrophobicContact SD-CE1 4.23Å; M137-F195 HydrophobicContact SD-CZ 3.72Å; R155-F195 HydrophobicContact CB-CD2 3.62Å; R155-F195 HydrophobicContact CB-CE2 3.81Å; R155-F195 HydrophobicContact CB-CG 4.02Å; R155-F195 HydrophobicContact CB-CZ 4.34Å; R155-F195 HydrophobicContact CG-CB 4.26Å; R155-F195 HydrophobicContact CG-CD1 3.78Å; R155-F195 HydrophobicContact CG-CD2 3.73Å; R155-F195 HydrophobicContact CG-CE1 3.92Å; R155-F195 HydrophobicContact CG-CE2 3.88Å; R155-F195 HydrophobicContact CG-CG 3.66Å; R155-F195 HydrophobicContact CG-CZ 3.94Å; R155-F195 WeakPolarHBondContact O-CE2 3.16Å; V158-F195 HydrophobicContact CB-CE2 3.88Å; V158-F195 HydrophobicContact CB-CZ 4.05Å; V158-F195 HydrophobicContact CG1-CE2 3.89Å; V158-F195 HydrophobicContact CG1-CZ 3.91Å; P189-F195 WeakPolarHBondContact O-CA 3.34Å; P189-F195 WeakPolarHBondContact O-CB 3.43Å; P189-F195 PolarHBondContact O-N 2.99Å; D191-F195 WeakPolarHBondContact O-CB 3.44Å; D191-F195 PolarHBondContact O-N 3.13Å; E192-F195 PolarHBondContact O-N 2.95Å; F195-S197 PolarHBondContact O-N 2.92Å; F195-L198 HydrophobicContact CD2-CD1 4Å; F195-L198 WeakPolarHBondContact O-CB 3.15Å; F195-L198 PolarHBondContact O-N 3.07Å
196	Q	93.9	Very high	94.3	Very high	106 Å²	106	41.4 Å²	41.4	50%	0.495	23%	0.226	S	C	.	.	H	α-helix	trans	-68.1	-23.9	176.9	-69	179.4	14.7	0	0	113.1	E192 G194	E192-Q196 WeakPolarHBondContact O-CG 3.38Å; E192-Q196 PolarHBondContact O-N 2.81Å; E192-Q196 VanDerWaalsContact O-N 3.1Å; G194-Q196 VanDerWaalsContact C-N 3.33Å; G194-Q196 PolarHBondContact O-N 2.94Å
197	S	94	Very high	94.2	Very high	45 Å²	45	45 Å²	45	32%	0.315	25%	0.25	S	C	.	.	H	α-helix	trans	-86.1	-7.1	179	74.9	0	0	0	0	114.5	C184 P186 G193 G194 F195 A199	C184-S197 PolarHBondContact SG-O 3.29Å; P186-S197 WeakPolarHBondContact CG-OG 3.5Å; G193-S197 PolarHBondContact O-N 2.83Å; G193-S197 PolarHBondContact O-OG 3.37Å; G194-S197 PolarHBondContact O-N 3.49Å; G194-S197 PolarHBondContact O-OG 3.11Å; F195-S197 PolarHBondContact O-N 2.92Å; S197-A199 PolarHBondContact O-N 2.89Å
198	L	95.6	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.			trans	-58.9	120.1	175.6	-75.6	171.7	0	0	0	110.1	V130 F162 C184 I185 P189 G194 F195	V130-L198 HydrophobicContact CG2-CB 3.53Å; V130-L198 HydrophobicContact CG2-CD1 3.9Å; V130-L198 HydrophobicContact CG2-CG 4.36Å; V130-L198 PolarHBondContact N-O 3.47Å; F162-L198 HydrophobicContact CD1-CB 4.09Å; F162-L198 HydrophobicContact CE1-CB 4.04Å; C184-L198 WeakPolarHBondContact O-CA 3.48Å; I185-L198 HydrophobicContact CB-CD2 4.37Å; I185-L198 HydrophobicContact CG1-CD2 4.24Å; I185-L198 HydrophobicContact CG2-CD2 4.19Å; P189-L198 HydrophobicContact CB-CD1 4.38Å; P189-L198 HydrophobicContact CB-CD2 4.01Å; P189-L198 HydrophobicContact CB-CG 4.43Å; G194-L198 PolarHBondContact O-N 3.05Å; F195-L198 HydrophobicContact CD2-CD1 4Å; F195-L198 WeakPolarHBondContact O-CB 3.15Å; F195-L198 PolarHBondContact O-N 3.07Å
199	A	96.4	Very high	93.7	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.017	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.3	-173.4	0	0	0	0	0	112.8	K128 L129 F162 Y183 C184 S197	K128-A199 CarbonylContact O-C 3.53Å; K128-A199 VanDerWaalsContact O-CA 3.29Å; K128-A199 WeakPolarHBondContact O-CA 3.48Å; L129-A199 HydrophobicContact CD2-CB 3.52Å; F162-A199 VanDerWaalsContact CE1-C 3.47Å; Y183-A199 CarbonylContact C-O 3.56Å; Y183-A199 WeakPolarHBondContact CA-O 3.33Å; Y183-A199 WeakPolarHBondContact CB-O 3.42Å; C184-A199 HydrophobicContact CB-CB 4.06Å; C184-A199 PolarHBondContact N-O 3.14Å; C184-A199 PolarHBondContact O-N 2.99Å; S197-A199 PolarHBondContact O-N 2.89Å
200	V	96.8	Very high	93.5	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.2	164.2	-174.6	0	0	0	0	107.8	V127 K128 F162 I166 L169 L180	V127-V200 WeakPolarHBondContact CA-O 3.29Å; K128-V200 HydrophobicContact CB-CB 4.26Å; K128-V200 PolarHBondContact N-O 3.33Å; K128-V200 PolarHBondContact O-N 2.76Å; F162-V200 HydrophobicContact CD1-CG2 4Å; F162-V200 HydrophobicContact CE1-CB 4.43Å; F162-V200 HydrophobicContact CE1-CG2 3.4Å; F162-V200 HydrophobicContact CZ-CB 4.49Å; F162-V200 HydrophobicContact CZ-CG2 3.75Å; I166-V200 HydrophobicContact CD1-CG2 4.08Å; I166-V200 HydrophobicContact CG1-CG2 3.61Å; L169-V200 HydrophobicContact CD1-CG1 4.22Å; L180-V200 HydrophobicContact CD1-CG1 3.56Å
201	V	97.4	Very high	93.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.4	173.3	-173.8	0	0	0	0	108.1	I97 L101 V125 A126 V127 I181 G182	I97-V201 HydrophobicContact CD1-CG2 3.84Å; I97-V201 HydrophobicContact CG1-CG2 3.87Å; I97-V201 HydrophobicContact CG2-CG2 4.36Å; L101-V201 HydrophobicContact CD1-CG2 4.22Å; V125-V201 HydrophobicContact CB-CG1 3.99Å; V125-V201 HydrophobicContact CG1-CG1 4.41Å; V125-V201 HydrophobicContact CG2-CG1 3.99Å; A126-V201 WeakPolarHBondContact O-CA 3.33Å; V127-V201 HydrophobicContact CG1-CG2 4.48Å; V127-V201 HydrophobicContact CG2-CG2 4.48Å; I181-V201 WeakPolarHBondContact CA-O 3.25Å; I181-V201 HydrophobicContact CB-CG1 4.19Å; I181-V201 WeakPolarHBondContact CB-O 3.34Å; I181-V201 HydrophobicContact CG2-CG1 4.33Å; I181-V201 PolarHBondContact N-O 2.87Å; G182-V201 PolarHBondContact N-O 3.28Å; G182-V201 PolarHBondContact O-N 3.49Å
202	S	97	Very high	93	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	168.8	178.2	70.8	0	0	0	0	111.3	V125 A126 E179 I181	V125-S202 WeakPolarHBondContact CA-O 3.5Å; V125-S202 WeakPolarHBondContact CB-O 3.36Å; A126-S202 PolarHBondContact N-O 2.86Å; A126-S202 PolarHBondContact O-N 2.9Å; E179-S202 CarbonylContact O-C 3.6Å; E179-S202 WeakPolarHBondContact O-CA 3.42Å; E179-S202 WeakPolarHBondContact O-CB 3.36Å; I181-S202 VanDerWaalsContact CD1-C 3.46Å
203	E	96.4	Very high	93	Very high	16 Å²	16	44.1 Å²	44.1	8%	0.075	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	149.3	164.5	75.9	-172.3	139.6	0	0	110.3	R123 I178 E179 I181 K261	R123-E203 VanDerWaalsContact NH2-CB 3.29Å; I178-E203 HydrophobicContact CD1-CG 3.23Å; I178-E203 HydrophobicContact CG1-CG 3.69Å; E179-E203 HydrophobicContact CB-CB 4.29Å; E179-E203 HydrophobicContact CB-CG 4.16Å; E179-E203 PolarHBondContact N-OE1 3.46Å; E179-E203 PolarHBondContact O-N 2.97Å; I181-E203 HydrophobicContact CD1-CB 4.33Å; E203-K261 WeakPolarHBondContact OE1-CD 3.47Å; E203-K261 WeakPolarHBondContact OE1-CE 2.98Å; E203-K261 IonicContact OE1-NZ 3.99Å; E203-K261 PolarHBondContact OE1-NZ 3.29Å; E203-K261 IonicContact OE2-NZ 3.33Å; E203-K261 PolarHBondContact OE2-NZ 2.9Å
204	L	97.2	Very high	92.8	Very high	38 Å²	38	45 Å²	45	20%	0.199	25%	0.245	C	C	.	.			trans	-86	140.8	174.1	-176.7	73.1	0	0	0	109.5	L107 H117 A126	L107-L204 HydrophobicContact CD1-CD1 4.01Å; H117-L204 WeakPolarHBondContact CD2-CD2 3.43Å; H117-L204 WeakPolarHBondContact NE2-CD2 3.4Å; A126-L204 HydrophobicContact CB-CD1 4.09Å
205	G	96	Very high	92.5	Very high	11 Å²	11	50.5 Å²	50.5	11%	0.113	27%	0.267	C	S	.	.			trans	-137.7	164.1	167.7	0	0	0	0	0	111.6
206	E	94.4	Very high	92.3	Very high	123 Å²	123	53.5 Å²	53.5	58%	0.575	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.6	-179.3	-63.9	-55.7	131.4	0	0	110.1	V254 V255	E206-V254 CarbonylContact O-C 3.49Å; E206-V254 VanDerWaalsContact O-CA 3.29Å; E206-V254 WeakPolarHBondContact O-CA 3.41Å; E206-V254 WeakPolarHBondContact O-CB 3.5Å; E206-V255 PolarHBondContact N-O 3.36Å; E206-V255 PolarHBondContact O-N 2.82Å
207	P	92.4	Very high	92.2	Very high	95 Å²	95	48.8 Å²	48.8	62%	0.617	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.3	142	174.5	-24.2	34	0	0	0	111.5	N209	P207-N209 PolarHBondContact O-N 3.09Å
208	M	86	Confident	92.2	Very high	41 Å²	41	46.9 Å²	46.9	20%	0.202	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-66.6	130	-179.4	-61.6	-147.9	-56.1	0	0	112.6	L213 A250 F253 F260 F320	M208-L213 HydrophobicContact CB-CD1 4.4Å; M208-L213 HydrophobicContact SD-CD1 3.99Å; M208-A250 VanDerWaalsContact CE-C 3.41Å; M208-A250 HydrophobicContact CE-CB 3.3Å; M208-A250 WeakPolarHBondContact CE-O 3.31Å; M208-F253 HydrophobicContact CE-CB 4.35Å; M208-F253 HydrophobicContact CG-CB 4.32Å; M208-F253 WeakPolarHBondContact CG-O 3.42Å; M208-F253 HydrophobicContact SD-CB 4.07Å; M208-F260 HydrophobicContact CG-CD1 4.37Å; M208-F260 HydrophobicContact CG-CE1 3.89Å; M208-F260 HydrophobicContact SD-CD1 3.62Å; M208-F260 HydrophobicContact SD-CE1 2.98Å; M208-F260 WeakPolarHBondContact SD-CE1 3.43Å; M208-F260 HydrophobicContact SD-CE2 4.48Å; M208-F260 HydrophobicContact SD-CZ 3.47Å; M208-F260 WeakPolarHBondContact SD-CZ 3.48Å; M208-F320 HydrophobicContact CE-CD1 4.42Å; M208-F320 HydrophobicContact CE-CE1 3.26Å; M208-F320 HydrophobicContact CE-CZ 3.55Å; M208-F320 HydrophobicContact SD-CE1 3.63Å; M208-F320 HydrophobicContact SD-CZ 4.18Å
209	N	88.6	Confident	92.2	Very high	71 Å²	71	47 Å²	47	38%	0.38	25%	0.248	S	C	.	.			trans	-119.7	119.6	167.2	-177.4	-38.4	0	0	0	109.5	P207 V211 Q212 L213	P207-N209 PolarHBondContact O-N 3.09Å; N209-V211 VanDerWaalsContact C-N 3.25Å; N209-V211 PolarHBondContact O-N 3.42Å; N209-V211 WeakPolarHBondContact OD1-CB 3.32Å; N209-V211 PolarHBondContact OD1-N 2.97Å; N209-Q212 HydrophobicContact CB-CB 4.08Å; N209-Q212 HydrophobicContact CB-CG 3.94Å; N209-Q212 PolarHBondContact O-N 2.76Å; N209-Q212 VanDerWaalsContact O-N 3.11Å; N209-Q212 PolarHBondContact OD1-N 2.8Å; N209-L213 WeakPolarHBondContact O-CG 3.16Å; N209-L213 PolarHBondContact O-N 2.83Å
210	L	87.6	Confident	92.1	Very high	99 Å²	99	48.5 Å²	48.5	52%	0.518	26%	0.259	S	S	.	.	H	α-helix	trans	-55	-40.5	-178	178.8	60.7	0	0	0	112.5	L213 L214 F322	L210-L213 PolarHBondContact O-N 3.49Å; L210-L214 HydrophobicContact CD1-CD1 4.23Å; L210-L214 HydrophobicContact CD1-CG 4.23Å; L210-L214 HydrophobicContact CG-CD1 4.15Å; L210-L214 WeakPolarHBondContact O-CG 3.37Å; L210-L214 PolarHBondContact O-N 3.45Å; L210-F322 HydrophobicContact CD1-CD1 4.44Å; L210-F322 HydrophobicContact CD1-CD2 4.05Å; L210-F322 HydrophobicContact CD1-CE1 3.88Å; L210-F322 HydrophobicContact CD1-CE2 3.46Å; L210-F322 VanDerWaalsContact CD1-CE2 3.46Å; L210-F322 HydrophobicContact CD1-CZ 3.36Å
211	V	86.8	Confident	92	Very high	88 Å²	88	49 Å²	49	53%	0.533	26%	0.26	S	S	.	.	H	α-helix	trans	-64.2	-45.8	179.6	179.3	0	0	0	0	110.3	N209 L213 L214 Q215	N209-V211 VanDerWaalsContact C-N 3.25Å; N209-V211 PolarHBondContact O-N 3.42Å; N209-V211 WeakPolarHBondContact OD1-CB 3.32Å; N209-V211 PolarHBondContact OD1-N 2.97Å; V211-L213 VanDerWaalsContact C-N 3.34Å; V211-L213 PolarHBondContact O-N 3.45Å; V211-L214 PolarHBondContact O-N 2.75Å; V211-Q215 WeakPolarHBondContact O-CG 3.49Å; V211-Q215 PolarHBondContact O-N 2.97Å; V211-Q215 VanDerWaalsContact O-N 3.14Å
212	Q	87.9	Confident	92	Very high	112 Å²	112	49 Å²	49	52%	0.523	26%	0.26	S	S	.	.	H	α-helix	trans	-63.6	-40.7	177.5	-66.6	178.2	-9.3	0	0	111.5	N209 L214 Q215 L216	N209-Q212 HydrophobicContact CB-CB 4.08Å; N209-Q212 HydrophobicContact CB-CG 3.94Å; N209-Q212 PolarHBondContact O-N 2.76Å; N209-Q212 VanDerWaalsContact O-N 3.11Å; N209-Q212 PolarHBondContact OD1-N 2.8Å; Q212-L214 VanDerWaalsContact C-N 3.34Å; Q212-L214 PolarHBondContact O-N 3.34Å; Q212-Q215 PolarHBondContact O-N 3.35Å; Q212-L216 PolarHBondContact O-N 2.96Å
213	L	89.4	Confident	92	Very high	9 Å²	9	51 Å²	51	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-38.1	176.8	-68.8	178.8	0	0	0	112.7	M208 N209 L210 V211 Q215 L216 R221 L224 V255 F260 F322	M208-L213 HydrophobicContact CB-CD1 4.4Å; M208-L213 HydrophobicContact SD-CD1 3.99Å; N209-L213 WeakPolarHBondContact O-CG 3.16Å; N209-L213 PolarHBondContact O-N 2.83Å; L210-L213 PolarHBondContact O-N 3.49Å; V211-L213 VanDerWaalsContact C-N 3.34Å; V211-L213 PolarHBondContact O-N 3.45Å; L213-Q215 VanDerWaalsContact C-N 3.29Å; L213-Q215 PolarHBondContact O-N 3.42Å; L213-L216 HydrophobicContact CD2-CD1 3.89Å; L213-L216 WeakPolarHBondContact O-CB 3.46Å; L213-L216 PolarHBondContact O-N 2.91Å; L213-R221 WeakPolarHBondContact O-CD 2.92Å; L213-L224 HydrophobicContact CD2-CD1 3.61Å; L213-V255 HydrophobicContact CD2-CG2 4.49Å; L213-F260 HydrophobicContact CD1-CE1 4.48Å; L213-F260 HydrophobicContact CD1-CZ 4.09Å; L213-F260 HydrophobicContact CD2-CE1 4.26Å; L213-F260 HydrophobicContact CD2-CZ 4.08Å; L213-F322 HydrophobicContact CB-CE2 4.35Å; L213-F322 HydrophobicContact CD1-CZ 4.06Å
214	L	87.1	Confident	92.1	Very high	73 Å²	73	50.3 Å²	50.3	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-71.2	-25.2	177.1	-71.5	173.8	0	0	0	112.9	L210 V211 Q212 L216 R221 F322	L210-L214 HydrophobicContact CD1-CD1 4.23Å; L210-L214 HydrophobicContact CD1-CG 4.23Å; L210-L214 HydrophobicContact CG-CD1 4.15Å; L210-L214 WeakPolarHBondContact O-CG 3.37Å; L210-L214 PolarHBondContact O-N 3.45Å; V211-L214 PolarHBondContact O-N 2.75Å; Q212-L214 VanDerWaalsContact C-N 3.34Å; Q212-L214 PolarHBondContact O-N 3.34Å; L214-L216 VanDerWaalsContact C-N 3.34Å; L214-R221 PolarHBondContact O-NH1 2.63Å; L214-F322 HydrophobicContact CD2-CD2 3.81Å; L214-F322 HydrophobicContact CD2-CE2 4.1Å; L214-F322 HydrophobicContact CG-CE2 4.47Å
215	Q	87.7	Confident	92.1	Very high	127 Å²	127	48.5 Å²	48.5	59%	0.593	26%	0.256	S	S	*	.	H	α-helix	trans	-80.2	-13.5	175.1	-71.1	173.7	-12.8	0	0	113.5	V211 Q212 L213	V211-Q215 WeakPolarHBondContact O-CG 3.49Å; V211-Q215 PolarHBondContact O-N 2.97Å; V211-Q215 VanDerWaalsContact O-N 3.14Å; Q212-Q215 PolarHBondContact O-N 3.35Å; L213-Q215 VanDerWaalsContact C-N 3.29Å; L213-Q215 PolarHBondContact O-N 3.42Å
216	L	90.7	Very high	92.2	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.335	25%	0.252	S	S	.	.	S	Bend	trans	-64.4	145.4	173	-63.8	178.1	0	0	0	111.1	Q212 L213 L214 R221 L224	Q212-L216 PolarHBondContact O-N 2.96Å; L213-L216 HydrophobicContact CD2-CD1 3.89Å; L213-L216 WeakPolarHBondContact O-CB 3.46Å; L213-L216 PolarHBondContact O-N 2.91Å; L214-L216 VanDerWaalsContact C-N 3.34Å; L216-R221 HydrophobicContact CB-CG 3.89Å; L216-R221 PolarHBondContact O-NH1 3.35Å; L216-L224 HydrophobicContact CD1-CD1 3.44Å; L216-L224 VanDerWaalsContact CD1-CD1 3.44Å
217	S	91.8	Very high	92.4	Very high	7 Å²	7	42.3 Å²	42.3	5%	0.049	22%	0.224	C	C	.	.			trans	-57.6	152.3	167.9	69.7	0	0	0	0	110.6	E219 S220 R221 D399 Y401	S217-E219 PolarHBondContact O-N 3.29Å; S217-S220 WeakPolarHBondContact O-CB 3.28Å; S217-S220 PolarHBondContact O-N 3.47Å; S217-S220 PolarHBondContact OG-N 3.48Å; S217-S220 PolarHBondContact OG-OG 3.46Å; S217-R221 PolarHBondContact O-N 3.21Å; S217-D399 WeakPolarHBondContact CB-O 3.37Å; S217-Y401 WeakPolarHBondContact OG-CD1 3.27Å; S217-Y401 VanDerWaalsContact OG-CE1 3.28Å; S217-Y401 WeakPolarHBondContact OG-CE1 3.42Å
218	W	93	Very high	92.7	Very high	6 Å²	6	37.9 Å²	37.9	2%	0.023	20%	0.196	C	C	.	.	H	α-helix	trans	-57	-38.2	-179.2	-179.9	83.6	0	0	0	112.4	S220 R221 L222 H326 G327 V328 P329 L332 V336 L360 Y364	W218-S220 PolarHBondContact O-N 3Å; W218-R221 PolarHBondContact O-N 3.04Å; W218-L222 HydrophobicContact CH2-CD2 3.73Å; W218-L222 HydrophobicContact CZ2-CD2 4.49Å; W218-L222 HydrophobicContact CZ3-CD2 3.77Å; W218-L222 WeakPolarHBondContact O-CB 3.41Å; W218-L222 PolarHBondContact O-N 3.45Å; W218-H326 VanDerWaalsContact CD1-O 3.28Å; W218-G327 VanDerWaalsContact CB-O 3.29Å; W218-G327 WeakPolarHBondContact CB-O 3.45Å; W218-G327 VanDerWaalsContact CG-O 3.31Å; W218-V328 HydrophobicContact CZ2-CG1 4.26Å; W218-P329 HydrophobicContact CD2-CG 4.5Å; W218-P329 HydrophobicContact CE3-CG 4.1Å; W218-P329 HydrophobicContact CZ3-CG 4.21Å; W218-L332 HydrophobicContact CH2-CD1 3.73Å; W218-L332 HydrophobicContact CZ3-CD1 4.16Å; W218-V336 HydrophobicContact CZ2-CG2 3.96Å; W218-L360 HydrophobicContact CH2-CD1 4.27Å; W218-Y364 HydrophobicContact CE3-CD2 4.16Å; W218-Y364 AromaticContact CE3-CE2 3.9Å; W218-Y364 HydrophobicContact CE3-CE2 3.9Å; W218-Y364 HydrophobicContact CH2-CD2 4.18Å; W218-Y364 HydrophobicContact CH2-CG 4.35Å; W218-Y364 HydrophobicContact CZ3-CD1 4.13Å; W218-Y364 AromaticContact CZ3-CD2 3.36Å; W218-Y364 HydrophobicContact CZ3-CD2 3.36Å; W218-Y364 HydrophobicContact CZ3-CE1 4.34Å; W218-Y364 AromaticContact CZ3-CE2 3.59Å; W218-Y364 HydrophobicContact CZ3-CE2 3.59Å; W218-Y364 AromaticContact CZ3-CG 3.63Å; W218-Y364 HydrophobicContact CZ3-CG 3.63Å
219	E	95	Very high	93.3	Very high	3 Å²	3	36 Å²	36	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-39.9	175.5	175.4	174.8	-161.8	0	0	112.9	S217 L222 K223 Y364 Y401 S409 S436 W437 T438	S217-E219 PolarHBondContact O-N 3.29Å; E219-L222 WeakPolarHBondContact O-CB 3.27Å; E219-L222 PolarHBondContact O-N 3.48Å; E219-K223 PolarHBondContact O-N 3.05Å; E219-Y364 HydrophobicContact CB-CE1 3.74Å; E219-Y364 HydrophobicContact CG-CD1 4.49Å; E219-Y364 HydrophobicContact CG-CE1 3.65Å; E219-Y401 PolarHBondContact OE2-OH 3.29Å; E219-S409 WeakPolarHBondContact OE2-CB 3.36Å; E219-S409 PolarHBondContact OE2-OG 3.02Å; E219-S436 WeakPolarHBondContact OE1-CB 3.35Å; E219-S436 PolarHBondContact OE1-OG 2.95Å; E219-W437 PolarHBondContact O-NE1 3.47Å; E219-T438 HydrophobicContact CG-CG2 4.41Å; E219-T438 WeakPolarHBondContact OE1-CG2 3.04Å; E219-T438 PolarHBondContact OE1-OG1 2.81Å
220	S	94.7	Very high	93.7	Very high	33 Å²	33	36.7 Å²	36.7	23%	0.231	18%	0.184	C	C	.	.	H	α-helix	trans	-67.6	-38.8	175.9	-68.3	0	0	0	0	111.2	S217 W218 L222 K223 L224	S217-S220 WeakPolarHBondContact O-CB 3.28Å; S217-S220 PolarHBondContact O-N 3.47Å; S217-S220 PolarHBondContact OG-N 3.48Å; S217-S220 PolarHBondContact OG-OG 3.46Å; W218-S220 PolarHBondContact O-N 3Å; S220-L222 VanDerWaalsContact C-N 3.33Å; S220-K223 WeakPolarHBondContact O-CB 3.42Å; S220-K223 PolarHBondContact O-N 2.89Å; S220-L224 PolarHBondContact O-N 3.37Å; S220-L224 VanDerWaalsContact O-N 3.16Å
221	R	95.9	Very high	94.3	Very high	9 Å²	9	32 Å²	32	3%	0.034	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-36	172.5	-66.5	-161.5	-69.6	-115.1	-7	112.7	L213 L214 L216 S217 W218 K223 L224 F225 L323 H326	L213-R221 WeakPolarHBondContact O-CD 2.92Å; L214-R221 PolarHBondContact O-NH1 2.63Å; L216-R221 HydrophobicContact CB-CG 3.89Å; L216-R221 PolarHBondContact O-NH1 3.35Å; S217-R221 PolarHBondContact O-N 3.21Å; W218-R221 PolarHBondContact O-N 3.04Å; R221-K223 VanDerWaalsContact C-N 3.35Å; R221-L224 WeakPolarHBondContact O-CB 3.49Å; R221-L224 PolarHBondContact O-N 2.74Å; R221-F225 WeakPolarHBondContact O-CB 3.49Å; R221-F225 PolarHBondContact O-N 2.8Å; R221-L323 HydrophobicContact CB-CB 4.4Å; R221-L323 HydrophobicContact CB-CD2 4.42Å; R221-L323 WeakPolarHBondContact CB-O 3.36Å; R221-L323 VanDerWaalsContact CD-O 3.27Å; R221-L323 WeakPolarHBondContact CD-O 3.09Å; R221-L323 HydrophobicContact CG-CD2 4.29Å; R221-L323 PolarHBondContact NE-O 3.14Å; R221-L323 VanDerWaalsContact NE-O 3.07Å; R221-H326 PolarHBondContact NH2-O 3.1Å
222	L	97.1	Very high	94.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-40.2	174.7	-179	63.4	0	0	0	111.4	W218 E219 S220 F225 L226 L324 L360 V361 Y364 W437	W218-L222 HydrophobicContact CH2-CD2 3.73Å; W218-L222 HydrophobicContact CZ2-CD2 4.49Å; W218-L222 HydrophobicContact CZ3-CD2 3.77Å; W218-L222 WeakPolarHBondContact O-CB 3.41Å; W218-L222 PolarHBondContact O-N 3.45Å; E219-L222 WeakPolarHBondContact O-CB 3.27Å; E219-L222 PolarHBondContact O-N 3.48Å; S220-L222 VanDerWaalsContact C-N 3.33Å; L222-F225 PolarHBondContact O-N 3.45Å; L222-L226 WeakPolarHBondContact O-CB 3.36Å; L222-L226 PolarHBondContact O-N 3.25Å; L222-L324 HydrophobicContact CD1-CD2 3.94Å; L222-L360 HydrophobicContact CD1-CD2 3.75Å; L222-L360 HydrophobicContact CD1-CG 4.22Å; L222-V361 HydrophobicContact CD1-CG2 4.1Å; L222-V361 HydrophobicContact CD2-CG2 3.79Å; L222-V361 HydrophobicContact CG-CG2 3.85Å; L222-Y364 HydrophobicContact CD2-CD1 4.47Å; L222-W437 HydrophobicContact CG-CZ2 4.43Å
223	K	97.6	Very high	95.3	Very high	45 Å²	45	23.6 Å²	23.6	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-59.2	-48.3	174.1	-164.9	-177.7	178.4	-170.5	0	111.8	E219 S220 R221 L226 S227 N257 G258 E259 W437	E219-K223 PolarHBondContact O-N 3.05Å; S220-K223 WeakPolarHBondContact O-CB 3.42Å; S220-K223 PolarHBondContact O-N 2.89Å; R221-K223 VanDerWaalsContact C-N 3.35Å; K223-L226 WeakPolarHBondContact O-CB 3.41Å; K223-L226 PolarHBondContact O-N 3.09Å; K223-S227 PolarHBondContact O-N 2.99Å; K223-N257 PolarHBondContact NZ-O 3.18Å; K223-G258 WeakPolarHBondContact CD-O 3.43Å; K223-E259 HydrophobicContact CD-CG 4.49Å; K223-E259 HydrophobicContact CG-CG 4.47Å; K223-W437 HydrophobicContact CB-CD2 4.13Å; K223-W437 HydrophobicContact CB-CH2 4.34Å; K223-W437 HydrophobicContact CB-CZ2 3.65Å; K223-W437 HydrophobicContact CD-CB 4.27Å; K223-W437 HydrophobicContact CD-CD2 3.94Å; K223-W437 HydrophobicContact CD-CG 3.78Å; K223-W437 HydrophobicContact CG-CD2 3.87Å; K223-W437 HydrophobicContact CG-CE3 4.25Å; K223-W437 HydrophobicContact CG-CG 4.26Å; K223-W437 HydrophobicContact CG-CH2 4.46Å; K223-W437 HydrophobicContact CG-CZ2 4.13Å
224	L	97.4	Very high	95.7	Very high	3 Å²	3	25 Å²	25	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-48.1	176.4	-73.5	175.4	0	0	0	111.1	L213 L216 S220 R221 L226 S227 L228 V255 G258 F260	L213-L224 HydrophobicContact CD2-CD1 3.61Å; L216-L224 HydrophobicContact CD1-CD1 3.44Å; L216-L224 VanDerWaalsContact CD1-CD1 3.44Å; S220-L224 PolarHBondContact O-N 3.37Å; S220-L224 VanDerWaalsContact O-N 3.16Å; R221-L224 WeakPolarHBondContact O-CB 3.49Å; R221-L224 PolarHBondContact O-N 2.74Å; L224-L226 PolarHBondContact O-N 2.99Å; L224-S227 PolarHBondContact O-N 3.13Å; L224-S227 PolarHBondContact O-OG 3.42Å; L224-L228 PolarHBondContact O-N 2.94Å; L224-V255 HydrophobicContact CD2-CG1 4.16Å; L224-V255 HydrophobicContact CD2-CG2 4.15Å; L224-G258 WeakPolarHBondContact CD2-O 3.35Å; L224-F260 HydrophobicContact CB-CD2 3.87Å; L224-F260 HydrophobicContact CB-CE2 3.56Å; L224-F260 HydrophobicContact CB-CZ 4.07Å; L224-F260 HydrophobicContact CD1-CE1 4.37Å; L224-F260 HydrophobicContact CD1-CE2 4.25Å; L224-F260 HydrophobicContact CD1-CZ 3.9Å; L224-F260 HydrophobicContact CD2-CD1 3.97Å; L224-F260 HydrophobicContact CD2-CD2 3.99Å; L224-F260 HydrophobicContact CD2-CE1 3.86Å; L224-F260 HydrophobicContact CD2-CE2 4.02Å; L224-F260 HydrophobicContact CD2-CG 4.01Å; L224-F260 HydrophobicContact CD2-CZ 3.95Å; L224-F260 HydrophobicContact CG-CD2 4.48Å; L224-F260 HydrophobicContact CG-CE2 4.16Å; L224-F260 HydrophobicContact CG-CZ 4.21Å; L224-F260 WeakPolarHBondContact O-CD2 3.45Å
225	F	97.8	Very high	96.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.9	-45.1	177.6	-168.1	-96.1	0	0	0	112	R221 L222 S227 L228 V229 L321 L323 L324 L339 F343 T357	R221-F225 WeakPolarHBondContact O-CB 3.49Å; R221-F225 PolarHBondContact O-N 2.8Å; L222-F225 PolarHBondContact O-N 3.45Å; F225-S227 VanDerWaalsContact C-N 3.25Å; F225-S227 PolarHBondContact O-N 3.04Å; F225-L228 WeakPolarHBondContact O-CB 3.31Å; F225-L228 PolarHBondContact O-N 2.82Å; F225-V229 HydrophobicContact CD1-CG2 3.75Å; F225-V229 HydrophobicContact CE1-CG2 3.47Å; F225-V229 VanDerWaalsContact CE1-CG2 3.47Å; F225-V229 HydrophobicContact CZ-CG2 4.11Å; F225-V229 WeakPolarHBondContact O-CG2 3.14Å; F225-V229 PolarHBondContact O-N 3.05Å; F225-L321 HydrophobicContact CE2-CD1 4.37Å; F225-L321 HydrophobicContact CZ-CD1 4.47Å; F225-L323 HydrophobicContact CD2-CB 4.42Å; F225-L323 HydrophobicContact CD2-CD1 4.37Å; F225-L324 HydrophobicContact CB-CD2 4.06Å; F225-L324 HydrophobicContact CB-CG 4.31Å; F225-L324 HydrophobicContact CD1-CD1 3.57Å; F225-L324 HydrophobicContact CD1-CD2 4.44Å; F225-L324 HydrophobicContact CD1-CG 4.14Å; F225-L324 HydrophobicContact CD2-CD1 4.15Å; F225-L324 HydrophobicContact CD2-CG 4.05Å; F225-L324 HydrophobicContact CE1-CD1 3.59Å; F225-L324 HydrophobicContact CE1-CG 4.49Å; F225-L324 HydrophobicContact CE2-CD1 4.18Å; F225-L324 HydrophobicContact CE2-CG 4.41Å; F225-L324 HydrophobicContact CG-CD1 3.85Å; F225-L324 HydrophobicContact CG-CD2 4.16Å; F225-L324 HydrophobicContact CG-CG 3.89Å; F225-L324 HydrophobicContact CZ-CD1 3.91Å; F225-L339 HydrophobicContact CE1-CD2 4.19Å; F225-F343 AromaticContact CE1-CE2 3.72Å; F225-F343 HydrophobicContact CE1-CE2 3.72Å; F225-F343 AromaticContact CE1-CZ 3.94Å; F225-F343 HydrophobicContact CE1-CZ 3.94Å; F225-F343 AromaticContact CZ-CD2 3.97Å; F225-F343 HydrophobicContact CZ-CD2 3.97Å; F225-F343 HydrophobicContact CZ-CE1 4.15Å; F225-F343 AromaticContact CZ-CE2 3.48Å; F225-F343 HydrophobicContact CZ-CE2 3.48Å; F225-F343 VanDerWaalsContact CZ-CE2 3.48Å; F225-F343 AromaticContact CZ-CZ 3.6Å; F225-F343 HydrophobicContact CZ-CZ 3.6Å; F225-T357 HydrophobicContact CD1-CG2 4.06Å; F225-T357 HydrophobicContact CE1-CG2 4.43Å
226	L	98.4	Very high	96.7	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	8%	0.08	C	C	.	.	H	α-helix	trans	-55.8	-40.2	176	176.5	64.6	0	0	0	112.1	L222 K223 L224 L228 V229 R230 T357 N358 V361 W437	L222-L226 WeakPolarHBondContact O-CB 3.36Å; L222-L226 PolarHBondContact O-N 3.25Å; K223-L226 WeakPolarHBondContact O-CB 3.41Å; K223-L226 PolarHBondContact O-N 3.09Å; L224-L226 PolarHBondContact O-N 2.99Å; L226-L228 VanDerWaalsContact C-N 3.33Å; L226-L228 PolarHBondContact O-N 2.82Å; L226-V229 PolarHBondContact O-N 3.21Å; L226-R230 HydrophobicContact CD1-CG 4.41Å; L226-R230 WeakPolarHBondContact O-CG 3.42Å; L226-R230 PolarHBondContact O-N 3.45Å; L226-T357 HydrophobicContact CB-CG2 4.32Å; L226-T357 HydrophobicContact CD1-CG2 3.87Å; L226-N358 WeakPolarHBondContact CD1-OD1 3.03Å; L226-V361 HydrophobicContact CD2-CG2 4.1Å; L226-W437 HydrophobicContact CD2-CH2 3.87Å; L226-W437 HydrophobicContact CD2-CZ3 3.89Å
227	S	98.2	Very high	96.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-37.3	176.6	74.3	0	0	0	0	112.6	S176 K223 L224 F225 L231 F260	S176-S227 PolarHBondContact OG-O 2.68Å; S176-S227 VanDerWaalsContact OG-O 3.05Å; K223-S227 PolarHBondContact O-N 2.99Å; L224-S227 PolarHBondContact O-N 3.13Å; L224-S227 PolarHBondContact O-OG 3.42Å; F225-S227 VanDerWaalsContact C-N 3.25Å; F225-S227 PolarHBondContact O-N 3.04Å; S227-L231 PolarHBondContact O-N 3.12Å; S227-F260 PolarHBondContact OG-N 3.38Å
228	L	97.8	Very high	96.9	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	9%	0.094	C	C	.	.	H	α-helix	trans	-66.1	-44.3	173.9	-65	167.2	0	0	0	111.6	L224 F225 L226 R230 L231 L232 F253 F260 F320 L323	L224-L228 PolarHBondContact O-N 2.94Å; F225-L228 WeakPolarHBondContact O-CB 3.31Å; F225-L228 PolarHBondContact O-N 2.82Å; L226-L228 VanDerWaalsContact C-N 3.33Å; L226-L228 PolarHBondContact O-N 2.82Å; L228-R230 VanDerWaalsContact C-N 3.31Å; L228-R230 PolarHBondContact O-N 3.13Å; L228-L231 WeakPolarHBondContact O-CB 3.31Å; L228-L231 PolarHBondContact O-N 3.07Å; L228-L231 VanDerWaalsContact O-N 3.13Å; L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 2.89Å; L228-F253 HydrophobicContact CD2-CD1 4.24Å; L228-F253 HydrophobicContact CD2-CE1 3.82Å; L228-F253 HydrophobicContact CD2-CZ 4.17Å; L228-F260 HydrophobicContact CD1-CD2 3.74Å; L228-F260 HydrophobicContact CD1-CE2 3.89Å; L228-F260 HydrophobicContact CD2-CB 4.13Å; L228-F260 HydrophobicContact CD2-CD2 3.89Å; L228-F260 HydrophobicContact CD2-CG 4.31Å; L228-F260 HydrophobicContact CG-CD2 3.65Å; L228-F260 HydrophobicContact CG-CE2 4.32Å; L228-F260 HydrophobicContact CG-CG 4.49Å; L228-F320 HydrophobicContact CD1-CB 3.52Å; L228-F320 HydrophobicContact CD1-CD1 3.75Å; L228-F320 HydrophobicContact CD1-CD2 3.73Å; L228-F320 HydrophobicContact CD1-CE1 4.3Å; L228-F320 HydrophobicContact CD1-CE2 4.32Å; L228-F320 HydrophobicContact CD1-CG 3.4Å; L228-F320 HydrophobicContact CD2-CD2 4.21Å; L228-F320 HydrophobicContact CD2-CE2 4.08Å; L228-F320 HydrophobicContact CD2-CZ 4.35Å; L228-L323 HydrophobicContact CD1-CD1 4.18Å
229	V	98.3	Very high	96.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.4	-35.3	-178.4	-169.5	0	0	0	0	111.5	F225 L226 L232 D233 F343 L353 K354 T357	F225-V229 HydrophobicContact CD1-CG2 3.75Å; F225-V229 HydrophobicContact CE1-CG2 3.47Å; F225-V229 VanDerWaalsContact CE1-CG2 3.47Å; F225-V229 HydrophobicContact CZ-CG2 4.11Å; F225-V229 WeakPolarHBondContact O-CG2 3.14Å; F225-V229 PolarHBondContact O-N 3.05Å; L226-V229 PolarHBondContact O-N 3.21Å; V229-L232 PolarHBondContact O-N 3.03Å; V229-D233 PolarHBondContact O-N 3.22Å; V229-D233 VanDerWaalsContact O-N 3.09Å; V229-F343 HydrophobicContact CG1-CZ 4.43Å; V229-F343 HydrophobicContact CG2-CE2 4.41Å; V229-F343 HydrophobicContact CG2-CZ 3.74Å; V229-L353 HydrophobicContact CG1-CB 4.15Å; V229-K354 HydrophobicContact CG1-CB 3.82Å; V229-K354 HydrophobicContact CG1-CG 4.48Å; V229-K354 VanDerWaalsContact CG1-N 3.32Å; V229-T357 HydrophobicContact CG2-CG2 4.28Å
230	R	98.5	Very high	96.4	Very high	87 Å²	87	24.3 Å²	24.3	33%	0.328	13%	0.13	S	C	.	.	H	α-helix	trans	-62.3	-42.7	170.6	-73	172.6	176.4	171.8	-2.8	111.7	L226 L228 F234 E259	L226-R230 HydrophobicContact CD1-CG 4.41Å; L226-R230 WeakPolarHBondContact O-CG 3.42Å; L226-R230 PolarHBondContact O-N 3.45Å; L228-R230 VanDerWaalsContact C-N 3.31Å; L228-R230 PolarHBondContact O-N 3.13Å; R230-F234 WeakPolarHBondContact O-CB 3.42Å; R230-F234 PolarHBondContact O-N 2.79Å; R230-E259 IonicContact NH1-OE1 2.94Å
231	L	98.3	Very high	96.1	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-46.7	174.5	179.6	60.7	0	0	0	111.7	I177 S227 L228 D233 F234 L235 F253 L262	I177-L231 HydrophobicContact CD1-CD1 3.89Å; I177-L231 HydrophobicContact CG1-CD1 3.74Å; S227-L231 PolarHBondContact O-N 3.12Å; L228-L231 WeakPolarHBondContact O-CB 3.31Å; L228-L231 PolarHBondContact O-N 3.07Å; L228-L231 VanDerWaalsContact O-N 3.13Å; L231-D233 PolarHBondContact O-N 3.11Å; L231-F234 HydrophobicContact CD1-CD1 4.31Å; L231-F234 WeakPolarHBondContact O-CB 3.39Å; L231-F234 PolarHBondContact O-N 2.88Å; L231-L235 HydrophobicContact CD1-CD1 4.09Å; L231-L235 HydrophobicContact CD1-CD2 4.37Å; L231-L235 HydrophobicContact CD1-CG 4.05Å; L231-L235 HydrophobicContact CG-CD1 3.88Å; L231-L235 HydrophobicContact CG-CG 4.3Å; L231-L235 VanDerWaalsContact O-CG 3.24Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 2.84Å; L231-F253 HydrophobicContact CD2-CE1 3.72Å; L231-F253 HydrophobicContact CD2-CZ 4.11Å; L231-L262 HydrophobicContact CD2-CB 4.3Å; L231-L262 HydrophobicContact CD2-CD2 4.33Å
232	L	98.4	Very high	96.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-48.5	179.2	-69.8	176.6	0	0	0	112	L228 V229 F234 L235 A236 N312 I313 T316 F343	L228-L232 WeakPolarHBondContact O-CG 3.48Å; L228-L232 PolarHBondContact O-N 2.89Å; V229-L232 PolarHBondContact O-N 3.03Å; L232-F234 VanDerWaalsContact C-N 3.33Å; L232-F234 PolarHBondContact O-N 3.5Å; L232-L235 PolarHBondContact O-N 3.2Å; L232-A236 WeakPolarHBondContact O-CB 3.4Å; L232-A236 PolarHBondContact O-N 3.43Å; L232-N312 HydrophobicContact CD2-CB 3.57Å; L232-I313 HydrophobicContact CD1-CG1 4.22Å; L232-T316 HydrophobicContact CD1-CG2 4.18Å; L232-F343 HydrophobicContact CD1-CE1 4.14Å
233	D	98.4	Very high	96.1	Very high	22 Å²	22	24.8 Å²	24.8	12%	0.118	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-38.5	177.8	173.4	89.3	0	0	0	112.3	V229 L231 N237 S351 K354	V229-D233 PolarHBondContact O-N 3.22Å; V229-D233 VanDerWaalsContact O-N 3.09Å; L231-D233 PolarHBondContact O-N 3.11Å; D233-N237 WeakPolarHBondContact O-CB 3.39Å; D233-N237 PolarHBondContact O-N 2.97Å; D233-N237 VanDerWaalsContact O-N 3.14Å; D233-N237 PolarHBondContact O-ND2 3.16Å; D233-N237 PolarHBondContact OD1-ND2 3.34Å; D233-S351 WeakPolarHBondContact OD1-CA 3.41Å; D233-S351 VanDerWaalsContact OD1-CB 3.26Å; D233-S351 WeakPolarHBondContact OD1-CB 3.5Å; D233-K354 HydrophobicContact CB-CB 4.26Å; D233-K354 HydrophobicContact CB-CD 3.79Å; D233-K354 VanDerWaalsContact CG-CE 3.45Å; D233-K354 IonicContact OD1-NZ 3.08Å; D233-K354 PolarHBondContact OD1-NZ 3.01Å; D233-K354 VanDerWaalsContact OD2-CE 3.31Å; D233-K354 WeakPolarHBondContact OD2-CE 3.44Å; D233-K354 IonicContact OD2-NZ 2.65Å; D233-K354 PolarHBondContact OD2-NZ 3.34Å
234	F	98	Very high	96	Very high	38 Å²	38	23.2 Å²	23.2	17%	0.167	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-47.1	173.3	167.1	-97.5	0	0	0	111.9	F172 H174 I177 R230 L231 L232 N237 H238	F172-F234 HydrophobicContact CB-CE1 4.25Å; F172-F234 HydrophobicContact CB-CZ 4.24Å; H174-F234 HydrophobicContact CB-CD1 3.98Å; H174-F234 HydrophobicContact CB-CD2 4.26Å; H174-F234 HydrophobicContact CB-CE1 3.97Å; H174-F234 HydrophobicContact CB-CE2 4.24Å; H174-F234 HydrophobicContact CB-CG 4.12Å; H174-F234 HydrophobicContact CB-CZ 4.1Å; H174-F234 AromaticContact CD2-CD2 3.74Å; H174-F234 AromaticContact CD2-CG 3.65Å; H174-F234 AromaticContact CG-CG 3.85Å; I177-F234 HydrophobicContact CD1-CD1 4.34Å; I177-F234 HydrophobicContact CD1-CE1 3.83Å; R230-F234 WeakPolarHBondContact O-CB 3.42Å; R230-F234 PolarHBondContact O-N 2.79Å; L231-F234 HydrophobicContact CD1-CD1 4.31Å; L231-F234 WeakPolarHBondContact O-CB 3.39Å; L231-F234 PolarHBondContact O-N 2.88Å; L232-F234 VanDerWaalsContact C-N 3.33Å; L232-F234 PolarHBondContact O-N 3.5Å; F234-N237 PolarHBondContact O-N 3.06Å; F234-H238 AromaticContact CE2-CD2 3.7Å; F234-H238 AromaticContact CZ-CD2 3.54Å; F234-H238 WeakPolarHBondContact O-CB 3.16Å; F234-H238 PolarHBondContact O-N 3.4Å; F234-H238 VanDerWaalsContact O-N 3.12Å
235	L	97.6	Very high	96	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-42.5	-179.4	-66.2	169	0	0	0	111.5	L231 L232 N237 P242 I243 L245 F265	L231-L235 HydrophobicContact CD1-CD1 4.09Å; L231-L235 HydrophobicContact CD1-CD2 4.37Å; L231-L235 HydrophobicContact CD1-CG 4.05Å; L231-L235 HydrophobicContact CG-CD1 3.88Å; L231-L235 HydrophobicContact CG-CG 4.3Å; L231-L235 VanDerWaalsContact O-CG 3.24Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 2.84Å; L232-L235 PolarHBondContact O-N 3.2Å; L235-N237 PolarHBondContact O-N 3.07Å; L235-P242 CarbonylContact O-C 3.59Å; L235-P242 WeakPolarHBondContact O-CA 3.37Å; L235-I243 HydrophobicContact CB-CB 4.19Å; L235-I243 HydrophobicContact CD2-CB 3.77Å; L235-I243 HydrophobicContact CD2-CD1 4.07Å; L235-I243 HydrophobicContact CD2-CG1 4.46Å; L235-I243 HydrophobicContact CD2-CG2 3.84Å; L235-I243 PolarHBondContact O-N 3.37Å; L235-L245 HydrophobicContact CD1-CD1 3.55Å; L235-L245 HydrophobicContact CD1-CD2 4.41Å; L235-L245 HydrophobicContact CD1-CG 3.86Å; L235-L245 HydrophobicContact CD2-CD2 4.41Å; L235-F265 HydrophobicContact CD2-CE2 4.26Å; L235-F265 HydrophobicContact CD2-CZ 3.96Å
236	A	96.9	Very high	95.8	Very high	15 Å²	15	27 Å²	27	12%	0.124	15%	0.151	C	C	.	.	H	α-helix	trans	-68.3	-32.8	-178.5	0	0	0	0	0	113.4	L232 D309 S350	L232-A236 WeakPolarHBondContact O-CB 3.4Å; L232-A236 PolarHBondContact O-N 3.43Å; A236-D309 HydrophobicContact CB-CB 3.99Å; A236-D309 WeakPolarHBondContact CB-OD1 3.4Å; A236-S350 WeakPolarHBondContact CB-OG 3.48Å
237	N	95.3	Very high	95.5	Very high	99 Å²	99	29.1 Å²	29.1	53%	0.529	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	15.3	-174.2	-59.2	-73.5	0	0	0	113.3	D233 F234 L235	D233-N237 WeakPolarHBondContact O-CB 3.39Å; D233-N237 PolarHBondContact O-N 2.97Å; D233-N237 VanDerWaalsContact O-N 3.14Å; D233-N237 PolarHBondContact O-ND2 3.16Å; D233-N237 PolarHBondContact OD1-ND2 3.34Å; F234-N237 PolarHBondContact O-N 3.06Å; L235-N237 PolarHBondContact O-N 3.07Å
238	H	93	Very high	95.3	Very high	33 Å²	33	29.4 Å²	29.4	15%	0.153	16%	0.164	C	C	.	.			trans	-65	137.5	-176.7	-170.4	-95.3	0	0	0	111.2	F172 F234 A240 G241 I243	F172-H238 AromaticContact CD1-CD2 3.99Å; F172-H238 AromaticContact CD1-CE1 3.43Å; F172-H238 VanDerWaalsContact CD1-CE1 3.43Å; F172-H238 WeakPolarHBondContact CD1-CE1 3.08Å; F172-H238 AromaticContact CD1-ND1 3.83Å; F172-H238 AromaticContact CD1-NE2 3.54Å; F172-H238 AromaticContact CE1-CE1 3.39Å; F172-H238 WeakPolarHBondContact CE1-CE1 3.49Å; F172-H238 AromaticContact CE1-ND1 3.62Å; F234-H238 AromaticContact CE2-CD2 3.7Å; F234-H238 AromaticContact CZ-CD2 3.54Å; F234-H238 WeakPolarHBondContact O-CB 3.16Å; F234-H238 PolarHBondContact O-N 3.4Å; F234-H238 VanDerWaalsContact O-N 3.12Å; H238-A240 WeakPolarHBondContact ND1-CB 3.49Å; H238-A240 PolarHBondContact ND1-N 3.38Å; H238-A240 VanDerWaalsContact ND1-N 3.17Å; H238-A240 PolarHBondContact O-N 3.15Å; H238-G241 CarbonylContact O-C 3.52Å; H238-G241 PolarHBondContact O-N 2.83Å; H238-I243 HydrophobicContact CB-CD1 3.84Å; H238-I243 HydrophobicContact CB-CG1 4.12Å
239	P	89.1	Confident	95	Very high	106 Å²	106	34.6 Å²	34.6	69%	0.688	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-17	-176.8	-27.1	35.5	0	0	0	116.1	G241	P239-G241 VanDerWaalsContact C-N 3.32Å
240	A	87.5	Confident	94.7	Very high	13 Å²	13	35.6 Å²	35.6	11%	0.107	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.7	175.9	0	0	0	0	0	113.5	S55 M56 F172 H238	S55-A240 PolarHBondContact OG-O 3.21Å; M56-A240 HydrophobicContact CE-CB 3.84Å; F172-A240 HydrophobicContact CE1-CB 4.44Å; H238-A240 WeakPolarHBondContact ND1-CB 3.49Å; H238-A240 PolarHBondContact ND1-N 3.38Å; H238-A240 VanDerWaalsContact ND1-N 3.17Å; H238-A240 PolarHBondContact O-N 3.15Å
241	G	89.6	Confident	94.3	Very high	19 Å²	19	38.1 Å²	38.1	20%	0.196	21%	0.207	C	C	.	.			trans	121.9	158.1	-171.3	0	0	0	0	0	111.8	H238 P239 I243	H238-G241 CarbonylContact O-C 3.52Å; H238-G241 PolarHBondContact O-N 2.83Å; P239-G241 VanDerWaalsContact C-N 3.32Å; G241-I243 PolarHBondContact O-N 3.15Å
242	P	94.5	Very high	94.1	Very high	33 Å²	33	39.4 Å²	39.4	21%	0.214	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-62.2	119.7	175.3	-21.3	33.9	0	0	0	111.2	L235 E272 N308	L235-P242 CarbonylContact O-C 3.59Å; L235-P242 WeakPolarHBondContact O-CA 3.37Å; P242-E272 HydrophobicContact CG-CG 4.48Å; P242-N308 HydrophobicContact CB-CB 4.05Å; P242-N308 PolarHBondContact O-ND2 3.15Å
243	I	96.4	Very high	93.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-88.6	126.6	-174.6	-53.7	176.2	0	0	0	109.7	F172 L235 H238 G241 F265 I268 G269 L270 N312	F172-I243 HydrophobicContact CD1-CD1 3.37Å; F172-I243 HydrophobicContact CE1-CD1 3.47Å; F172-I243 VanDerWaalsContact CE1-CD1 3.47Å; F172-I243 HydrophobicContact CE1-CG1 4.44Å; F172-I243 HydrophobicContact CG-CD1 4.04Å; F172-I243 HydrophobicContact CZ-CD1 4.21Å; L235-I243 HydrophobicContact CB-CB 4.19Å; L235-I243 HydrophobicContact CD2-CB 3.77Å; L235-I243 HydrophobicContact CD2-CD1 4.07Å; L235-I243 HydrophobicContact CD2-CG1 4.46Å; L235-I243 HydrophobicContact CD2-CG2 3.84Å; L235-I243 PolarHBondContact O-N 3.37Å; H238-I243 HydrophobicContact CB-CD1 3.84Å; H238-I243 HydrophobicContact CB-CG1 4.12Å; G241-I243 PolarHBondContact O-N 3.15Å; I243-F265 HydrophobicContact CG2-CZ 4.4Å; I243-I268 HydrophobicContact CG2-CB 4.09Å; I243-I268 HydrophobicContact CG2-CD1 4.38Å; I243-G269 CarbonylContact C-O 3.5Å; I243-G269 VanDerWaalsContact CA-O 3.3Å; I243-G269 WeakPolarHBondContact CA-O 3.32Å; I243-L270 HydrophobicContact CD1-CD2 4.33Å; I243-L270 HydrophobicContact CG1-CD2 3.83Å; I243-L270 HydrophobicContact CG2-CD2 4.3Å; I243-N312 PolarHBondContact O-ND2 3.21Å
244	V	96.9	Very high	93.8	Very high	11 Å²	11	39.1 Å²	39.1	7%	0.067	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.5	168.4	62.6	0	0	0	0	110.8	I268 G269 N308 A311	V244-I268 WeakPolarHBondContact O-CA 3.45Å; V244-G269 PolarHBondContact N-O 3.29Å; V244-G269 PolarHBondContact O-N 2.96Å; V244-N308 HydrophobicContact CB-CB 3.91Å; V244-A311 HydrophobicContact CG2-CB 4.17Å
245	L	96.1	Very high	93.7	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	102.9	172.6	-60.2	179.2	0	0	0	108.2	L235 F248 L262 F265 I268 N312 K315	L235-L245 HydrophobicContact CD1-CD1 3.55Å; L235-L245 HydrophobicContact CD1-CD2 4.41Å; L235-L245 HydrophobicContact CD1-CG 3.86Å; L235-L245 HydrophobicContact CD2-CD2 4.41Å; L245-F248 HydrophobicContact CB-CB 4.04Å; L245-F248 HydrophobicContact CB-CD2 3.99Å; L245-F248 HydrophobicContact CD1-CD2 3.52Å; L245-F248 HydrophobicContact CD1-CE2 3.96Å; L245-F248 HydrophobicContact CG-CD2 4.34Å; L245-L262 HydrophobicContact CD1-CD2 3.47Å; L245-L262 VanDerWaalsContact CD1-CD2 3.47Å; L245-L262 HydrophobicContact CD2-CD2 3.85Å; L245-L262 HydrophobicContact CG-CD2 4.31Å; L245-F265 HydrophobicContact CD2-CD2 4.24Å; L245-F265 HydrophobicContact CD2-CE2 3.7Å; L245-F265 HydrophobicContact CD2-CZ 4.16Å; L245-I268 HydrophobicContact CD2-CG2 3.66Å; L245-N312 PolarHBondContact N-OD1 2.94Å; L245-K315 PolarHBondContact O-NZ 3.46Å
246	N	94.4	Very high	93.7	Very high	77 Å²	77	39.5 Å²	39.5	41%	0.412	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-48.3	-174.5	-67.9	-34.4	0	0	0	110.7	F248 D267 K315	N246-F248 PolarHBondContact O-N 3.23Å; N246-D267 HydrophobicContact CB-CB 4.43Å; N246-D267 VanDerWaalsContact CB-CG 3.5Å; N246-D267 WeakPolarHBondContact CB-O 3.38Å; N246-D267 WeakPolarHBondContact CB-OD1 3.4Å; N246-D267 WeakPolarHBondContact CB-OD2 3.36Å; N246-D267 PolarHBondContact N-O 3.03Å; N246-D267 PolarHBondContact ND2-OD1 2.81Å; N246-K315 PolarHBondContact O-NZ 2.98Å
247	D	91.8	Very high	93.5	Very high	47 Å²	47	45.6 Å²	45.6	25%	0.251	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	54.3	174.4	-167.2	22.5	0	0	0	113.3	R249 Q252 D267	D247-R249 VanDerWaalsContact CG-NH2 3.34Å; D247-R249 PolarHBondContact O-N 2.88Å; D247-R249 VanDerWaalsContact O-N 3.12Å; D247-R249 IonicContact OD1-CZ 3.71Å; D247-R249 VanDerWaalsContact OD1-CZ 3.22Å; D247-R249 IonicContact OD1-NE 3.25Å; D247-R249 PolarHBondContact OD1-NE 2.88Å; D247-R249 IonicContact OD1-NH2 2.78Å; D247-R249 PolarHBondContact OD1-NH2 2.97Å; D247-R249 VanDerWaalsContact OD1-NH2 3.09Å; D247-R249 IonicContact OD2-CZ 3.11Å; D247-R249 IonicContact OD2-NE 3.6Å; D247-R249 IonicContact OD2-NH2 3.76Å; D247-R249 PolarHBondContact OD2-NH2 3.49Å; D247-Q252 WeakPolarHBondContact O-CG 3.27Å; D247-Q252 PolarHBondContact OD2-NE2 3.34Å; D247-D267 HydrophobicContact CB-CB 4.47Å
248	F	93.8	Very high	93.4	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.031	24%	0.237	C	C	.	.			trans	-76.2	102.8	173.1	-167.9	-68.2	0	0	0	110	L245 N246 F253 K315 T316 H319 F320	L245-F248 HydrophobicContact CB-CB 4.04Å; L245-F248 HydrophobicContact CB-CD2 3.99Å; L245-F248 HydrophobicContact CD1-CD2 3.52Å; L245-F248 HydrophobicContact CD1-CE2 3.96Å; L245-F248 HydrophobicContact CG-CD2 4.34Å; N246-F248 PolarHBondContact O-N 3.23Å; F248-F253 HydrophobicContact CD1-CE2 4.4Å; F248-F253 HydrophobicContact CD2-CZ 4.42Å; F248-F253 HydrophobicContact CE1-CE2 4.09Å; F248-F253 HydrophobicContact CE1-CZ 4.43Å; F248-F253 HydrophobicContact CE2-CE2 4.2Å; F248-F253 AromaticContact CE2-CZ 3.84Å; F248-F253 HydrophobicContact CE2-CZ 3.84Å; F248-F253 AromaticContact CZ-CE2 3.96Å; F248-F253 HydrophobicContact CZ-CE2 3.96Å; F248-F253 AromaticContact CZ-CZ 3.84Å; F248-F253 HydrophobicContact CZ-CZ 3.84Å; F248-K315 HydrophobicContact CB-CB 3.75Å; F248-K315 HydrophobicContact CB-CD 3.44Å; F248-K315 VanDerWaalsContact CB-CD 3.44Å; F248-K315 HydrophobicContact CB-CG 4.17Å; F248-K315 HydrophobicContact CD1-CB 3.61Å; F248-K315 HydrophobicContact CD2-CB 4.44Å; F248-K315 HydrophobicContact CE1-CB 4.31Å; F248-K315 HydrophobicContact CG-CB 3.71Å; F248-K315 HydrophobicContact CG-CD 4.31Å; F248-T316 VanDerWaalsContact CZ-OG1 3.24Å; F248-T316 WeakPolarHBondContact CZ-OG1 3.43Å; F248-H319 HydrophobicContact CE1-CB 4.47Å; F248-H319 PolarHBondContact O-CD2 3.49Å; F248-H319 PolarHBondContact O-NE2 3.35Å; F248-F320 AromaticContact CE1-CD2 3.72Å; F248-F320 HydrophobicContact CE1-CD2 3.72Å; F248-F320 AromaticContact CE1-CE2 3.47Å; F248-F320 HydrophobicContact CE1-CE2 3.47Å; F248-F320 VanDerWaalsContact CE1-CE2 3.47Å; F248-F320 HydrophobicContact CZ-CD2 4.06Å; F248-F320 AromaticContact CZ-CE2 3.86Å; F248-F320 HydrophobicContact CZ-CE2 3.86Å
249	R	91.7	Very high	93.6	Very high	112 Å²	112	42.7 Å²	42.7	42%	0.423	24%	0.239	S	C	.	.			trans	-139.9	159.1	172.2	-67.6	-177.4	-70	168.7	-1.3	110.7	D247 Q251 Q252 F253	D247-R249 VanDerWaalsContact CG-NH2 3.34Å; D247-R249 PolarHBondContact O-N 2.88Å; D247-R249 VanDerWaalsContact O-N 3.12Å; D247-R249 IonicContact OD1-CZ 3.71Å; D247-R249 VanDerWaalsContact OD1-CZ 3.22Å; D247-R249 IonicContact OD1-NE 3.25Å; D247-R249 PolarHBondContact OD1-NE 2.88Å; D247-R249 IonicContact OD1-NH2 2.78Å; D247-R249 PolarHBondContact OD1-NH2 2.97Å; D247-R249 VanDerWaalsContact OD1-NH2 3.09Å; D247-R249 IonicContact OD2-CZ 3.11Å; D247-R249 IonicContact OD2-NE 3.6Å; D247-R249 IonicContact OD2-NH2 3.76Å; D247-R249 PolarHBondContact OD2-NH2 3.49Å; R249-Q251 PolarHBondContact O-N 2.92Å; R249-Q252 WeakPolarHBondContact O-CB 3.37Å; R249-Q252 PolarHBondContact O-N 2.92Å; R249-F253 WeakPolarHBondContact O-CD2 3.31Å
250	A	91.6	Very high	93.9	Very high	21 Å²	21	37.7 Å²	37.7	17%	0.174	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-50.5	-40.6	178	0	0	0	0	0	113.3	M208 Q252 F253	M208-A250 VanDerWaalsContact CE-C 3.41Å; M208-A250 HydrophobicContact CE-CB 3.3Å; M208-A250 WeakPolarHBondContact CE-O 3.31Å; A250-Q252 PolarHBondContact O-N 2.83Å; A250-Q252 VanDerWaalsContact O-N 3.15Å; A250-F253 PolarHBondContact O-N 3.07Å; A250-F253 VanDerWaalsContact O-N 3.1Å
251	Q	91.4	Very high	94.4	Very high	140 Å²	140	38.4 Å²	38.4	65%	0.654	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-65.3	-17.9	-178.3	-63.7	82.6	-3.7	0	0	113.9	R249 F253	R249-Q251 PolarHBondContact O-N 2.92Å; Q251-F253 PolarHBondContact O-N 2.9Å
252	Q	93.2	Very high	94.7	Very high	27 Å²	27	37.6 Å²	37.6	13%	0.126	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-84.8	6.3	177.4	-54.9	-61.1	10.3	0	0	113	D247 R249 A250 L262 V263 D264	D247-Q252 WeakPolarHBondContact O-CG 3.27Å; D247-Q252 PolarHBondContact OD2-NE2 3.34Å; R249-Q252 WeakPolarHBondContact O-CB 3.37Å; R249-Q252 PolarHBondContact O-N 2.92Å; A250-Q252 PolarHBondContact O-N 2.83Å; A250-Q252 VanDerWaalsContact O-N 3.15Å; Q252-L262 HydrophobicContact CB-CD1 3.9Å; Q252-L262 WeakPolarHBondContact O-CA 2.94Å; Q252-L262 VanDerWaalsContact O-CD1 3.27Å; Q252-L262 WeakPolarHBondContact O-CD1 3.33Å; Q252-V263 VanDerWaalsContact O-CG2 3.29Å; Q252-V263 WeakPolarHBondContact O-CG2 3.29Å; Q252-V263 PolarHBondContact O-N 3.42Å; Q252-D264 HydrophobicContact CB-CB 4.42Å; Q252-D264 HydrophobicContact CG-CB 4.43Å; Q252-D264 PolarHBondContact NE2-OD2 3.29Å; Q252-D264 PolarHBondContact OE1-OD2 2.88Å
253	F	95.3	Very high	94.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.4	176.3	-67.6	-94.7	0	0	0	111.5	M208 L228 L231 F248 R249 A250 Q251 F260 K261 L262 F320	M208-F253 HydrophobicContact CE-CB 4.35Å; M208-F253 HydrophobicContact CG-CB 4.32Å; M208-F253 WeakPolarHBondContact CG-O 3.42Å; M208-F253 HydrophobicContact SD-CB 4.07Å; L228-F253 HydrophobicContact CD2-CD1 4.24Å; L228-F253 HydrophobicContact CD2-CE1 3.82Å; L228-F253 HydrophobicContact CD2-CZ 4.17Å; L231-F253 HydrophobicContact CD2-CE1 3.72Å; L231-F253 HydrophobicContact CD2-CZ 4.11Å; F248-F253 HydrophobicContact CD1-CE2 4.4Å; F248-F253 HydrophobicContact CD2-CZ 4.42Å; F248-F253 HydrophobicContact CE1-CE2 4.09Å; F248-F253 HydrophobicContact CE1-CZ 4.43Å; F248-F253 HydrophobicContact CE2-CE2 4.2Å; F248-F253 AromaticContact CE2-CZ 3.84Å; F248-F253 HydrophobicContact CE2-CZ 3.84Å; F248-F253 AromaticContact CZ-CE2 3.96Å; F248-F253 HydrophobicContact CZ-CE2 3.96Å; F248-F253 AromaticContact CZ-CZ 3.84Å; F248-F253 HydrophobicContact CZ-CZ 3.84Å; R249-F253 WeakPolarHBondContact O-CD2 3.31Å; A250-F253 PolarHBondContact O-N 3.07Å; A250-F253 VanDerWaalsContact O-N 3.1Å; Q251-F253 PolarHBondContact O-N 2.9Å; F253-F260 HydrophobicContact CB-CD1 4.34Å; F253-F260 HydrophobicContact CD1-CB 4.04Å; F253-K261 WeakPolarHBondContact CA-O 3.35Å; F253-L262 HydrophobicContact CD1-CB 4.14Å; F253-L262 HydrophobicContact CD2-CD1 4.46Å; F253-L262 HydrophobicContact CE1-CB 3.78Å; F253-L262 HydrophobicContact CE1-CD1 4.2Å; F253-L262 HydrophobicContact CE1-CG 4.47Å; F253-L262 HydrophobicContact CE2-CD1 4.06Å; F253-L262 HydrophobicContact CZ-CB 4.3Å; F253-L262 HydrophobicContact CZ-CD1 3.94Å; F253-F320 HydrophobicContact CB-CZ 4.43Å; F253-F320 AromaticContact CD2-CE2 3.97Å; F253-F320 HydrophobicContact CD2-CE2 3.97Å; F253-F320 AromaticContact CD2-CZ 3.65Å; F253-F320 HydrophobicContact CD2-CZ 3.65Å; F253-F320 AromaticContact CE2-CE2 3.87Å; F253-F320 HydrophobicContact CE2-CE2 3.87Å; F253-F320 HydrophobicContact CE2-CZ 4.05Å; F253-F320 HydrophobicContact CG-CZ 4.04Å; F253-F320 HydrophobicContact CZ-CE2 4.44Å
254	V	96	Very high	94.3	Very high	15 Å²	15	38.8 Å²	38.8	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	160.5	166.8	-62.2	0	0	0	0	109.8	I178 E206 V256 F260 K261 V263	I178-V254 HydrophobicContact CD1-CG2 3.85Å; E206-V254 CarbonylContact O-C 3.49Å; E206-V254 VanDerWaalsContact O-CA 3.29Å; E206-V254 WeakPolarHBondContact O-CA 3.41Å; E206-V254 WeakPolarHBondContact O-CB 3.5Å; V254-V256 HydrophobicContact CG2-CG2 4.13Å; V254-F260 WeakPolarHBondContact O-CA 3.25Å; V254-K261 HydrophobicContact CG2-CB 4.24Å; V254-K261 PolarHBondContact N-O 2.81Å; V254-K261 PolarHBondContact O-N 2.8Å; V254-V263 HydrophobicContact CB-CG1 4.04Å; V254-V263 HydrophobicContact CG1-CG1 3.56Å; V254-V263 HydrophobicContact CG2-CG1 3.4Å; V254-V263 VanDerWaalsContact CG2-CG1 3.4Å
255	V	96.1	Very high	93.8	Very high	33 Å²	33	38.3 Å²	38.3	20%	0.2	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.7	172.9	-178.7	0	0	0	0	109.4	E206 L213 L224 E259 F260	E206-V255 PolarHBondContact N-O 3.36Å; E206-V255 PolarHBondContact O-N 2.82Å; L213-V255 HydrophobicContact CD2-CG2 4.49Å; L224-V255 HydrophobicContact CD2-CG1 4.16Å; L224-V255 HydrophobicContact CD2-CG2 4.15Å; V255-E259 WeakPolarHBondContact CA-O 3.45Å; V255-F260 HydrophobicContact CG2-CD1 3.8Å; V255-F260 HydrophobicContact CG2-CE1 3.55Å
256	V	96.3	Very high	93.3	Very high	14 Å²	14	39.1 Å²	39.1	9%	0.085	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	119.7	172.3	-177.7	0	0	0	0	107.8	I178 V254 G258 E259 K261	I178-V256 HydrophobicContact CD1-CG2 4.48Å; V254-V256 HydrophobicContact CG2-CG2 4.13Å; V256-G258 PolarHBondContact O-N 3.41Å; V256-G258 VanDerWaalsContact O-N 3.13Å; V256-E259 PolarHBondContact N-O 3.47Å; V256-E259 PolarHBondContact O-N 2.04Å; V256-K261 HydrophobicContact CB-CD 3.91Å; V256-K261 HydrophobicContact CB-CG 4.34Å; V256-K261 HydrophobicContact CG2-CD 3.89Å; V256-K261 HydrophobicContact CG2-CG 4.34Å
257	N	93.4	Very high	93.1	Very high	142 Å²	142	39 Å²	39	76%	0.759	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	34.8	179.8	-58.7	-35.7	0	0	0	114.3	K223	K223-N257 PolarHBondContact NZ-O 3.18Å
258	G	93.4	Very high	93.1	Very high	30 Å²	30	36.9 Å²	36.9	31%	0.309	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	17.8	180	0	0	0	0	0	114.8	K223 L224 V256	K223-G258 WeakPolarHBondContact CD-O 3.43Å; L224-G258 WeakPolarHBondContact CD2-O 3.35Å; V256-G258 PolarHBondContact O-N 3.41Å; V256-G258 VanDerWaalsContact O-N 3.13Å
259	E	96.3	Very high	93.1	Very high	41 Å²	41	36.9 Å²	36.9	19%	0.192	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.4	171.9	-62.9	-173.5	114.1	0	0	110	K223 R230 V255 V256	K223-E259 HydrophobicContact CD-CG 4.49Å; K223-E259 HydrophobicContact CG-CG 4.47Å; R230-E259 IonicContact NH1-OE1 2.94Å; V255-E259 WeakPolarHBondContact CA-O 3.45Å; V256-E259 PolarHBondContact N-O 3.47Å; V256-E259 PolarHBondContact O-N 2.04Å
260	F	97.1	Very high	93.2	Very high	1 Å²	1	31.8 Å²	31.8	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	138.2	170.9	-73.7	-50.8	0	0	0	110.8	S176 M208 L213 L224 S227 L228 F253 V254 V255 F320 L323	S176-F260 VanDerWaalsContact CA-O 3.31Å; S176-F260 WeakPolarHBondContact CA-O 3.49Å; S176-F260 WeakPolarHBondContact CB-O 3.5Å; M208-F260 HydrophobicContact CG-CD1 4.37Å; M208-F260 HydrophobicContact CG-CE1 3.89Å; M208-F260 HydrophobicContact SD-CD1 3.62Å; M208-F260 HydrophobicContact SD-CE1 2.98Å; M208-F260 WeakPolarHBondContact SD-CE1 3.43Å; M208-F260 HydrophobicContact SD-CE2 4.48Å; M208-F260 HydrophobicContact SD-CZ 3.47Å; M208-F260 WeakPolarHBondContact SD-CZ 3.48Å; L213-F260 HydrophobicContact CD1-CE1 4.48Å; L213-F260 HydrophobicContact CD1-CZ 4.09Å; L213-F260 HydrophobicContact CD2-CE1 4.26Å; L213-F260 HydrophobicContact CD2-CZ 4.08Å; L224-F260 HydrophobicContact CB-CD2 3.87Å; L224-F260 HydrophobicContact CB-CE2 3.56Å; L224-F260 HydrophobicContact CB-CZ 4.07Å; L224-F260 HydrophobicContact CD1-CE1 4.37Å; L224-F260 HydrophobicContact CD1-CE2 4.25Å; L224-F260 HydrophobicContact CD1-CZ 3.9Å; L224-F260 HydrophobicContact CD2-CD1 3.97Å; L224-F260 HydrophobicContact CD2-CD2 3.99Å; L224-F260 HydrophobicContact CD2-CE1 3.86Å; L224-F260 HydrophobicContact CD2-CE2 4.02Å; L224-F260 HydrophobicContact CD2-CG 4.01Å; L224-F260 HydrophobicContact CD2-CZ 3.95Å; L224-F260 HydrophobicContact CG-CD2 4.48Å; L224-F260 HydrophobicContact CG-CE2 4.16Å; L224-F260 HydrophobicContact CG-CZ 4.21Å; L224-F260 WeakPolarHBondContact O-CD2 3.45Å; S227-F260 PolarHBondContact OG-N 3.38Å; L228-F260 HydrophobicContact CD1-CD2 3.74Å; L228-F260 HydrophobicContact CD1-CE2 3.89Å; L228-F260 HydrophobicContact CD2-CB 4.13Å; L228-F260 HydrophobicContact CD2-CD2 3.89Å; L228-F260 HydrophobicContact CD2-CG 4.31Å; L228-F260 HydrophobicContact CG-CD2 3.65Å; L228-F260 HydrophobicContact CG-CE2 4.32Å; L228-F260 HydrophobicContact CG-CG 4.49Å; F253-F260 HydrophobicContact CB-CD1 4.34Å; F253-F260 HydrophobicContact CD1-CB 4.04Å; V254-F260 WeakPolarHBondContact O-CA 3.25Å; V255-F260 HydrophobicContact CG2-CD1 3.8Å; V255-F260 HydrophobicContact CG2-CE1 3.55Å; F260-F320 HydrophobicContact CE2-CD1 4.07Å; F260-F320 AromaticContact CE2-CE1 3.99Å; F260-F320 HydrophobicContact CE2-CE1 3.99Å; F260-F320 HydrophobicContact CZ-CD1 4.36Å; F260-F320 HydrophobicContact CZ-CE1 4.03Å; F260-L323 HydrophobicContact CE2-CD1 3.68Å; F260-L323 HydrophobicContact CZ-CD1 4.3Å
261	K	97.5	Very high	93.3	Very high	28 Å²	28	34.9 Å²	34.9	12%	0.122	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.8	171.3	-61.5	-164.3	177	-171.8	0	110.1	S175 S176 I178 E203 F253 V254 V256 V263	S175-K261 VanDerWaalsContact O-CE 3.31Å; S175-K261 WeakPolarHBondContact O-CE 3.34Å; S176-K261 WeakPolarHBondContact O-CA 3.35Å; I178-K261 HydrophobicContact CD1-CB 4.14Å; I178-K261 HydrophobicContact CD1-CD 4.3Å; E203-K261 WeakPolarHBondContact OE1-CD 3.47Å; E203-K261 WeakPolarHBondContact OE1-CE 2.98Å; E203-K261 IonicContact OE1-NZ 3.99Å; E203-K261 PolarHBondContact OE1-NZ 3.29Å; E203-K261 IonicContact OE2-NZ 3.33Å; E203-K261 PolarHBondContact OE2-NZ 2.9Å; F253-K261 WeakPolarHBondContact CA-O 3.35Å; V254-K261 HydrophobicContact CG2-CB 4.24Å; V254-K261 PolarHBondContact N-O 2.81Å; V254-K261 PolarHBondContact O-N 2.8Å; V256-K261 HydrophobicContact CB-CD 3.91Å; V256-K261 HydrophobicContact CB-CG 4.34Å; V256-K261 HydrophobicContact CG2-CD 3.89Å; V256-K261 HydrophobicContact CG2-CG 4.34Å; K261-V263 PolarHBondContact O-N 2.88Å
262	L	96.5	Very high	93.5	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	121.8	173.6	-179.9	56.2	0	0	0	109.2	S176 I177 I178 L231 L245 Q252 F253 D264 F265	S176-L262 PolarHBondContact O-N 3.07Å; I177-L262 HydrophobicContact CG1-CB 4.45Å; I178-L262 WeakPolarHBondContact CB-O 3.4Å; I178-L262 PolarHBondContact N-O 3.33Å; L231-L262 HydrophobicContact CD2-CB 4.3Å; L231-L262 HydrophobicContact CD2-CD2 4.33Å; L245-L262 HydrophobicContact CD1-CD2 3.47Å; L245-L262 VanDerWaalsContact CD1-CD2 3.47Å; L245-L262 HydrophobicContact CD2-CD2 3.85Å; L245-L262 HydrophobicContact CG-CD2 4.31Å; Q252-L262 HydrophobicContact CB-CD1 3.9Å; Q252-L262 WeakPolarHBondContact O-CA 2.94Å; Q252-L262 VanDerWaalsContact O-CD1 3.27Å; Q252-L262 WeakPolarHBondContact O-CD1 3.33Å; F253-L262 HydrophobicContact CD1-CB 4.14Å; F253-L262 HydrophobicContact CD2-CD1 4.46Å; F253-L262 HydrophobicContact CE1-CB 3.78Å; F253-L262 HydrophobicContact CE1-CD1 4.2Å; F253-L262 HydrophobicContact CE1-CG 4.47Å; F253-L262 HydrophobicContact CE2-CD1 4.06Å; F253-L262 HydrophobicContact CZ-CB 4.3Å; F253-L262 HydrophobicContact CZ-CD1 3.94Å; L262-D264 WeakPolarHBondContact CD1-O 3.38Å; L262-F265 HydrophobicContact CD2-CD2 3.38Å; L262-F265 HydrophobicContact CD2-CE2 3.49Å; L262-F265 VanDerWaalsContact CD2-CE2 3.49Å; L262-F265 HydrophobicContact CG-CD2 3.91Å; L262-F265 HydrophobicContact CG-CE2 4.46Å
263	V	94.3	Very high	93.6	Very high	23 Å²	23	29.3 Å²	29.3	14%	0.139	16%	0.163	C	C	.	.			trans	-96.6	-26.6	-176	-65.6	0	0	0	0	114.1	K128 I178 Q252 V254 K261	K128-V263 PolarHBondContact NZ-O 2.97Å; I178-V263 HydrophobicContact CB-CG1 4.22Å; I178-V263 HydrophobicContact CD1-CG1 4.01Å; I178-V263 HydrophobicContact CG1-CG1 4.12Å; Q252-V263 VanDerWaalsContact O-CG2 3.29Å; Q252-V263 WeakPolarHBondContact O-CG2 3.29Å; Q252-V263 PolarHBondContact O-N 3.42Å; V254-V263 HydrophobicContact CB-CG1 4.04Å; V254-V263 HydrophobicContact CG1-CG1 3.56Å; V254-V263 HydrophobicContact CG2-CG1 3.4Å; V254-V263 VanDerWaalsContact CG2-CG1 3.4Å; K261-V263 PolarHBondContact O-N 2.88Å
264	D	86.9	Confident	93.7	Very high	35 Å²	35	33.7 Å²	33.7	19%	0.187	20%	0.195	C	C	.	.			trans	-115	116.2	-176	-154.2	19.5	0	0	0	109	K113 Q252 L262	K113-D264 IonicContact NZ-OD1 3.92Å; K113-D264 PolarHBondContact NZ-OD1 3.07Å; Q252-D264 HydrophobicContact CB-CB 4.42Å; Q252-D264 HydrophobicContact CG-CB 4.43Å; Q252-D264 PolarHBondContact NE2-OD2 3.29Å; Q252-D264 PolarHBondContact OE1-OD2 2.88Å; L262-D264 WeakPolarHBondContact CD1-O 3.38Å
265	F	87.1	Confident	93.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.194	C	C	.	.			trans	-131.4	24.6	-171.6	-143.5	-95.1	0	0	0	111.1	A168 L169 F172 I177 L235 I243 L245 L262 I268	A168-F265 HydrophobicContact CB-CD1 3.55Å; A168-F265 HydrophobicContact CB-CE1 4.24Å; A168-F265 WeakPolarHBondContact CB-O 3.45Å; L169-F265 HydrophobicContact CD2-CB 3.96Å; L169-F265 HydrophobicContact CG-CB 4.43Å; F172-F265 HydrophobicContact CB-CE1 3.75Å; F172-F265 HydrophobicContact CB-CZ 4.01Å; F172-F265 AromaticContact CD2-CD1 3.99Å; F172-F265 HydrophobicContact CD2-CD1 3.99Å; F172-F265 AromaticContact CD2-CE1 3.33Å; F172-F265 HydrophobicContact CD2-CE1 3.33Å; F172-F265 HydrophobicContact CD2-CZ 4.29Å; F172-F265 HydrophobicContact CE2-CE1 4.12Å; F172-F265 AromaticContact CG-CE1 3.73Å; F172-F265 HydrophobicContact CG-CE1 3.73Å; F172-F265 HydrophobicContact CG-CZ 4.29Å; I177-F265 HydrophobicContact CD1-CD2 4.36Å; I177-F265 HydrophobicContact CD1-CE2 3.68Å; I177-F265 HydrophobicContact CD1-CZ 3.98Å; I177-F265 HydrophobicContact CG1-CE2 4.29Å; L235-F265 HydrophobicContact CD2-CE2 4.26Å; L235-F265 HydrophobicContact CD2-CZ 3.96Å; I243-F265 HydrophobicContact CG2-CZ 4.4Å; L245-F265 HydrophobicContact CD2-CD2 4.24Å; L245-F265 HydrophobicContact CD2-CE2 3.7Å; L245-F265 HydrophobicContact CD2-CZ 4.16Å; L262-F265 HydrophobicContact CD2-CD2 3.38Å; L262-F265 HydrophobicContact CD2-CE2 3.49Å; L262-F265 VanDerWaalsContact CD2-CE2 3.49Å; L262-F265 HydrophobicContact CG-CD2 3.91Å; L262-F265 HydrophobicContact CG-CE2 4.46Å; F265-I268 HydrophobicContact CD1-CD1 3.67Å; F265-I268 HydrophobicContact CD1-CG2 3.72Å; F265-I268 HydrophobicContact CD2-CG2 4.29Å; F265-I268 HydrophobicContact CE1-CD1 3.34Å; F265-I268 HydrophobicContact CE1-CG1 4.46Å; F265-I268 HydrophobicContact CE1-CG2 3.74Å; F265-I268 HydrophobicContact CE2-CG2 4.31Å; F265-I268 HydrophobicContact CG-CG2 4Å; F265-I268 HydrophobicContact CZ-CD1 4.31Å; F265-I268 HydrophobicContact CZ-CG2 4.05Å
266	D	85	Confident	93.9	Very high	24 Å²	24	41.1 Å²	41.1	13%	0.128	23%	0.227	C	C	.	.	S	Bend	trans	-86.7	-28.1	178.5	62.2	-1	0	0	0	113.4	K113 K164 E165	K113-D266 IonicContact NZ-OD2 3.82Å; K113-D266 PolarHBondContact NZ-OD2 2.81Å; K164-D266 WeakPolarHBondContact CD-O 3.41Å; K164-D266 WeakPolarHBondContact CE-O 3.4Å; K164-D266 PolarHBondContact NZ-O 3.13Å; E165-D266 HydrophobicContact CB-CB 4.09Å
267	D	89.6	Confident	94	Very high	74 Å²	74	43 Å²	43	40%	0.396	24%	0.241	S	C	.	.	S	Bend	trans	-104.4	64.8	178.6	-163.3	8.7	0	0	0	112.9	N246 D247	N246-D267 HydrophobicContact CB-CB 4.43Å; N246-D267 VanDerWaalsContact CB-CG 3.5Å; N246-D267 WeakPolarHBondContact CB-O 3.38Å; N246-D267 WeakPolarHBondContact CB-OD1 3.4Å; N246-D267 WeakPolarHBondContact CB-OD2 3.36Å; N246-D267 PolarHBondContact N-O 3.03Å; N246-D267 PolarHBondContact ND2-OD1 2.81Å; D247-D267 HydrophobicContact CB-CB 4.47Å
268	I	93.1	Very high	94.1	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	153.4	174.1	73.2	178.8	0	0	0	111.7	T58 L61 K164 A168 F172 I243 V244 L245 F265 L270	T58-I268 VanDerWaalsContact CG2-O 3.31Å; T58-I268 WeakPolarHBondContact CG2-O 3.38Å; L61-I268 HydrophobicContact CD1-CD1 3.66Å; L61-I268 HydrophobicContact CD1-CG1 3.84Å; K164-I268 PolarHBondContact NZ-O 3.2Å; A168-I268 HydrophobicContact CB-CD1 3.97Å; F172-I268 HydrophobicContact CD2-CD1 3.94Å; F172-I268 HydrophobicContact CE2-CD1 3.5Å; F172-I268 VanDerWaalsContact CE2-CD1 3.5Å; F172-I268 HydrophobicContact CZ-CD1 4.2Å; I243-I268 HydrophobicContact CG2-CB 4.09Å; I243-I268 HydrophobicContact CG2-CD1 4.38Å; V244-I268 WeakPolarHBondContact O-CA 3.45Å; L245-I268 HydrophobicContact CD2-CG2 3.66Å; F265-I268 HydrophobicContact CD1-CD1 3.67Å; F265-I268 HydrophobicContact CD1-CG2 3.72Å; F265-I268 HydrophobicContact CD2-CG2 4.29Å; F265-I268 HydrophobicContact CE1-CD1 3.34Å; F265-I268 HydrophobicContact CE1-CG1 4.46Å; F265-I268 HydrophobicContact CE1-CG2 3.74Å; F265-I268 HydrophobicContact CE2-CG2 4.31Å; F265-I268 HydrophobicContact CG-CG2 4Å; F265-I268 HydrophobicContact CZ-CD1 4.31Å; F265-I268 HydrophobicContact CZ-CG2 4.05Å; I268-L270 HydrophobicContact CD1-CD2 4.26Å
269	G	94	Very high	94.2	Very high	7 Å²	7	41.4 Å²	41.4	7%	0.072	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.1	167.7	0	0	0	0	0	111.6	T58 I243 V244	T58-G269 VanDerWaalsContact OG1-CA 3.31Å; T58-G269 WeakPolarHBondContact OG1-CA 3.16Å; I243-G269 CarbonylContact C-O 3.5Å; I243-G269 VanDerWaalsContact CA-O 3.3Å; I243-G269 WeakPolarHBondContact CA-O 3.32Å; V244-G269 PolarHBondContact N-O 3.29Å; V244-G269 PolarHBondContact O-N 2.96Å
270	L	93.4	Very high	94.3	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.031	24%	0.238	C	C	.	.			trans	-106	-17.7	179	-56.2	-174	0	0	0	113.2	M56 T57 T58 L61 F172 I243 I268	M56-L270 HydrophobicContact CB-CD1 4.34Å; M56-L270 HydrophobicContact CE-CD1 3.66Å; M56-L270 HydrophobicContact CG-CD1 3.97Å; T57-L270 WeakPolarHBondContact O-CD1 3.49Å; T58-L270 PolarHBondContact OG1-N 3.47Å; L61-L270 HydrophobicContact CD1-CD1 4.01Å; L61-L270 HydrophobicContact CD1-CD2 4.47Å; L61-L270 HydrophobicContact CD1-CG 4.21Å; L61-L270 HydrophobicContact CD2-CD1 4.4Å; L61-L270 HydrophobicContact CG-CD1 4.15Å; F172-L270 HydrophobicContact CE1-CD2 4.18Å; F172-L270 HydrophobicContact CE2-CD2 4.46Å; F172-L270 HydrophobicContact CZ-CD1 4.28Å; F172-L270 HydrophobicContact CZ-CD2 3.67Å; I243-L270 HydrophobicContact CD1-CD2 4.33Å; I243-L270 HydrophobicContact CG1-CD2 3.83Å; I243-L270 HydrophobicContact CG2-CD2 4.3Å; I268-L270 HydrophobicContact CD1-CD2 4.26Å
271	E	92.6	Very high	94.3	Very high	86 Å²	86	42.3 Å²	42.3	40%	0.402	24%	0.238	S	C	.	.	S	Bend	trans	-96.9	142.5	-178	-55.4	88.2	161.7	0	0	111.2	T57 T58 N308	T57-E271 WeakPolarHBondContact CA-OE1 3.03Å; T57-E271 WeakPolarHBondContact CB-OE1 3.05Å; T58-E271 VanDerWaalsContact CB-OE2 3.31Å; T58-E271 WeakPolarHBondContact CB-OE2 3.29Å; T58-E271 PolarHBondContact N-OE1 3.43Å; T58-E271 PolarHBondContact N-OE2 2.86Å; T58-E271 PolarHBondContact OG1-OE2 2.85Å; E271-N308 PolarHBondContact O-ND2 2.91Å
272	E	95.9	Very high	94.2	Very high	21 Å²	21	44.6 Å²	44.6	10%	0.098	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-73.1	150.3	163.6	-65.8	-78	-155.1	0	0	109.5	P242 G306 F307 N308	P242-E272 HydrophobicContact CG-CG 4.48Å; E272-G306 PolarHBondContact OE1-N 3.17Å; E272-F307 PolarHBondContact OE1-N 2.95Å; E272-F307 WeakPolarHBondContact OE2-CB 3.41Å; E272-F307 PolarHBondContact OE2-N 3.02Å; E272-N308 WeakPolarHBondContact OE2-CB 3.42Å; E272-N308 PolarHBondContact OE2-N 3.12Å; E272-N308 PolarHBondContact OE2-OD1 2.82Å
273	P	96.6	Very high	94.2	Very high	28 Å²	28	45.6 Å²	45.6	18%	0.182	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-57.9	141.2	175	-22.9	32.5	0	0	0	112.3	S303 C304 F307	P273-S303 WeakPolarHBondContact O-CA 3.48Å; P273-C304 HydrophobicContact CB-CB 4.4Å; P273-C304 PolarHBondContact O-N 3.1Å; P273-F307 VanDerWaalsContact CD-CD1 3.44Å; P273-F307 HydrophobicContact CG-CB 4.26Å; P273-F307 HydrophobicContact CG-CD1 3.29Å; P273-F307 HydrophobicContact CG-CD2 4.3Å; P273-F307 HydrophobicContact CG-CE1 3.58Å; P273-F307 HydrophobicContact CG-CG 3.69Å; P273-F307 HydrophobicContact CG-CZ 4.2Å
274	S	97.1	Very high	94.3	Very high	95 Å²	95	46.6 Å²	46.6	66%	0.664	27%	0.266	S	S	*	.	B	Isolated β-bridge	trans	-70.2	149.8	174.6	-51.5	0	0	0	0	112	H284 G302	S274-H284 PolarHBondContact O-NE2 3.14Å; S274-H284 VanDerWaalsContact O-NE2 3.15Å; S274-G302 CarbonylContact C-O 3.47Å; S274-G302 VanDerWaalsContact CA-O 3.24Å; S274-G302 WeakPolarHBondContact CA-O 3.37Å
275	C	97.9	Very high	94.7	Very high	11 Å²	11	45.4 Å²	45.4	7%	0.074	26%	0.259	C	S	.	.			trans	-144.4	152.7	175.8	60.5	0	0	0	0	111.7	D280 C299 G302 S303	C275-D280 HydrophobicContact CB-CB 3.8Å; C275-C299 HydrophobicContact CB-CB 3.87Å; C275-C299 WeakPolarHBondContact CB-SG 3.31Å; C275-C299 WeakPolarHBondContact SG-CA 3.16Å; C275-C299 WeakPolarHBondContact SG-CB 3.37Å; C275-C299 CovalentContact SG-SG 2.03Å; C275-C299 PolarHBondContact SG-SG 3.23Å; C275-G302 PolarHBondContact N-O 2.68Å; C275-G302 CarbonylContact O-C 3.51Å; C275-G302 WeakPolarHBondContact O-CA 3.47Å; C275-S303 PolarHBondContact SG-N 2.83Å; C275-S303 VanDerWaalsContact SG-N 3.36Å
276	Q	98.1	Very high	95.1	Very high	192 Å²	192	49.8 Å²	49.8	90%	0.897	29%	0.286	S	S	*	.	S	Bend	trans	-105.9	-29.1	165.7	-61.4	-179.3	5.8	0	0	110.6	D280	Q276-D280 WeakPolarHBondContact CA-OD2 3.21Å; Q276-D280 PolarHBondContact N-OD2 3.48Å
277	S	97.4	Very high	95.6	Very high	54 Å²	54	57.6 Å²	57.6	38%	0.378	31%	0.314	S	S	.	.	S	Bend	trans	-142.5	171	179	72.2	0	0	0	0	111.3	A279 D280	S277-A279 PolarHBondContact O-N 3.24Å; S277-A279 PolarHBondContact OG-N 3.42Å; S277-D280 PolarHBondContact N-OD2 3.5Å; S277-D280 WeakPolarHBondContact O-CB 3.4Å; S277-D280 PolarHBondContact O-N 2.69Å; S277-D280 PolarHBondContact OG-OD2 2.94Å
278	Q	96.3	Very high	95.8	Very high	74 Å²	74	56.9 Å²	56.9	35%	0.346	31%	0.31	S	S	.	.	H	α-helix	trans	-59.5	-33.9	175.2	-174.9	57	43.1	0	0	112.7	D280 C281 D282 V297 C299	Q278-D280 PolarHBondContact O-N 3.09Å; Q278-C281 WeakPolarHBondContact O-CB 3.45Å; Q278-C281 PolarHBondContact O-N 3.44Å; Q278-D282 PolarHBondContact NE2-OD1 3.31Å; Q278-D282 PolarHBondContact O-N 3.06Å; Q278-V297 PolarHBondContact NE2-O 2.85Å; Q278-C299 VanDerWaalsContact OE1-N 3.1Å
279	A	96.1	Very high	95.7	Very high	65 Å²	65	59 Å²	59	54%	0.537	33%	0.332	S	S	.	.	H	α-helix	trans	-61.5	-27.6	-179.9	0	0	0	0	0	113	S277 G283	S277-A279 PolarHBondContact O-N 3.24Å; S277-A279 PolarHBondContact OG-N 3.42Å; A279-G283 PolarHBondContact O-N 3.17Å
280	D	97.7	Very high	95.6	Very high	60 Å²	60	58.9 Å²	58.9	32%	0.321	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-42.9	174.8	-60.3	-49.9	0	0	0	111	C275 Q276 S277 Q278 G283 H284	C275-D280 HydrophobicContact CB-CB 3.8Å; Q276-D280 WeakPolarHBondContact CA-OD2 3.21Å; Q276-D280 PolarHBondContact N-OD2 3.48Å; S277-D280 PolarHBondContact N-OD2 3.5Å; S277-D280 WeakPolarHBondContact O-CB 3.4Å; S277-D280 PolarHBondContact O-N 2.69Å; S277-D280 PolarHBondContact OG-OD2 2.94Å; Q278-D280 PolarHBondContact O-N 3.09Å; D280-G283 PolarHBondContact O-N 3.13Å; D280-H284 PolarHBondContact O-CD2 2.91Å; D280-H284 PolarHBondContact O-N 3.34Å
281	C	97.2	Very high	95.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-66.8	-42.7	177.3	-58.2	0	0	0	0	111.8	Q278 G283 H284 L285 V297 C304	Q278-C281 WeakPolarHBondContact O-CB 3.45Å; Q278-C281 PolarHBondContact O-N 3.44Å; C281-G283 VanDerWaalsContact C-N 3.27Å; C281-G283 PolarHBondContact O-N 2.72Å; C281-H284 PolarHBondContact O-N 2.86Å; C281-L285 WeakPolarHBondContact O-CG 3.13Å; C281-L285 PolarHBondContact O-N 2.94Å; C281-V297 HydrophobicContact CB-CG1 4.13Å; C281-C304 WeakPolarHBondContact CA-SG 3.45Å; C281-C304 HydrophobicContact CB-CB 3.84Å; C281-C304 WeakPolarHBondContact CB-SG 3.36Å; C281-C304 WeakPolarHBondContact SG-CA 3.21Å; C281-C304 WeakPolarHBondContact SG-CB 3.47Å; C281-C304 CovalentContact SG-SG 2.04Å; C281-C304 PolarHBondContact SG-SG 3.49Å
282	D	95.4	Very high	94.9	Very high	76 Å²	76	63.3 Å²	63.3	41%	0.406	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-37.8	175.3	-56.8	-18.2	0	0	0	111	Q278 L285 T286	Q278-D282 PolarHBondContact NE2-OD1 3.31Å; Q278-D282 PolarHBondContact O-N 3.06Å; D282-L285 PolarHBondContact O-N 2.83Å; D282-T286 WeakPolarHBondContact O-CB 3.26Å; D282-T286 PolarHBondContact O-N 2.87Å; D282-T286 PolarHBondContact O-OG1 3.43Å
283	G	96.7	Very high	94.4	Very high	24 Å²	24	63.4 Å²	63.4	25%	0.247	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-45.4	172.4	0	0	0	0	0	112.7	A279 D280 C281 T286 R287	A279-G283 PolarHBondContact O-N 3.17Å; D280-G283 PolarHBondContact O-N 3.13Å; C281-G283 VanDerWaalsContact C-N 3.27Å; C281-G283 PolarHBondContact O-N 2.72Å; G283-T286 PolarHBondContact O-N 3.3Å; G283-R287 WeakPolarHBondContact O-CG 3.49Å; G283-R287 PolarHBondContact O-N 3.2Å
284	H	96.1	Very high	94	Very high	44 Å²	44	66.5 Å²	66.5	20%	0.204	39%	0.39	C	S	.	.	H	α-helix	trans	-60.2	-45.2	174.5	-69.2	-56.1	0	0	0	111.7	S274 D280 C281 T286 R287 I288 F307	S274-H284 PolarHBondContact O-NE2 3.14Å; S274-H284 VanDerWaalsContact O-NE2 3.15Å; D280-H284 PolarHBondContact O-CD2 2.91Å; D280-H284 PolarHBondContact O-N 3.34Å; C281-H284 PolarHBondContact O-N 2.86Å; H284-T286 VanDerWaalsContact C-N 3.32Å; H284-T286 PolarHBondContact O-N 2.95Å; H284-R287 PolarHBondContact CE1-NH1 3.26Å; H284-R287 PolarHBondContact ND1-NH1 3.09Å; H284-R287 PolarHBondContact O-N 2.85Å; H284-I288 PolarHBondContact O-N 2.85Å; H284-F307 HydrophobicContact CB-CD2 4.1Å; H284-F307 HydrophobicContact CB-CE2 3.58Å; H284-F307 HydrophobicContact CB-CZ 4.15Å
285	L	96.1	Very high	93.5	Very high	10 Å²	10	63 Å²	63	5%	0.052	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-41.6	176.3	-72.4	172.8	0	0	0	112	C281 D282 I288 G289 I290 G291 V297 F307 A310	C281-L285 WeakPolarHBondContact O-CG 3.13Å; C281-L285 PolarHBondContact O-N 2.94Å; D282-L285 PolarHBondContact O-N 2.83Å; L285-I288 WeakPolarHBondContact O-CG1 3.33Å; L285-I288 PolarHBondContact O-N 3.5Å; L285-G289 PolarHBondContact O-N 3.28Å; L285-I290 HydrophobicContact CB-CG1 4.33Å; L285-I290 HydrophobicContact CD2-CD1 3.48Å; L285-I290 VanDerWaalsContact CD2-CD1 3.48Å; L285-I290 HydrophobicContact CD2-CG1 3.73Å; L285-I290 CarbonylContact O-C 3.53Å; L285-I290 PolarHBondContact O-N 2.83Å; L285-G291 PolarHBondContact O-N 2.9Å; L285-V297 HydrophobicContact CD1-CB 4.08Å; L285-V297 HydrophobicContact CD1-CG2 4.12Å; L285-V297 HydrophobicContact CD2-CG2 4.15Å; L285-F307 HydrophobicContact CD2-CD2 3.83Å; L285-F307 HydrophobicContact CD2-CE2 4.03Å; L285-F307 HydrophobicContact CG-CD2 4.19Å; L285-F307 HydrophobicContact CG-CE2 4.36Å; L285-A310 HydrophobicContact CD2-CB 4.38Å
286	T	95.8	Very high	92.9	Very high	92 Å²	92	65.8 Å²	65.8	56%	0.564	38%	0.383	S	S	*	.	H	α-helix	trans	-63.4	-41.9	177.3	-59.2	0	0	0	0	111.6	D282 G283 H284 I288 G289	D282-T286 WeakPolarHBondContact O-CB 3.26Å; D282-T286 PolarHBondContact O-N 2.87Å; D282-T286 PolarHBondContact O-OG1 3.43Å; G283-T286 PolarHBondContact O-N 3.3Å; H284-T286 VanDerWaalsContact C-N 3.32Å; H284-T286 PolarHBondContact O-N 2.95Å; T286-I288 VanDerWaalsContact C-N 3.28Å; T286-I288 PolarHBondContact O-N 2.9Å; T286-G289 PolarHBondContact O-N 3.44Å
287	R	95.5	Very high	92.7	Very high	188 Å²	188	57 Å²	57	71%	0.709	34%	0.343	S	S	*	.	H	α-helix	trans	-60.4	-34.7	178.9	-73.6	173.5	-172.2	134.2	3.1	113.3	G283 H284 G289	G283-R287 WeakPolarHBondContact O-CG 3.49Å; G283-R287 PolarHBondContact O-N 3.2Å; H284-R287 PolarHBondContact CE1-NH1 3.26Å; H284-R287 PolarHBondContact ND1-NH1 3.09Å; H284-R287 PolarHBondContact O-N 2.85Å; R287-G289 VanDerWaalsContact C-N 3.34Å
288	I	92.2	Very high	92.7	Very high	60 Å²	60	61.8 Å²	61.8	31%	0.308	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.9	176.9	60.1	157.4	0	0	0	113.3	H284 L285 T286 I290 F307 A311 Y314	H284-I288 PolarHBondContact O-N 2.85Å; L285-I288 WeakPolarHBondContact O-CG1 3.33Å; L285-I288 PolarHBondContact O-N 3.5Å; T286-I288 VanDerWaalsContact C-N 3.28Å; T286-I288 PolarHBondContact O-N 2.9Å; I288-I290 HydrophobicContact CD1-CD1 3.58Å; I288-I290 HydrophobicContact CD1-CG1 3.58Å; I288-I290 HydrophobicContact CG1-CD1 4.3Å; I288-I290 HydrophobicContact CG1-CG1 3.72Å; I288-F307 HydrophobicContact CD1-CE1 4.47Å; I288-F307 HydrophobicContact CD1-CE2 3.8Å; I288-F307 HydrophobicContact CD1-CZ 3.63Å; I288-F307 HydrophobicContact CG1-CE2 4.19Å; I288-F307 HydrophobicContact CG1-CZ 4.11Å; I288-F307 HydrophobicContact CG2-CZ 4.29Å; I288-A311 HydrophobicContact CD1-CB 3.93Å; I288-Y314 WeakPolarHBondContact O-CE1 3.43Å
289	G	91.8	Very high	92.7	Very high	47 Å²	47	60 Å²	60	49%	0.485	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	20.4	173.6	0	0	0	0	0	115.5	L285 T286 R287	L285-G289 PolarHBondContact O-N 3.28Å; T286-G289 PolarHBondContact O-N 3.44Å; R287-G289 VanDerWaalsContact C-N 3.34Å
290	I	91.2	Very high	92.8	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.015	34%	0.34	C	S	.	.			trans	-126.3	33.3	177.9	58.3	164.1	0	0	0	113.2	L285 I288 N292 A293 A310 Y314 L346	L285-I290 HydrophobicContact CB-CG1 4.33Å; L285-I290 HydrophobicContact CD2-CD1 3.48Å; L285-I290 VanDerWaalsContact CD2-CD1 3.48Å; L285-I290 HydrophobicContact CD2-CG1 3.73Å; L285-I290 CarbonylContact O-C 3.53Å; L285-I290 PolarHBondContact O-N 2.83Å; I288-I290 HydrophobicContact CD1-CD1 3.58Å; I288-I290 HydrophobicContact CD1-CG1 3.58Å; I288-I290 HydrophobicContact CG1-CD1 4.3Å; I288-I290 HydrophobicContact CG1-CG1 3.72Å; I290-N292 PolarHBondContact O-N 3.48Å; I290-N292 VanDerWaalsContact O-N 3.11Å; I290-A293 HydrophobicContact CB-CB 4.33Å; I290-A293 VanDerWaalsContact O-CB 3.24Å; I290-A293 WeakPolarHBondContact O-CB 3.24Å; I290-A293 PolarHBondContact O-N 2.88Å; I290-A310 HydrophobicContact CD1-CB 3.86Å; I290-Y314 HydrophobicContact CG2-CD1 4.01Å; I290-Y314 HydrophobicContact CG2-CD2 3.11Å; I290-Y314 HydrophobicContact CG2-CE1 4.35Å; I290-Y314 HydrophobicContact CG2-CE2 3.51Å; I290-Y314 HydrophobicContact CG2-CG 3.38Å; I290-L346 HydrophobicContact CB-CD1 4.45Å; I290-L346 HydrophobicContact CD1-CD2 3.98Å; I290-L346 HydrophobicContact CG2-CD1 3.99Å; I290-L346 HydrophobicContact CG2-CD2 4.46Å
291	G	87.7	Confident	92.7	Very high	47 Å²	47	66.8 Å²	66.8	49%	0.485	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.2	177.9	0	0	0	0	0	114.7	L285	L285-G291 PolarHBondContact O-N 2.9Å
292	N	84.2	Confident	92.7	Very high	139 Å²	139	68.3 Å²	68.3	74%	0.743	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	13.6	174.8	69.4	-20.8	0	0	0	113.6	I290	I290-N292 PolarHBondContact O-N 3.48Å; I290-N292 VanDerWaalsContact O-N 3.11Å
293	A	86.2	Confident	92.7	Very high	23 Å²	23	67 Å²	67	19%	0.19	38%	0.38	C	S	.	.			trans	-57.9	140	176.9	0	0	0	0	0	110.9	I290 L346	I290-A293 HydrophobicContact CB-CB 4.33Å; I290-A293 VanDerWaalsContact O-CB 3.24Å; I290-A293 WeakPolarHBondContact O-CB 3.24Å; I290-A293 PolarHBondContact O-N 2.88Å; A293-L346 HydrophobicContact CB-CB 3.98Å; A293-L346 HydrophobicContact CB-CD1 4.43Å
294	T	86.5	Confident	92.8	Very high	93 Å²	93	65.9 Å²	65.9	57%	0.571	37%	0.368	S	S	*	.			trans	-87.1	-14.1	179	52.7	0	0	0	0	113	T345 L346 S347	T294-T345 PolarHBondContact N-O 3Å; T294-T345 VanDerWaalsContact N-O 3.16Å; T294-T345 PolarHBondContact OG1-O 3.17Å; T294-L346 CarbonylContact C-O 3.21Å; T294-L346 PolarHBondContact N-O 2.68Å; T294-L346 PolarHBondContact OG1-O 3.37Å; T294-S347 WeakPolarHBondContact OG1-CA 3.38Å; T294-S347 WeakPolarHBondContact OG1-CB 3.33Å; T294-S347 PolarHBondContact OG1-N 3.13Å
295	M	87.4	Confident	92.8	Very high	21 Å²	21	67.9 Å²	67.9	10%	0.103	38%	0.381	C	S	.	.	S	Bend	trans	-71.6	136.3	176.2	-178.2	164.5	75.9	0	0	111.3	V297 A310 I313 L346 P349	M295-V297 PolarHBondContact O-N 3.37Å; M295-V297 VanDerWaalsContact O-N 3.14Å; M295-A310 HydrophobicContact CE-CB 3.22Å; M295-I313 HydrophobicContact CE-CD1 4.46Å; M295-L346 WeakPolarHBondContact CA-O 3Å; M295-L346 WeakPolarHBondContact CB-O 3.47Å; M295-L346 PolarHBondContact N-O 3.27Å; M295-P349 HydrophobicContact SD-CB 4.09Å
296	S	85.4	Confident	92.8	Very high	70 Å²	70	68.3 Å²	68.3	49%	0.49	39%	0.387	S	S	.	.			trans	-72	100.7	178.1	158.8	0	0	0	0	111.3	R298	S296-R298 WeakPolarHBondContact OG-CG 3.44Å; S296-R298 PolarHBondContact OG-NE 2.81Å
297	V	95	Very high	92.8	Very high	7 Å²	7	64.8 Å²	64.8	4%	0.042	36%	0.364	C	S	.	.			trans	-96.9	120.4	161.9	178.8	0	0	0	0	108.2	Q278 C281 L285 M295 C304 N305 F307 A310	Q278-V297 PolarHBondContact NE2-O 2.85Å; C281-V297 HydrophobicContact CB-CG1 4.13Å; L285-V297 HydrophobicContact CD1-CB 4.08Å; L285-V297 HydrophobicContact CD1-CG2 4.12Å; L285-V297 HydrophobicContact CD2-CG2 4.15Å; M295-V297 PolarHBondContact O-N 3.37Å; M295-V297 VanDerWaalsContact O-N 3.14Å; V297-C304 HydrophobicContact CG1-CB 3.95Å; V297-N305 WeakPolarHBondContact CA-O 3.42Å; V297-F307 HydrophobicContact CG1-CB 3.93Å; V297-A310 HydrophobicContact CG2-CB 4.34Å
298	R	95.8	Very high	92.9	Very high	155 Å²	155	56 Å²	56	59%	0.585	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.9	-174.6	-66.6	-177.8	-169.7	-175.4	-1.1	112.1	S296 I300 C304 N305	S296-R298 WeakPolarHBondContact OG-CG 3.44Å; S296-R298 PolarHBondContact OG-NE 2.81Å; R298-I300 HydrophobicContact CB-CD1 4.1Å; R298-I300 HydrophobicContact CB-CG1 3.96Å; R298-I300 PolarHBondContact O-N 3.1Å; R298-C304 CarbonylContact O-C 3.49Å; R298-N305 PolarHBondContact N-O 2.82Å; R298-N305 PolarHBondContact O-N 3.34Å
299	C	97.6	Very high	93.2	Very high	37 Å²	37	53.7 Å²	53.7	25%	0.25	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	106.1	167.8	-172.8	0	0	0	0	110.2	C275 Q278 S303	C275-C299 HydrophobicContact CB-CB 3.87Å; C275-C299 WeakPolarHBondContact CB-SG 3.31Å; C275-C299 WeakPolarHBondContact SG-CA 3.16Å; C275-C299 WeakPolarHBondContact SG-CB 3.37Å; C275-C299 CovalentContact SG-SG 2.03Å; C275-C299 PolarHBondContact SG-SG 3.23Å; Q278-C299 VanDerWaalsContact OE1-N 3.1Å; C299-S303 WeakPolarHBondContact CA-O 3.46Å
300	I	97	Very high	93.4	Very high	74 Å²	74	51.5 Å²	51.5	38%	0.379	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.4	-179.1	-60.4	176.5	0	0	0	108.1	R298 G302 S303 N305	R298-I300 HydrophobicContact CB-CD1 4.1Å; R298-I300 HydrophobicContact CB-CG1 3.96Å; R298-I300 PolarHBondContact O-N 3.1Å; I300-G302 PolarHBondContact O-N 3.41Å; I300-G302 VanDerWaalsContact O-N 3.08Å; I300-S303 PolarHBondContact N-O 3.42Å; I300-S303 PolarHBondContact O-N 2.73Å; I300-N305 HydrophobicContact CB-CB 4.49Å; I300-N305 HydrophobicContact CD1-CB 4.11Å; I300-N305 HydrophobicContact CG1-CB 4.49Å
301	H	95.5	Very high	93.7	Very high	193 Å²	193	51.5 Å²	51.5	89%	0.894	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	34.8	-179.1	-55.8	121.5	0	0	0	114.1
302	G	96.9	Very high	94.2	Very high	31 Å²	31	49.2 Å²	49.2	32%	0.32	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	10.7	179.3	0	0	0	0	0	115.5	S274 C275 I300	S274-G302 CarbonylContact C-O 3.47Å; S274-G302 VanDerWaalsContact CA-O 3.24Å; S274-G302 WeakPolarHBondContact CA-O 3.37Å; C275-G302 PolarHBondContact N-O 2.68Å; C275-G302 CarbonylContact O-C 3.51Å; C275-G302 WeakPolarHBondContact O-CA 3.47Å; I300-G302 PolarHBondContact O-N 3.41Å; I300-G302 VanDerWaalsContact O-N 3.08Å
303	S	96.9	Very high	94.8	Very high	49 Å²	49	42.6 Å²	42.6	34%	0.343	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.6	176.3	-61.1	0	0	0	0	112.3	P273 C275 C299 I300 N305	P273-S303 WeakPolarHBondContact O-CA 3.48Å; C275-S303 PolarHBondContact SG-N 2.83Å; C275-S303 VanDerWaalsContact SG-N 3.36Å; C299-S303 WeakPolarHBondContact CA-O 3.46Å; I300-S303 PolarHBondContact N-O 3.42Å; I300-S303 PolarHBondContact O-N 2.73Å; S303-N305 VanDerWaalsContact C-N 3.34Å; S303-N305 PolarHBondContact O-N 3.15Å
304	C	97.3	Very high	95.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	78.4	175.9	-66.1	0	0	0	0	111.5	P273 C281 V297 R298 G306 F307	P273-C304 HydrophobicContact CB-CB 4.4Å; P273-C304 PolarHBondContact O-N 3.1Å; C281-C304 WeakPolarHBondContact CA-SG 3.45Å; C281-C304 HydrophobicContact CB-CB 3.84Å; C281-C304 WeakPolarHBondContact CB-SG 3.36Å; C281-C304 WeakPolarHBondContact SG-CA 3.21Å; C281-C304 WeakPolarHBondContact SG-CB 3.47Å; C281-C304 CovalentContact SG-SG 2.04Å; C281-C304 PolarHBondContact SG-SG 3.49Å; V297-C304 HydrophobicContact CG1-CB 3.95Å; R298-C304 CarbonylContact O-C 3.49Å; C304-G306 PolarHBondContact O-N 2.63Å; C304-F307 HydrophobicContact CB-CB 4.05Å; C304-F307 VanDerWaalsContact O-CB 3.26Å; C304-F307 WeakPolarHBondContact O-CB 3.21Å; C304-F307 PolarHBondContact O-N 2.95Å; C304-F307 VanDerWaalsContact O-N 3.15Å
305	N	96.6	Very high	95.8	Very high	87 Å²	87	42.4 Å²	42.4	47%	0.465	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	125.1	-174.8	-175.3	-115.7	0	0	0	111.9	V297 R298 I300 S303	V297-N305 WeakPolarHBondContact CA-O 3.42Å; R298-N305 PolarHBondContact N-O 2.82Å; R298-N305 PolarHBondContact O-N 3.34Å; I300-N305 HydrophobicContact CB-CB 4.49Å; I300-N305 HydrophobicContact CD1-CB 4.11Å; I300-N305 HydrophobicContact CG1-CB 4.49Å; S303-N305 VanDerWaalsContact C-N 3.34Å; S303-N305 PolarHBondContact O-N 3.15Å
306	G	95.8	Very high	96.2	Very high	18 Å²	18	41.5 Å²	41.5	19%	0.186	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.7	-0.6	-178.8	0	0	0	0	0	114.2	E272 C304 A310	E272-G306 PolarHBondContact OE1-N 3.17Å; C304-G306 PolarHBondContact O-N 2.63Å; G306-A310 PolarHBondContact O-N 3.31Å; G306-A310 VanDerWaalsContact O-N 3.13Å
307	F	97.2	Very high	96.6	Very high	19 Å²	19	39.6 Å²	39.6	8%	0.083	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-46.4	-179.7	176	-86.8	0	0	0	111.7	E272 P273 H284 L285 I288 V297 C304 D309 A310 A311	E272-F307 PolarHBondContact OE1-N 2.95Å; E272-F307 WeakPolarHBondContact OE2-CB 3.41Å; E272-F307 PolarHBondContact OE2-N 3.02Å; P273-F307 VanDerWaalsContact CD-CD1 3.44Å; P273-F307 HydrophobicContact CG-CB 4.26Å; P273-F307 HydrophobicContact CG-CD1 3.29Å; P273-F307 HydrophobicContact CG-CD2 4.3Å; P273-F307 HydrophobicContact CG-CE1 3.58Å; P273-F307 HydrophobicContact CG-CG 3.69Å; P273-F307 HydrophobicContact CG-CZ 4.2Å; H284-F307 HydrophobicContact CB-CD2 4.1Å; H284-F307 HydrophobicContact CB-CE2 3.58Å; H284-F307 HydrophobicContact CB-CZ 4.15Å; L285-F307 HydrophobicContact CD2-CD2 3.83Å; L285-F307 HydrophobicContact CD2-CE2 4.03Å; L285-F307 HydrophobicContact CG-CD2 4.19Å; L285-F307 HydrophobicContact CG-CE2 4.36Å; I288-F307 HydrophobicContact CD1-CE1 4.47Å; I288-F307 HydrophobicContact CD1-CE2 3.8Å; I288-F307 HydrophobicContact CD1-CZ 3.63Å; I288-F307 HydrophobicContact CG1-CE2 4.19Å; I288-F307 HydrophobicContact CG1-CZ 4.11Å; I288-F307 HydrophobicContact CG2-CZ 4.29Å; V297-F307 HydrophobicContact CG1-CB 3.93Å; C304-F307 HydrophobicContact CB-CB 4.05Å; C304-F307 VanDerWaalsContact O-CB 3.26Å; C304-F307 WeakPolarHBondContact O-CB 3.21Å; C304-F307 PolarHBondContact O-N 2.95Å; C304-F307 VanDerWaalsContact O-N 3.15Å; F307-D309 VanDerWaalsContact C-N 3.31Å; F307-D309 PolarHBondContact O-N 2.7Å; F307-A310 WeakPolarHBondContact O-CB 3.07Å; F307-A310 PolarHBondContact O-N 3.18Å; F307-A310 VanDerWaalsContact O-N 3.14Å; F307-A311 HydrophobicContact CE1-CB 4.34Å; F307-A311 WeakPolarHBondContact O-CB 3.4Å; F307-A311 PolarHBondContact O-N 3.46Å
308	N	97.2	Very high	96.6	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-38.8	-178.9	-74.2	-6.8	0	0	0	112.1	P242 V244 E271 E272 A311 N312	P242-N308 HydrophobicContact CB-CB 4.05Å; P242-N308 PolarHBondContact O-ND2 3.15Å; V244-N308 HydrophobicContact CB-CB 3.91Å; E271-N308 PolarHBondContact O-ND2 2.91Å; E272-N308 WeakPolarHBondContact OE2-CB 3.42Å; E272-N308 PolarHBondContact OE2-N 3.12Å; E272-N308 PolarHBondContact OE2-OD1 2.82Å; N308-A311 PolarHBondContact O-N 3.18Å; N308-N312 VanDerWaalsContact O-CG 3.32Å; N308-N312 PolarHBondContact O-N 3.44Å; N308-N312 VanDerWaalsContact O-N 3.07Å; N308-N312 PolarHBondContact O-ND2 3.22Å
309	D	97.4	Very high	96.5	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.064	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-47.8	173.2	-166.3	29.6	0	0	0	110.8	A236 F307 A311 N312 I313 P349 S350	A236-D309 HydrophobicContact CB-CB 3.99Å; A236-D309 WeakPolarHBondContact CB-OD1 3.4Å; F307-D309 VanDerWaalsContact C-N 3.31Å; F307-D309 PolarHBondContact O-N 2.7Å; D309-A311 VanDerWaalsContact C-N 3.34Å; D309-A311 PolarHBondContact O-N 3.37Å; D309-N312 PolarHBondContact O-N 2.81Å; D309-I313 WeakPolarHBondContact O-CD1 3.5Å; D309-I313 VanDerWaalsContact O-CG1 3.26Å; D309-I313 WeakPolarHBondContact O-CG1 3.26Å; D309-I313 PolarHBondContact O-N 3.01Å; D309-P349 WeakPolarHBondContact OD2-CA 3.33Å; D309-P349 WeakPolarHBondContact OD2-CB 3.45Å; D309-S350 VanDerWaalsContact CG-OG 3.29Å; D309-S350 WeakPolarHBondContact OD1-CB 3.18Å; D309-S350 PolarHBondContact OD1-OG 3.32Å; D309-S350 PolarHBondContact OD2-N 3.48Å; D309-S350 PolarHBondContact OD2-OG 3.4Å
310	A	97	Very high	96.4	Very high	1 Å²	1	39 Å²	39	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-47.1	177.2	0	0	0	0	0	112	L285 I290 M295 V297 G306 F307 N312 I313 Y314 L346	L285-A310 HydrophobicContact CD2-CB 4.38Å; I290-A310 HydrophobicContact CD1-CB 3.86Å; M295-A310 HydrophobicContact CE-CB 3.22Å; V297-A310 HydrophobicContact CG2-CB 4.34Å; G306-A310 PolarHBondContact O-N 3.31Å; G306-A310 VanDerWaalsContact O-N 3.13Å; F307-A310 WeakPolarHBondContact O-CB 3.07Å; F307-A310 PolarHBondContact O-N 3.18Å; F307-A310 VanDerWaalsContact O-N 3.14Å; A310-N312 PolarHBondContact O-N 2.85Å; A310-I313 PolarHBondContact O-N 2.61Å; A310-Y314 WeakPolarHBondContact O-CB 3.16Å; A310-Y314 PolarHBondContact O-N 3.38Å; A310-L346 HydrophobicContact CB-CD2 4.4Å; A310-L346 VanDerWaalsContact O-CD2 3.31Å; A310-L346 WeakPolarHBondContact O-CD2 3.45Å
311	A	97	Very high	96.3	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-43.7	-179.1	0	0	0	0	0	111.5	V244 I288 F307 N308 D309 Y314 K315	V244-A311 HydrophobicContact CG2-CB 4.17Å; I288-A311 HydrophobicContact CD1-CB 3.93Å; F307-A311 HydrophobicContact CE1-CB 4.34Å; F307-A311 WeakPolarHBondContact O-CB 3.4Å; F307-A311 PolarHBondContact O-N 3.46Å; N308-A311 PolarHBondContact O-N 3.18Å; D309-A311 VanDerWaalsContact C-N 3.34Å; D309-A311 PolarHBondContact O-N 3.37Å; A311-Y314 PolarHBondContact O-N 3.04Å; A311-K315 VanDerWaalsContact O-CG 3.27Å; A311-K315 WeakPolarHBondContact O-CG 3.3Å; A311-K315 PolarHBondContact O-N 3.36Å
312	N	97.5	Very high	96.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-69.5	-39.5	178.5	-68.9	-27	0	0	0	112.5	L232 I243 L245 N308 D309 A310 K315 T316	L232-N312 HydrophobicContact CD2-CB 3.57Å; I243-N312 PolarHBondContact O-ND2 3.21Å; L245-N312 PolarHBondContact N-OD1 2.94Å; N308-N312 VanDerWaalsContact O-CG 3.32Å; N308-N312 PolarHBondContact O-N 3.44Å; N308-N312 VanDerWaalsContact O-N 3.07Å; N308-N312 PolarHBondContact O-ND2 3.22Å; D309-N312 PolarHBondContact O-N 2.81Å; A310-N312 PolarHBondContact O-N 2.85Å; N312-K315 PolarHBondContact O-N 2.84Å; N312-T316 PolarHBondContact O-N 2.78Å; N312-T316 PolarHBondContact O-OG1 3.5Å
313	I	97.6	Very high	96.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-46.8	174.5	-67.9	163.8	0	0	0	110	L232 M295 D309 A310 K315 T316 V317 F343 L346 L353	L232-I313 HydrophobicContact CD1-CG1 4.22Å; M295-I313 HydrophobicContact CE-CD1 4.46Å; D309-I313 WeakPolarHBondContact O-CD1 3.5Å; D309-I313 VanDerWaalsContact O-CG1 3.26Å; D309-I313 WeakPolarHBondContact O-CG1 3.26Å; D309-I313 PolarHBondContact O-N 3.01Å; A310-I313 PolarHBondContact O-N 2.61Å; I313-K315 PolarHBondContact O-N 3.39Å; I313-T316 WeakPolarHBondContact O-CB 3.39Å; I313-T316 PolarHBondContact O-N 3.22Å; I313-T316 VanDerWaalsContact O-N 3.14Å; I313-V317 WeakPolarHBondContact O-CG2 3.36Å; I313-V317 PolarHBondContact O-N 3.38Å; I313-F343 HydrophobicContact CG2-CD1 3.96Å; I313-F343 HydrophobicContact CG2-CE1 4.37Å; I313-L346 HydrophobicContact CB-CD2 4.4Å; I313-L346 HydrophobicContact CG2-CD2 4.24Å; I313-L346 HydrophobicContact CG2-CG 4.39Å; I313-L353 HydrophobicContact CD1-CD1 3.85Å; I313-L353 HydrophobicContact CG1-CD1 4.07Å; I313-L353 HydrophobicContact CG2-CD1 4.02Å
314	Y	96.5	Very high	96	Very high	74 Å²	74	24.7 Å²	24.7	29%	0.29	12%	0.12	S	C	.	.	H	α-helix	trans	-56.9	-48.1	176.9	174.2	-114.9	0	0	0	112.4	I288 I290 A310 A311 T316 V317 K318	I288-Y314 WeakPolarHBondContact O-CE1 3.43Å; I290-Y314 HydrophobicContact CG2-CD1 4.01Å; I290-Y314 HydrophobicContact CG2-CD2 3.11Å; I290-Y314 HydrophobicContact CG2-CE1 4.35Å; I290-Y314 HydrophobicContact CG2-CE2 3.51Å; I290-Y314 HydrophobicContact CG2-CG 3.38Å; A310-Y314 WeakPolarHBondContact O-CB 3.16Å; A310-Y314 PolarHBondContact O-N 3.38Å; A311-Y314 PolarHBondContact O-N 3.04Å; Y314-T316 VanDerWaalsContact C-N 3.26Å; Y314-T316 PolarHBondContact O-N 2.9Å; Y314-V317 WeakPolarHBondContact O-CB 3.35Å; Y314-V317 PolarHBondContact O-N 3.41Å; Y314-V317 VanDerWaalsContact O-N 3.14Å; Y314-K318 PolarHBondContact O-N 2.87Å
315	K	96.2	Very high	95.7	Very high	38 Å²	38	28.4 Å²	28.4	17%	0.165	14%	0.137	C	C	.	.	H	α-helix	trans	-64.4	-34.4	178.6	-65.3	176.8	-160.1	-175.2	0	111.3	L245 N246 F248 A311 N312 I313 K318 H319	L245-K315 PolarHBondContact O-NZ 3.46Å; N246-K315 PolarHBondContact O-NZ 2.98Å; F248-K315 HydrophobicContact CB-CB 3.75Å; F248-K315 HydrophobicContact CB-CD 3.44Å; F248-K315 VanDerWaalsContact CB-CD 3.44Å; F248-K315 HydrophobicContact CB-CG 4.17Å; F248-K315 HydrophobicContact CD1-CB 3.61Å; F248-K315 HydrophobicContact CD2-CB 4.44Å; F248-K315 HydrophobicContact CE1-CB 4.31Å; F248-K315 HydrophobicContact CG-CB 3.71Å; F248-K315 HydrophobicContact CG-CD 4.31Å; A311-K315 VanDerWaalsContact O-CG 3.27Å; A311-K315 WeakPolarHBondContact O-CG 3.3Å; A311-K315 PolarHBondContact O-N 3.36Å; N312-K315 PolarHBondContact O-N 2.84Å; I313-K315 PolarHBondContact O-N 3.39Å; K315-K318 PolarHBondContact O-N 3.27Å; K315-H319 PolarHBondContact O-CD2 2.74Å; K315-H319 VanDerWaalsContact O-CD2 3.27Å; K315-H319 PolarHBondContact O-N 3.47Å; K315-H319 VanDerWaalsContact O-N 3.13Å
316	T	96.5	Very high	95.4	Very high	1 Å²	1	29 Å²	29	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-63.3	-43.1	171.9	-58.9	0	0	0	0	112	L232 F248 N312 I313 Y314 K318 H319 F320 F343	L232-T316 HydrophobicContact CD1-CG2 4.18Å; F248-T316 VanDerWaalsContact CZ-OG1 3.24Å; F248-T316 WeakPolarHBondContact CZ-OG1 3.43Å; N312-T316 PolarHBondContact O-N 2.78Å; N312-T316 PolarHBondContact O-OG1 3.5Å; I313-T316 WeakPolarHBondContact O-CB 3.39Å; I313-T316 PolarHBondContact O-N 3.22Å; I313-T316 VanDerWaalsContact O-N 3.14Å; Y314-T316 VanDerWaalsContact C-N 3.26Å; Y314-T316 PolarHBondContact O-N 2.9Å; T316-K318 VanDerWaalsContact C-N 3.33Å; T316-K318 PolarHBondContact O-N 3.37Å; T316-H319 PolarHBondContact O-N 3.27Å; T316-F320 HydrophobicContact CG2-CB 4.25Å; T316-F320 HydrophobicContact CG2-CD2 4.47Å; T316-F320 WeakPolarHBondContact O-CB 3.24Å; T316-F320 PolarHBondContact O-N 3.05Å; T316-F343 HydrophobicContact CG2-CE1 4.39Å
317	V	94.9	Very high	95.1	Very high	31 Å²	31	28.7 Å²	28.7	19%	0.188	13%	0.134	C	C	.	.	H	α-helix	trans	-56.4	-49.5	174.9	169.3	0	0	0	0	110.8	I313 Y314 H319 L321 F343 R344	I313-V317 WeakPolarHBondContact O-CG2 3.36Å; I313-V317 PolarHBondContact O-N 3.38Å; Y314-V317 WeakPolarHBondContact O-CB 3.35Å; Y314-V317 PolarHBondContact O-N 3.41Å; Y314-V317 VanDerWaalsContact O-N 3.14Å; V317-H319 VanDerWaalsContact C-N 3.28Å; V317-H319 PolarHBondContact O-N 3.1Å; V317-L321 HydrophobicContact CG1-CD2 4.08Å; V317-L321 WeakPolarHBondContact O-CB 3.35Å; V317-F343 HydrophobicContact CG2-CB 3.86Å; V317-F343 HydrophobicContact CG2-CD1 4.15Å; V317-F343 WeakPolarHBondContact CG2-O 3.29Å; V317-R344 HydrophobicContact CG1-CG 4.37Å
318	K	94.5	Very high	94.9	Very high	146 Å²	146	28.5 Å²	28.5	64%	0.635	13%	0.134	S	C	*	.	H	α-helix	trans	-59.4	-37.5	-178.3	-176.6	179.3	177.6	-179.4	0	112.8	Y314 K315 T316	Y314-K318 PolarHBondContact O-N 2.87Å; K315-K318 PolarHBondContact O-N 3.27Å; T316-K318 VanDerWaalsContact C-N 3.33Å; T316-K318 PolarHBondContact O-N 3.37Å
319	H	94.3	Very high	94.5	Very high	39 Å²	39	29.6 Å²	29.6	18%	0.181	14%	0.141	C	C	.	.	H	α-helix	trans	-104.3	-23.7	-170	-72.9	-65.5	0	0	0	115.2	F248 K315 T316 V317 F322	F248-H319 HydrophobicContact CE1-CB 4.47Å; F248-H319 PolarHBondContact O-CD2 3.49Å; F248-H319 PolarHBondContact O-NE2 3.35Å; K315-H319 PolarHBondContact O-CD2 2.74Å; K315-H319 VanDerWaalsContact O-CD2 3.27Å; K315-H319 PolarHBondContact O-N 3.47Å; K315-H319 VanDerWaalsContact O-N 3.13Å; T316-H319 PolarHBondContact O-N 3.27Å; V317-H319 VanDerWaalsContact C-N 3.28Å; V317-H319 PolarHBondContact O-N 3.1Å; H319-F322 WeakPolarHBondContact O-CE1 3.48Å
320	F	95.5	Very high	94	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-136	-8.6	-164.1	-67	-68	0	0	0	115.6	M208 L228 F248 F253 F260 T316 F322 L323	M208-F320 HydrophobicContact CE-CD1 4.42Å; M208-F320 HydrophobicContact CE-CE1 3.26Å; M208-F320 HydrophobicContact CE-CZ 3.55Å; M208-F320 HydrophobicContact SD-CE1 3.63Å; M208-F320 HydrophobicContact SD-CZ 4.18Å; L228-F320 HydrophobicContact CD1-CB 3.52Å; L228-F320 HydrophobicContact CD1-CD1 3.75Å; L228-F320 HydrophobicContact CD1-CD2 3.73Å; L228-F320 HydrophobicContact CD1-CE1 4.3Å; L228-F320 HydrophobicContact CD1-CE2 4.32Å; L228-F320 HydrophobicContact CD1-CG 3.4Å; L228-F320 HydrophobicContact CD2-CD2 4.21Å; L228-F320 HydrophobicContact CD2-CE2 4.08Å; L228-F320 HydrophobicContact CD2-CZ 4.35Å; F248-F320 AromaticContact CE1-CD2 3.72Å; F248-F320 HydrophobicContact CE1-CD2 3.72Å; F248-F320 AromaticContact CE1-CE2 3.47Å; F248-F320 HydrophobicContact CE1-CE2 3.47Å; F248-F320 VanDerWaalsContact CE1-CE2 3.47Å; F248-F320 HydrophobicContact CZ-CD2 4.06Å; F248-F320 AromaticContact CZ-CE2 3.86Å; F248-F320 HydrophobicContact CZ-CE2 3.86Å; F253-F320 HydrophobicContact CB-CZ 4.43Å; F253-F320 AromaticContact CD2-CE2 3.97Å; F253-F320 HydrophobicContact CD2-CE2 3.97Å; F253-F320 AromaticContact CD2-CZ 3.65Å; F253-F320 HydrophobicContact CD2-CZ 3.65Å; F253-F320 AromaticContact CE2-CE2 3.87Å; F253-F320 HydrophobicContact CE2-CE2 3.87Å; F253-F320 HydrophobicContact CE2-CZ 4.05Å; F253-F320 HydrophobicContact CG-CZ 4.04Å; F253-F320 HydrophobicContact CZ-CE2 4.44Å; F260-F320 HydrophobicContact CE2-CD1 4.07Å; F260-F320 AromaticContact CE2-CE1 3.99Å; F260-F320 HydrophobicContact CE2-CE1 3.99Å; F260-F320 HydrophobicContact CZ-CD1 4.36Å; F260-F320 HydrophobicContact CZ-CE1 4.03Å; T316-F320 HydrophobicContact CG2-CB 4.25Å; T316-F320 HydrophobicContact CG2-CD2 4.47Å; T316-F320 WeakPolarHBondContact O-CB 3.24Å; T316-F320 PolarHBondContact O-N 3.05Å; F320-F322 PolarHBondContact O-N 3.41Å; F320-L323 HydrophobicContact CB-CD1 4.09Å; F320-L323 HydrophobicContact CD1-CD1 4.08Å; F320-L323 WeakPolarHBondContact O-CB 3.37Å; F320-L323 WeakPolarHBondContact O-CD1 3.24Å; F320-L323 VanDerWaalsContact O-CG 3.27Å; F320-L323 WeakPolarHBondContact O-CG 3.45Å; F320-L323 PolarHBondContact O-N 3.03Å; F320-L323 VanDerWaalsContact O-N 3.07Å
321	L	94.4	Very high	93.5	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-62.4	-23	-176.3	-164.3	65.1	0	0	0	113.2	F225 V317 L323 L324 M340 F343 R344	F225-L321 HydrophobicContact CE2-CD1 4.37Å; F225-L321 HydrophobicContact CZ-CD1 4.47Å; V317-L321 HydrophobicContact CG1-CD2 4.08Å; V317-L321 WeakPolarHBondContact O-CB 3.35Å; L321-L323 PolarHBondContact O-N 3.13Å; L321-L323 VanDerWaalsContact O-N 3.15Å; L321-L324 PolarHBondContact O-N 3.38Å; L321-M340 HydrophobicContact CD1-CB 4.33Å; L321-M340 HydrophobicContact CD1-CG 4.03Å; L321-M340 HydrophobicContact CG-CG 4.42Å; L321-F343 HydrophobicContact CD1-CB 3.99Å; L321-F343 HydrophobicContact CD1-CG 4.3Å; L321-R344 HydrophobicContact CD2-CG 3.39Å; L321-R344 VanDerWaalsContact CD2-NE 3.32Å
322	F	93.1	Very high	93.3	Very high	41 Å²	41	37.7 Å²	37.7	18%	0.18	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-58.8	-23.4	176.2	76.4	-94.9	0	0	0	113.5	L210 L213 L214 H319 F320 L324 Q325	L210-F322 HydrophobicContact CD1-CD1 4.44Å; L210-F322 HydrophobicContact CD1-CD2 4.05Å; L210-F322 HydrophobicContact CD1-CE1 3.88Å; L210-F322 HydrophobicContact CD1-CE2 3.46Å; L210-F322 VanDerWaalsContact CD1-CE2 3.46Å; L210-F322 HydrophobicContact CD1-CZ 3.36Å; L213-F322 HydrophobicContact CB-CE2 4.35Å; L213-F322 HydrophobicContact CD1-CZ 4.06Å; L214-F322 HydrophobicContact CD2-CD2 3.81Å; L214-F322 HydrophobicContact CD2-CE2 4.1Å; L214-F322 HydrophobicContact CG-CE2 4.47Å; H319-F322 WeakPolarHBondContact O-CE1 3.48Å; F320-F322 PolarHBondContact O-N 3.41Å; F322-L324 PolarHBondContact O-N 3.19Å; F322-L324 VanDerWaalsContact O-N 3.16Å; F322-Q325 PolarHBondContact O-N 3.29Å; F322-Q325 VanDerWaalsContact O-N 3.13Å
323	L	94.9	Very high	93.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58.7	-30.5	-177.7	-69.3	168.3	0	0	0	113.1	R221 F225 L228 F260 F320 L321	R221-L323 HydrophobicContact CB-CB 4.4Å; R221-L323 HydrophobicContact CB-CD2 4.42Å; R221-L323 WeakPolarHBondContact CB-O 3.36Å; R221-L323 VanDerWaalsContact CD-O 3.27Å; R221-L323 WeakPolarHBondContact CD-O 3.09Å; R221-L323 HydrophobicContact CG-CD2 4.29Å; R221-L323 PolarHBondContact NE-O 3.14Å; R221-L323 VanDerWaalsContact NE-O 3.07Å; F225-L323 HydrophobicContact CD2-CB 4.42Å; F225-L323 HydrophobicContact CD2-CD1 4.37Å; L228-L323 HydrophobicContact CD1-CD1 4.18Å; F260-L323 HydrophobicContact CE2-CD1 3.68Å; F260-L323 HydrophobicContact CZ-CD1 4.3Å; F320-L323 HydrophobicContact CB-CD1 4.09Å; F320-L323 HydrophobicContact CD1-CD1 4.08Å; F320-L323 WeakPolarHBondContact O-CB 3.37Å; F320-L323 WeakPolarHBondContact O-CD1 3.24Å; F320-L323 VanDerWaalsContact O-CG 3.27Å; F320-L323 WeakPolarHBondContact O-CG 3.45Å; F320-L323 PolarHBondContact O-N 3.03Å; F320-L323 VanDerWaalsContact O-N 3.07Å; L321-L323 PolarHBondContact O-N 3.13Å; L321-L323 VanDerWaalsContact O-N 3.15Å
324	L	95.1	Very high	93	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-100.4	-5.3	-179.2	-60.8	-173.4	0	0	0	113.9	L222 F225 L321 F322 V328 V336 L339 M340	L222-L324 HydrophobicContact CD1-CD2 3.94Å; F225-L324 HydrophobicContact CB-CD2 4.06Å; F225-L324 HydrophobicContact CB-CG 4.31Å; F225-L324 HydrophobicContact CD1-CD1 3.57Å; F225-L324 HydrophobicContact CD1-CD2 4.44Å; F225-L324 HydrophobicContact CD1-CG 4.14Å; F225-L324 HydrophobicContact CD2-CD1 4.15Å; F225-L324 HydrophobicContact CD2-CG 4.05Å; F225-L324 HydrophobicContact CE1-CD1 3.59Å; F225-L324 HydrophobicContact CE1-CG 4.49Å; F225-L324 HydrophobicContact CE2-CD1 4.18Å; F225-L324 HydrophobicContact CE2-CG 4.41Å; F225-L324 HydrophobicContact CG-CD1 3.85Å; F225-L324 HydrophobicContact CG-CD2 4.16Å; F225-L324 HydrophobicContact CG-CG 3.89Å; F225-L324 HydrophobicContact CZ-CD1 3.91Å; L321-L324 PolarHBondContact O-N 3.38Å; F322-L324 PolarHBondContact O-N 3.19Å; F322-L324 VanDerWaalsContact O-N 3.16Å; L324-V328 WeakPolarHBondContact O-CG2 3.48Å; L324-V336 HydrophobicContact CB-CG1 4Å; L324-L339 HydrophobicContact CD1-CD2 3.9Å; L324-M340 HydrophobicContact CB-CG 4.42Å; L324-M340 HydrophobicContact CB-SD 4.28Å
325	Q	91.1	Very high	93	Very high	79 Å²	79	46 Å²	46	37%	0.369	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-28.5	-170.5	-71.4	177.4	9.9	0	0	114	F322 M340	F322-Q325 PolarHBondContact O-N 3.29Å; F322-Q325 VanDerWaalsContact O-N 3.13Å; Q325-M340 HydrophobicContact CG-SD 3.75Å
326	H	90.3	Very high	93	Very high	100 Å²	100	44.1 Å²	44.1	46%	0.463	23%	0.229	S	C	.	.	S	Bend	trans	-116.2	147.3	-172.3	-58.6	-55.1	0	0	0	111.5	W218 R221 V328	W218-H326 VanDerWaalsContact CD1-O 3.28Å; R221-H326 PolarHBondContact NH2-O 3.1Å; H326-V328 VanDerWaalsContact C-N 3.27Å; H326-V328 PolarHBondContact O-N 3.45Å
327	G	88.8	Confident	93.1	Very high	11 Å²	11	46.5 Å²	46.5	11%	0.113	24%	0.242	C	C	.	.	S	Bend	trans	70	19.1	173.6	0	0	0	0	0	114.7	W218	W218-G327 VanDerWaalsContact CB-O 3.29Å; W218-G327 WeakPolarHBondContact CB-O 3.45Å; W218-G327 VanDerWaalsContact CG-O 3.31Å
328	V	92.3	Very high	93.2	Very high	14 Å²	14	49.3 Å²	49.3	9%	0.085	26%	0.255	C	S	.	.			trans	-63.8	130.9	175.7	-171.6	0	0	0	0	109.2	W218 L324 H326 L332 V336	W218-V328 HydrophobicContact CZ2-CG1 4.26Å; L324-V328 WeakPolarHBondContact O-CG2 3.48Å; H326-V328 VanDerWaalsContact C-N 3.27Å; H326-V328 PolarHBondContact O-N 3.45Å; V328-L332 HydrophobicContact CG1-CB 4.13Å; V328-V336 HydrophobicContact CG1-CB 4.03Å; V328-V336 HydrophobicContact CG1-CG1 4.44Å; V328-V336 HydrophobicContact CG1-CG2 3.62Å; V328-V336 HydrophobicContact CG2-CB 4.43Å; V328-V336 HydrophobicContact CG2-CG1 3.97Å; V328-V336 HydrophobicContact CG2-CG2 4.48Å
329	P	89.6	Confident	93.3	Very high	26 Å²	26	42.5 Å²	42.5	17%	0.169	23%	0.226	C	C	.	.			trans	-54	128.2	168.9	-27.3	35.9	0	0	0	110	W218 S331 L332 Q333 Y364	W218-P329 HydrophobicContact CD2-CG 4.5Å; W218-P329 HydrophobicContact CE3-CG 4.1Å; W218-P329 HydrophobicContact CZ3-CG 4.21Å; P329-S331 PolarHBondContact O-N 2.9Å; P329-L332 HydrophobicContact CB-CB 4.46Å; P329-L332 HydrophobicContact CB-CD1 4.32Å; P329-L332 HydrophobicContact CB-CG 4.44Å; P329-L332 HydrophobicContact CG-CD1 4.18Å; P329-L332 WeakPolarHBondContact O-CA 3.37Å; P329-L332 PolarHBondContact O-N 3.3Å; P329-Q333 PolarHBondContact O-N 3.48Å; P329-Y364 HydrophobicContact CG-CD2 4.33Å; P329-Y364 HydrophobicContact CG-CE2 4.01Å
330	P	87	Confident	93.5	Very high	120 Å²	120	41 Å²	41	78%	0.779	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-53.2	-34.6	-171.2	-31.1	35.6	0	0	0	114.7	L332 Q333	P330-L332 VanDerWaalsContact C-N 3.28Å; P330-L332 PolarHBondContact O-N 3.37Å; P330-Q333 VanDerWaalsContact O-CB 3.25Å; P330-Q333 WeakPolarHBondContact O-CB 3.45Å; P330-Q333 PolarHBondContact O-N 3.29Å
331	S	87	Confident	93.5	Very high	63 Å²	63	44.1 Å²	44.1	44%	0.441	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-68.5	-20.5	176.6	47.8	0	0	0	0	114.8	P329 Y369	P329-S331 PolarHBondContact O-N 2.9Å; S331-Y369 WeakPolarHBondContact CB-O 3.5Å; S331-Y369 WeakPolarHBondContact OG-CD2 3.27Å
332	L	93.2	Very high	93.6	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-97.7	-5.3	176.2	-69.2	179.1	0	0	0	112.9	W218 V328 P329 P330 Q334 Q335 V336 L360 N363 Y364 Y369	W218-L332 HydrophobicContact CH2-CD1 3.73Å; W218-L332 HydrophobicContact CZ3-CD1 4.16Å; V328-L332 HydrophobicContact CG1-CB 4.13Å; P329-L332 HydrophobicContact CB-CB 4.46Å; P329-L332 HydrophobicContact CB-CD1 4.32Å; P329-L332 HydrophobicContact CB-CG 4.44Å; P329-L332 HydrophobicContact CG-CD1 4.18Å; P329-L332 WeakPolarHBondContact O-CA 3.37Å; P329-L332 PolarHBondContact O-N 3.3Å; P330-L332 VanDerWaalsContact C-N 3.28Å; P330-L332 PolarHBondContact O-N 3.37Å; L332-Q334 VanDerWaalsContact C-N 3.33Å; L332-Q334 PolarHBondContact O-N 3Å; L332-Q335 PolarHBondContact O-N 3.25Å; L332-V336 WeakPolarHBondContact O-CG2 3.4Å; L332-V336 PolarHBondContact O-N 3.14Å; L332-L360 HydrophobicContact CB-CD1 4.44Å; L332-L360 HydrophobicContact CD1-CD1 4.2Å; L332-L360 HydrophobicContact CD2-CD1 4.22Å; L332-N363 HydrophobicContact CD2-CB 4.26Å; L332-Y364 HydrophobicContact CD1-CD2 3.71Å; L332-Y364 HydrophobicContact CD1-CG 4.31Å; L332-Y369 HydrophobicContact CD1-CD1 3.9Å; L332-Y369 HydrophobicContact CD1-CE1 4.15Å; L332-Y369 HydrophobicContact CD1-CG 4.37Å; L332-Y369 HydrophobicContact CD2-CD1 3.87Å; L332-Y369 HydrophobicContact CD2-CG 3.94Å; L332-Y369 HydrophobicContact CG-CD1 3.91Å; L332-Y369 HydrophobicContact CG-CG 3.92Å
333	Q	93.6	Very high	93.8	Very high	72 Å²	72	42.8 Å²	42.8	34%	0.336	24%	0.235	S	C	.	.	H	α-helix	trans	-51.8	-49	-174.1	-172	61.7	52.2	0	0	112.1	P329 P330 Q335 V336 D337	P329-Q333 PolarHBondContact O-N 3.48Å; P330-Q333 VanDerWaalsContact O-CB 3.25Å; P330-Q333 WeakPolarHBondContact O-CB 3.45Å; P330-Q333 PolarHBondContact O-N 3.29Å; Q333-Q335 VanDerWaalsContact C-N 3.35Å; Q333-Q335 PolarHBondContact O-N 3.47Å; Q333-V336 PolarHBondContact O-N 3.33Å; Q333-D337 WeakPolarHBondContact CG-OD2 3.2Å; Q333-D337 VanDerWaalsContact NE2-CG 3.35Å; Q333-D337 PolarHBondContact NE2-OD1 3.28Å; Q333-D337 PolarHBondContact NE2-OD2 2.86Å; Q333-D337 VanDerWaalsContact NE2-OD2 3.09Å; Q333-D337 WeakPolarHBondContact O-CB 3.47Å; Q333-D337 PolarHBondContact O-N 3.46Å
334	Q	94.7	Very high	93.8	Very high	125 Å²	125	48.1 Å²	48.1	58%	0.584	26%	0.255	S	S	*	.	H	α-helix	trans	-61.4	-40.3	179.1	-173.7	63.6	54.4	0	0	113.1	L332 D337 N338	L332-Q334 VanDerWaalsContact C-N 3.33Å; L332-Q334 PolarHBondContact O-N 3Å; Q334-D337 PolarHBondContact O-N 3.46Å; Q334-N338 PolarHBondContact NE2-OD1 3.47Å; Q334-N338 WeakPolarHBondContact O-CB 3.41Å; Q334-N338 PolarHBondContact O-N 2.72Å; Q334-N338 PolarHBondContact O-ND2 3.27Å; Q334-N338 PolarHBondContact O-OD1 3.07Å
335	Q	95.9	Very high	93.8	Very high	50 Å²	50	50.9 Å²	50.9	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-42	179.7	-170.6	175.6	22.7	0	0	110.5	L332 Q333 N338 L339 L360 N363	L332-Q335 PolarHBondContact O-N 3.25Å; Q333-Q335 VanDerWaalsContact C-N 3.35Å; Q333-Q335 PolarHBondContact O-N 3.47Å; Q335-N338 PolarHBondContact O-N 2.84Å; Q335-L339 WeakPolarHBondContact O-CB 3.18Å; Q335-L339 PolarHBondContact O-N 3.38Å; Q335-L360 HydrophobicContact CB-CD1 4.39Å; Q335-L360 HydrophobicContact CG-CB 4.47Å; Q335-L360 HydrophobicContact CG-CD1 4.13Å; Q335-N363 PolarHBondContact NE2-ND2 3.31Å; Q335-N363 PolarHBondContact OE1-ND2 3.37Å
336	V	97.4	Very high	94	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-40.7	176.6	176.9	0	0	0	0	111.2	W218 L324 V328 L332 Q333 L339 M340 L360	W218-V336 HydrophobicContact CZ2-CG2 3.96Å; L324-V336 HydrophobicContact CB-CG1 4Å; V328-V336 HydrophobicContact CG1-CB 4.03Å; V328-V336 HydrophobicContact CG1-CG1 4.44Å; V328-V336 HydrophobicContact CG1-CG2 3.62Å; V328-V336 HydrophobicContact CG2-CB 4.43Å; V328-V336 HydrophobicContact CG2-CG1 3.97Å; V328-V336 HydrophobicContact CG2-CG2 4.48Å; L332-V336 WeakPolarHBondContact O-CG2 3.4Å; L332-V336 PolarHBondContact O-N 3.14Å; Q333-V336 PolarHBondContact O-N 3.33Å; V336-L339 PolarHBondContact O-N 2.96Å; V336-M340 HydrophobicContact CG1-CE 3.87Å; V336-M340 HydrophobicContact CG1-CG 4.19Å; V336-M340 HydrophobicContact CG1-SD 4.15Å; V336-M340 WeakPolarHBondContact O-CB 3.48Å; V336-M340 VanDerWaalsContact O-CG 3.31Å; V336-M340 WeakPolarHBondContact O-CG 3.27Å; V336-M340 PolarHBondContact O-N 3.27Å; V336-L360 HydrophobicContact CG2-CD1 3.84Å; V336-L360 HydrophobicContact CG2-CD2 3.88Å
337	D	97.2	Very high	94.2	Very high	51 Å²	51	44.8 Å²	44.8	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-64.8	-40.5	177.2	-70.6	-26.8	0	0	0	112.1	Q333 Q334 M340 T341	Q333-D337 WeakPolarHBondContact CG-OD2 3.2Å; Q333-D337 VanDerWaalsContact NE2-CG 3.35Å; Q333-D337 PolarHBondContact NE2-OD1 3.28Å; Q333-D337 PolarHBondContact NE2-OD2 2.86Å; Q333-D337 VanDerWaalsContact NE2-OD2 3.09Å; Q333-D337 WeakPolarHBondContact O-CB 3.47Å; Q333-D337 PolarHBondContact O-N 3.46Å; Q334-D337 PolarHBondContact O-N 3.46Å; D337-M340 PolarHBondContact O-N 2.9Å; D337-M340 WeakPolarHBondContact OD1-CE 3.22Å; D337-T341 VanDerWaalsContact O-CB 3.24Å; D337-T341 WeakPolarHBondContact O-CB 3.42Å; D337-T341 PolarHBondContact O-N 3.43Å; D337-T341 PolarHBondContact O-OG1 2.92Å
338	N	97.1	Very high	94.6	Very high	89 Å²	89	46.7 Å²	46.7	48%	0.476	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-44.1	174.2	-70.6	-8	0	0	0	111.6	Q334 Q335 S342	Q334-N338 PolarHBondContact NE2-OD1 3.47Å; Q334-N338 WeakPolarHBondContact O-CB 3.41Å; Q334-N338 PolarHBondContact O-N 2.72Å; Q334-N338 PolarHBondContact O-ND2 3.27Å; Q334-N338 PolarHBondContact O-OD1 3.07Å; Q335-N338 PolarHBondContact O-N 2.84Å; N338-S342 PolarHBondContact O-N 3.3Å; N338-S342 PolarHBondContact O-OG 3.37Å
339	L	97.9	Very high	94.8	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-52.9	176.4	-179.4	60.9	0	0	0	110.9	F225 L324 Q335 V336 T341 S342 F343 L353 L356 L360	F225-L339 HydrophobicContact CE1-CD2 4.19Å; L324-L339 HydrophobicContact CD1-CD2 3.9Å; Q335-L339 WeakPolarHBondContact O-CB 3.18Å; Q335-L339 PolarHBondContact O-N 3.38Å; V336-L339 PolarHBondContact O-N 2.96Å; L339-T341 VanDerWaalsContact C-N 3.28Å; L339-T341 PolarHBondContact O-N 3.46Å; L339-S342 WeakPolarHBondContact O-CB 3.47Å; L339-S342 PolarHBondContact O-N 3.48Å; L339-S342 VanDerWaalsContact O-N 3.13Å; L339-F343 HydrophobicContact CD1-CD2 3.95Å; L339-F343 HydrophobicContact CD1-CE2 3.7Å; L339-F343 HydrophobicContact CG-CD2 4.13Å; L339-F343 HydrophobicContact CG-CE2 4.12Å; L339-F343 WeakPolarHBondContact O-CD2 3.3Å; L339-F343 PolarHBondContact O-N 2.95Å; L339-L353 HydrophobicContact CD1-CD2 4.39Å; L339-L356 HydrophobicContact CD1-CB 3.81Å; L339-L356 HydrophobicContact CD1-CD1 4.35Å; L339-L360 HydrophobicContact CD2-CD2 3.89Å
340	M	97.3	Very high	95.2	Very high	6 Å²	6	47 Å²	47	3%	0.03	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-38.2	179.9	-72.4	-169.9	-59.4	0	0	112.1	L321 L324 Q325 V336 D337 F343 R344	L321-M340 HydrophobicContact CD1-CB 4.33Å; L321-M340 HydrophobicContact CD1-CG 4.03Å; L321-M340 HydrophobicContact CG-CG 4.42Å; L324-M340 HydrophobicContact CB-CG 4.42Å; L324-M340 HydrophobicContact CB-SD 4.28Å; Q325-M340 HydrophobicContact CG-SD 3.75Å; V336-M340 HydrophobicContact CG1-CE 3.87Å; V336-M340 HydrophobicContact CG1-CG 4.19Å; V336-M340 HydrophobicContact CG1-SD 4.15Å; V336-M340 WeakPolarHBondContact O-CB 3.48Å; V336-M340 VanDerWaalsContact O-CG 3.31Å; V336-M340 WeakPolarHBondContact O-CG 3.27Å; V336-M340 PolarHBondContact O-N 3.27Å; D337-M340 PolarHBondContact O-N 2.9Å; D337-M340 WeakPolarHBondContact OD1-CE 3.22Å; M340-F343 PolarHBondContact O-N 3.4Å; M340-R344 VanDerWaalsContact O-CG 3.3Å; M340-R344 WeakPolarHBondContact O-CG 3.47Å; M340-R344 PolarHBondContact O-N 3.14Å
341	T	96.5	Very high	95.7	Very high	67 Å²	67	43.3 Å²	43.3	41%	0.411	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-45.9	175.7	-60.3	0	0	0	0	110.6	D337 L339 F343 R344 T345	D337-T341 VanDerWaalsContact O-CB 3.24Å; D337-T341 WeakPolarHBondContact O-CB 3.42Å; D337-T341 PolarHBondContact O-N 3.43Å; D337-T341 PolarHBondContact O-OG1 2.92Å; L339-T341 VanDerWaalsContact C-N 3.28Å; L339-T341 PolarHBondContact O-N 3.46Å; T341-F343 VanDerWaalsContact C-N 3.26Å; T341-F343 PolarHBondContact O-N 2.91Å; T341-R344 PolarHBondContact O-N 3.14Å; T341-R344 VanDerWaalsContact O-N 3.1Å; T341-T345 HydrophobicContact CG2-CG2 4.15Å; T341-T345 PolarHBondContact O-N 3.36Å; T341-T345 PolarHBondContact O-OG1 2.78Å
342	S	96.8	Very high	96.2	Very high	18 Å²	18	41.2 Å²	41.2	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-36.2	178.8	-54.8	0	0	0	0	112.9	N338 L339 L346 S347	N338-S342 PolarHBondContact O-N 3.3Å; N338-S342 PolarHBondContact O-OG 3.37Å; L339-S342 WeakPolarHBondContact O-CB 3.47Å; L339-S342 PolarHBondContact O-N 3.48Å; L339-S342 VanDerWaalsContact O-N 3.13Å; S342-L346 WeakPolarHBondContact O-CA 3.48Å; S342-L346 PolarHBondContact O-N 2.99Å; S342-S347 WeakPolarHBondContact CA-OG 3.48Å; S342-S347 PolarHBondContact O-N 3.37Å
343	F	96.8	Very high	96.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-52.9	170.5	-92.6	-82.7	0	0	0	111.7	F225 V229 L232 I313 T316 V317 L321 L339 M340 T341 T345 L346 L353	F225-F343 AromaticContact CE1-CE2 3.72Å; F225-F343 HydrophobicContact CE1-CE2 3.72Å; F225-F343 AromaticContact CE1-CZ 3.94Å; F225-F343 HydrophobicContact CE1-CZ 3.94Å; F225-F343 AromaticContact CZ-CD2 3.97Å; F225-F343 HydrophobicContact CZ-CD2 3.97Å; F225-F343 HydrophobicContact CZ-CE1 4.15Å; F225-F343 AromaticContact CZ-CE2 3.48Å; F225-F343 HydrophobicContact CZ-CE2 3.48Å; F225-F343 VanDerWaalsContact CZ-CE2 3.48Å; F225-F343 AromaticContact CZ-CZ 3.6Å; F225-F343 HydrophobicContact CZ-CZ 3.6Å; V229-F343 HydrophobicContact CG1-CZ 4.43Å; V229-F343 HydrophobicContact CG2-CE2 4.41Å; V229-F343 HydrophobicContact CG2-CZ 3.74Å; L232-F343 HydrophobicContact CD1-CE1 4.14Å; I313-F343 HydrophobicContact CG2-CD1 3.96Å; I313-F343 HydrophobicContact CG2-CE1 4.37Å; T316-F343 HydrophobicContact CG2-CE1 4.39Å; V317-F343 HydrophobicContact CG2-CB 3.86Å; V317-F343 HydrophobicContact CG2-CD1 4.15Å; V317-F343 WeakPolarHBondContact CG2-O 3.29Å; L321-F343 HydrophobicContact CD1-CB 3.99Å; L321-F343 HydrophobicContact CD1-CG 4.3Å; L339-F343 HydrophobicContact CD1-CD2 3.95Å; L339-F343 HydrophobicContact CD1-CE2 3.7Å; L339-F343 HydrophobicContact CG-CD2 4.13Å; L339-F343 HydrophobicContact CG-CE2 4.12Å; L339-F343 WeakPolarHBondContact O-CD2 3.3Å; L339-F343 PolarHBondContact O-N 2.95Å; M340-F343 PolarHBondContact O-N 3.4Å; T341-F343 VanDerWaalsContact C-N 3.26Å; T341-F343 PolarHBondContact O-N 2.91Å; F343-T345 PolarHBondContact O-N 3.06Å; F343-L346 PolarHBondContact O-N 2.93Å; F343-L353 HydrophobicContact CD1-CD1 4.02Å; F343-L353 HydrophobicContact CD2-CD1 4.39Å; F343-L353 HydrophobicContact CD2-CD2 3.82Å; F343-L353 HydrophobicContact CE1-CD1 3.74Å; F343-L353 HydrophobicContact CE2-CB 3.99Å; F343-L353 HydrophobicContact CE2-CD1 4.12Å; F343-L353 HydrophobicContact CE2-CD2 3.79Å; F343-L353 HydrophobicContact CE2-CG 4.18Å; F343-L353 HydrophobicContact CG-CD1 4.33Å; F343-L353 HydrophobicContact CG-CD2 4.33Å; F343-L353 HydrophobicContact CZ-CB 3.9Å; F343-L353 HydrophobicContact CZ-CD1 3.77Å; F343-L353 HydrophobicContact CZ-CD2 4.3Å; F343-L353 HydrophobicContact CZ-CG 4.2Å
344	R	95.1	Very high	96.7	Very high	113 Å²	113	40.5 Å²	40.5	43%	0.426	22%	0.216	S	C	.	.	H	α-helix	trans	-62.9	-40.7	-175.7	-73.3	174.5	-174.1	134.9	1.7	113.4	V317 L321 M340 T341 L346	V317-R344 HydrophobicContact CG1-CG 4.37Å; L321-R344 HydrophobicContact CD2-CG 3.39Å; L321-R344 VanDerWaalsContact CD2-NE 3.32Å; M340-R344 VanDerWaalsContact O-CG 3.3Å; M340-R344 WeakPolarHBondContact O-CG 3.47Å; M340-R344 PolarHBondContact O-N 3.14Å; T341-R344 PolarHBondContact O-N 3.14Å; T341-R344 VanDerWaalsContact O-N 3.1Å; R344-L346 VanDerWaalsContact C-N 3.25Å
345	T	94.3	Very high	96.9	Very high	57 Å²	57	41 Å²	41	35%	0.35	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.1	-179.7	61.7	0	0	0	0	112.8	T294 T341 F343 S347	T294-T345 PolarHBondContact N-O 3Å; T294-T345 VanDerWaalsContact N-O 3.16Å; T294-T345 PolarHBondContact OG1-O 3.17Å; T341-T345 HydrophobicContact CG2-CG2 4.15Å; T341-T345 PolarHBondContact O-N 3.36Å; T341-T345 PolarHBondContact O-OG1 2.78Å; F343-T345 PolarHBondContact O-N 3.06Å; T345-S347 VanDerWaalsContact C-N 3.31Å; T345-S347 PolarHBondContact O-N 3.33Å
346	L	95.4	Very high	97	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.037	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	56.4	-171.6	-63.2	101.3	0	0	0	110.3	I290 A293 T294 M295 A310 I313 S342 F343 R344	I290-L346 HydrophobicContact CB-CD1 4.45Å; I290-L346 HydrophobicContact CD1-CD2 3.98Å; I290-L346 HydrophobicContact CG2-CD1 3.99Å; I290-L346 HydrophobicContact CG2-CD2 4.46Å; A293-L346 HydrophobicContact CB-CB 3.98Å; A293-L346 HydrophobicContact CB-CD1 4.43Å; T294-L346 CarbonylContact C-O 3.21Å; T294-L346 PolarHBondContact N-O 2.68Å; T294-L346 PolarHBondContact OG1-O 3.37Å; M295-L346 WeakPolarHBondContact CA-O 3Å; M295-L346 WeakPolarHBondContact CB-O 3.47Å; M295-L346 PolarHBondContact N-O 3.27Å; A310-L346 HydrophobicContact CB-CD2 4.4Å; A310-L346 VanDerWaalsContact O-CD2 3.31Å; A310-L346 WeakPolarHBondContact O-CD2 3.45Å; I313-L346 HydrophobicContact CB-CD2 4.4Å; I313-L346 HydrophobicContact CG2-CD2 4.24Å; I313-L346 HydrophobicContact CG2-CG 4.39Å; S342-L346 WeakPolarHBondContact O-CA 3.48Å; S342-L346 PolarHBondContact O-N 2.99Å; F343-L346 PolarHBondContact O-N 2.93Å; R344-L346 VanDerWaalsContact C-N 3.25Å
347	S	94.8	Very high	97	Very high	45 Å²	45	41.4 Å²	41.4	32%	0.315	22%	0.216	S	C	.	.			trans	-93.4	-13.4	-175	63.3	0	0	0	0	114.5	T294 S342 T345	T294-S347 WeakPolarHBondContact OG1-CA 3.38Å; T294-S347 WeakPolarHBondContact OG1-CB 3.33Å; T294-S347 PolarHBondContact OG1-N 3.13Å; S342-S347 WeakPolarHBondContact CA-OG 3.48Å; S342-S347 PolarHBondContact O-N 3.37Å; T345-S347 VanDerWaalsContact C-N 3.31Å; T345-S347 PolarHBondContact O-N 3.33Å
348	L	96.5	Very high	97.1	Very high	51 Å²	51	41.8 Å²	41.8	27%	0.267	22%	0.218	S	C	.	.	S	Bend	trans	-135.1	144	-174.7	-66	177.6	0	0	0	110.7	L353 L356	L348-L353 HydrophobicContact CB-CD2 3.98Å; L348-L353 HydrophobicContact CB-CG 4.09Å; L348-L353 HydrophobicContact CD1-CD2 4.35Å; L348-L356 HydrophobicContact CD1-CD1 3.52Å
349	P	96.7	Very high	97.1	Very high	44 Å²	44	40.6 Å²	40.6	29%	0.286	21%	0.212	S	C	.	.			trans	-68.6	161.4	170.8	30.9	-35.7	0	0	0	111	M295 D309 S351 S352 L353	M295-P349 HydrophobicContact SD-CB 4.09Å; D309-P349 WeakPolarHBondContact OD2-CA 3.33Å; D309-P349 WeakPolarHBondContact OD2-CB 3.45Å; P349-S351 PolarHBondContact O-N 3.06Å; P349-S351 VanDerWaalsContact O-N 3.13Å; P349-S352 PolarHBondContact O-N 3.35Å; P349-L353 PolarHBondContact O-N 3.11Å
350	S	97.8	Very high	97.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-56.2	-33.8	-176.5	51.5	0	0	0	0	113.5	A236 D309 S352 L353 K354	A236-S350 WeakPolarHBondContact CB-OG 3.48Å; D309-S350 VanDerWaalsContact CG-OG 3.29Å; D309-S350 WeakPolarHBondContact OD1-CB 3.18Å; D309-S350 PolarHBondContact OD1-OG 3.32Å; D309-S350 PolarHBondContact OD2-N 3.48Å; D309-S350 PolarHBondContact OD2-OG 3.4Å; S350-S352 VanDerWaalsContact C-N 3.34Å; S350-S352 PolarHBondContact O-N 3.36Å; S350-L353 PolarHBondContact O-N 3.23Å; S350-K354 WeakPolarHBondContact O-CB 3.18Å; S350-K354 PolarHBondContact O-N 3.25Å
351	S	97.5	Very high	97.1	Very high	44 Å²	44	41 Å²	41	31%	0.308	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-38.7	175.7	62.2	0	0	0	0	113.6	D233 P349 R355	D233-S351 WeakPolarHBondContact OD1-CA 3.41Å; D233-S351 VanDerWaalsContact OD1-CB 3.26Å; D233-S351 WeakPolarHBondContact OD1-CB 3.5Å; P349-S351 PolarHBondContact O-N 3.06Å; P349-S351 VanDerWaalsContact O-N 3.13Å; S351-R355 PolarHBondContact O-N 3.33Å
352	S	97.9	Very high	97.1	Very high	18 Å²	18	43.2 Å²	43.2	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-76.5	-37.1	176.5	-68.6	0	0	0	0	111.5	P349 S350 K354 R355 L356	P349-S352 PolarHBondContact O-N 3.35Å; S350-S352 VanDerWaalsContact C-N 3.34Å; S350-S352 PolarHBondContact O-N 3.36Å; S352-K354 VanDerWaalsContact C-N 3.31Å; S352-K354 PolarHBondContact O-N 2.87Å; S352-R355 PolarHBondContact O-N 3.12Å; S352-R355 PolarHBondContact OG-NH2 3.14Å; S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 2.9Å
353	L	98.3	Very high	97	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-37.7	172.6	-64.3	172.3	0	0	0	111.7	V229 I313 L339 F343 L348 P349 S350 L356 T357	V229-L353 HydrophobicContact CG1-CB 4.15Å; I313-L353 HydrophobicContact CD1-CD1 3.85Å; I313-L353 HydrophobicContact CG1-CD1 4.07Å; I313-L353 HydrophobicContact CG2-CD1 4.02Å; L339-L353 HydrophobicContact CD1-CD2 4.39Å; F343-L353 HydrophobicContact CD1-CD1 4.02Å; F343-L353 HydrophobicContact CD2-CD1 4.39Å; F343-L353 HydrophobicContact CD2-CD2 3.82Å; F343-L353 HydrophobicContact CE1-CD1 3.74Å; F343-L353 HydrophobicContact CE2-CB 3.99Å; F343-L353 HydrophobicContact CE2-CD1 4.12Å; F343-L353 HydrophobicContact CE2-CD2 3.79Å; F343-L353 HydrophobicContact CE2-CG 4.18Å; F343-L353 HydrophobicContact CG-CD1 4.33Å; F343-L353 HydrophobicContact CG-CD2 4.33Å; F343-L353 HydrophobicContact CZ-CB 3.9Å; F343-L353 HydrophobicContact CZ-CD1 3.77Å; F343-L353 HydrophobicContact CZ-CD2 4.3Å; F343-L353 HydrophobicContact CZ-CG 4.2Å; L348-L353 HydrophobicContact CB-CD2 3.98Å; L348-L353 HydrophobicContact CB-CG 4.09Å; L348-L353 HydrophobicContact CD1-CD2 4.35Å; P349-L353 PolarHBondContact O-N 3.11Å; S350-L353 PolarHBondContact O-N 3.23Å; L353-L356 PolarHBondContact O-N 3.34Å; L353-T357 WeakPolarHBondContact O-CB 3.42Å; L353-T357 PolarHBondContact O-N 3.36Å; L353-T357 PolarHBondContact O-OG1 3.32Å
354	K	98.5	Very high	96.9	Very high	61 Å²	61	45.2 Å²	45.2	27%	0.265	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-46.3	173.6	-173.4	-175.8	62.6	174.1	0	111.3	V229 D233 S350 S352 T357 N358	V229-K354 HydrophobicContact CG1-CB 3.82Å; V229-K354 HydrophobicContact CG1-CG 4.48Å; V229-K354 VanDerWaalsContact CG1-N 3.32Å; D233-K354 HydrophobicContact CB-CB 4.26Å; D233-K354 HydrophobicContact CB-CD 3.79Å; D233-K354 VanDerWaalsContact CG-CE 3.45Å; D233-K354 IonicContact OD1-NZ 3.08Å; D233-K354 PolarHBondContact OD1-NZ 3.01Å; D233-K354 VanDerWaalsContact OD2-CE 3.31Å; D233-K354 WeakPolarHBondContact OD2-CE 3.44Å; D233-K354 IonicContact OD2-NZ 2.65Å; D233-K354 PolarHBondContact OD2-NZ 3.34Å; S350-K354 WeakPolarHBondContact O-CB 3.18Å; S350-K354 PolarHBondContact O-N 3.25Å; S352-K354 VanDerWaalsContact C-N 3.31Å; S352-K354 PolarHBondContact O-N 2.87Å; K354-T357 PolarHBondContact O-N 3.03Å; K354-N358 PolarHBondContact O-N 2.88Å; K354-N358 PolarHBondContact O-ND2 3.26Å
355	R	98.5	Very high	97	Very high	136 Å²	136	41 Å²	41	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-58.7	-52.8	175.6	-178.8	175	54.2	-122.9	-11	111.3	S351 S352 T357 N358 D359	S351-R355 PolarHBondContact O-N 3.33Å; S352-R355 PolarHBondContact O-N 3.12Å; S352-R355 PolarHBondContact OG-NH2 3.14Å; R355-T357 PolarHBondContact O-N 3.47Å; R355-N358 WeakPolarHBondContact O-CB 3.38Å; R355-N358 PolarHBondContact O-N 3.49Å; R355-N358 VanDerWaalsContact O-N 3.1Å; R355-D359 PolarHBondContact O-N 2.83Å
356	L	98.3	Very high	96.9	Very high	57 Å²	57	41.3 Å²	41.3	30%	0.298	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-35.8	178.7	-68.1	179.4	0	0	0	113.1	L339 L348 S352 L353 L360	L339-L356 HydrophobicContact CD1-CB 3.81Å; L339-L356 HydrophobicContact CD1-CD1 4.35Å; L348-L356 HydrophobicContact CD1-CD1 3.52Å; S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 2.9Å; L353-L356 PolarHBondContact O-N 3.34Å; L356-L360 WeakPolarHBondContact O-CB 3.31Å; L356-L360 PolarHBondContact O-N 2.65Å
357	T	98.4	Very high	96.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-71.7	-39.9	177.9	-54.9	0	0	0	0	111.2	F225 L226 V229 L353 K354 R355 L360 V361	F225-T357 HydrophobicContact CD1-CG2 4.06Å; F225-T357 HydrophobicContact CE1-CG2 4.43Å; L226-T357 HydrophobicContact CB-CG2 4.32Å; L226-T357 HydrophobicContact CD1-CG2 3.87Å; V229-T357 HydrophobicContact CG2-CG2 4.28Å; L353-T357 WeakPolarHBondContact O-CB 3.42Å; L353-T357 PolarHBondContact O-N 3.36Å; L353-T357 PolarHBondContact O-OG1 3.32Å; K354-T357 PolarHBondContact O-N 3.03Å; R355-T357 PolarHBondContact O-N 3.47Å; T357-L360 WeakPolarHBondContact O-CB 3.26Å; T357-L360 PolarHBondContact O-N 3.02Å; T357-V361 VanDerWaalsContact O-CG2 3.24Å; T357-V361 WeakPolarHBondContact O-CG2 3.42Å; T357-V361 PolarHBondContact O-N 3.14Å
358	N	98.4	Very high	96.2	Very high	59 Å²	59	45.6 Å²	45.6	32%	0.316	24%	0.236	S	C	.	.	H	α-helix	trans	-62.7	-43.3	172.6	-74.1	-30.8	0	0	0	111.3	L226 K354 R355 L360 V361 E362	L226-N358 WeakPolarHBondContact CD1-OD1 3.03Å; K354-N358 PolarHBondContact O-N 2.88Å; K354-N358 PolarHBondContact O-ND2 3.26Å; R355-N358 WeakPolarHBondContact O-CB 3.38Å; R355-N358 PolarHBondContact O-N 3.49Å; R355-N358 VanDerWaalsContact O-N 3.1Å; N358-L360 VanDerWaalsContact C-N 3.29Å; N358-L360 PolarHBondContact O-N 3.44Å; N358-V361 WeakPolarHBondContact O-CB 3.14Å; N358-V361 PolarHBondContact O-N 3.07Å; N358-V361 VanDerWaalsContact O-N 3.11Å; N358-E362 WeakPolarHBondContact O-CB 3.02Å; N358-E362 PolarHBondContact O-N 2.83Å
359	D	97.5	Very high	95.5	Very high	64 Å²	64	44.6 Å²	44.6	34%	0.342	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-39.4	177.3	-59	-18.2	0	0	0	111.1	R355 E362 N363	R355-D359 PolarHBondContact O-N 2.83Å; D359-E362 PolarHBondContact O-N 2.77Å; D359-N363 WeakPolarHBondContact O-CB 3.38Å; D359-N363 PolarHBondContact O-N 3.21Å; D359-N363 PolarHBondContact O-ND2 3.09Å
360	L	97.5	Very high	94.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-44	173.3	173.4	63.7	0	0	0	111.7	W218 L222 L332 Q335 V336 L339 L356 T357 N358 Y364	W218-L360 HydrophobicContact CH2-CD1 4.27Å; L222-L360 HydrophobicContact CD1-CD2 3.75Å; L222-L360 HydrophobicContact CD1-CG 4.22Å; L332-L360 HydrophobicContact CB-CD1 4.44Å; L332-L360 HydrophobicContact CD1-CD1 4.2Å; L332-L360 HydrophobicContact CD2-CD1 4.22Å; Q335-L360 HydrophobicContact CB-CD1 4.39Å; Q335-L360 HydrophobicContact CG-CB 4.47Å; Q335-L360 HydrophobicContact CG-CD1 4.13Å; V336-L360 HydrophobicContact CG2-CD1 3.84Å; V336-L360 HydrophobicContact CG2-CD2 3.88Å; L339-L360 HydrophobicContact CD2-CD2 3.89Å; L356-L360 WeakPolarHBondContact O-CB 3.31Å; L356-L360 PolarHBondContact O-N 2.65Å; T357-L360 WeakPolarHBondContact O-CB 3.26Å; T357-L360 PolarHBondContact O-N 3.02Å; N358-L360 VanDerWaalsContact C-N 3.29Å; N358-L360 PolarHBondContact O-N 3.44Å; L360-Y364 WeakPolarHBondContact O-CB 3.36Å; L360-Y364 PolarHBondContact O-N 3.14Å
361	V	97.7	Very high	93.3	Very high	18 Å²	18	48.6 Å²	48.6	11%	0.109	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-43.5	177.7	170.1	0	0	0	0	111	L222 L226 T357 N358 Y364 A365 W437 T438	L222-V361 HydrophobicContact CD1-CG2 4.1Å; L222-V361 HydrophobicContact CD2-CG2 3.79Å; L222-V361 HydrophobicContact CG-CG2 3.85Å; L226-V361 HydrophobicContact CD2-CG2 4.1Å; T357-V361 VanDerWaalsContact O-CG2 3.24Å; T357-V361 WeakPolarHBondContact O-CG2 3.42Å; T357-V361 PolarHBondContact O-N 3.14Å; N358-V361 WeakPolarHBondContact O-CB 3.14Å; N358-V361 PolarHBondContact O-N 3.07Å; N358-V361 VanDerWaalsContact O-N 3.11Å; V361-Y364 PolarHBondContact O-N 3.44Å; V361-A365 VanDerWaalsContact O-CB 3.23Å; V361-A365 WeakPolarHBondContact O-CB 3.26Å; V361-A365 PolarHBondContact O-N 2.87Å; V361-W437 HydrophobicContact CB-CH2 4.42Å; V361-W437 HydrophobicContact CG1-CH2 3.54Å; V361-W437 HydrophobicContact CG1-CZ3 3.81Å; V361-W437 HydrophobicContact CG2-CH2 3.94Å; V361-T438 HydrophobicContact CG1-CG2 4.43Å
362	E	96.7	Very high	91.3	Very high	114 Å²	114	54 Å²	54	53%	0.533	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-45.8	177.9	-176.5	175.7	177.3	0	0	111.6	N358 D359 Y364 A365 T366	N358-E362 WeakPolarHBondContact O-CB 3.02Å; N358-E362 PolarHBondContact O-N 2.83Å; D359-E362 PolarHBondContact O-N 2.77Å; E362-Y364 VanDerWaalsContact C-N 3.27Å; E362-Y364 PolarHBondContact O-N 3.17Å; E362-A365 PolarHBondContact O-N 3.35Å; E362-T366 HydrophobicContact CG-CG2 4.24Å; E362-T366 WeakPolarHBondContact O-CB 3.34Å; E362-T366 VanDerWaalsContact O-CG2 3.31Å; E362-T366 WeakPolarHBondContact O-CG2 3.33Å; E362-T366 PolarHBondContact O-N 3.31Å; E362-T366 PolarHBondContact O-OG1 2.76Å
363	N	94.9	Very high	89.3	Confident	46 Å²	46	63.7 Å²	63.7	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-43.1	174.8	-76.1	-13.8	0	0	0	111.2	L332 Q335 D359 T366 G367 Q368 Y369	L332-N363 HydrophobicContact CD2-CB 4.26Å; Q335-N363 PolarHBondContact NE2-ND2 3.31Å; Q335-N363 PolarHBondContact OE1-ND2 3.37Å; D359-N363 WeakPolarHBondContact O-CB 3.38Å; D359-N363 PolarHBondContact O-N 3.21Å; D359-N363 PolarHBondContact O-ND2 3.09Å; N363-T366 PolarHBondContact O-OG1 3.43Å; N363-G367 PolarHBondContact O-N 3.1Å; N363-G367 VanDerWaalsContact O-N 3.09Å; N363-Q368 PolarHBondContact O-N 3.06Å; N363-Y369 WeakPolarHBondContact O-CD1 3.49Å
364	Y	95.4	Very high	87.3	Confident	15 Å²	15	67.2 Å²	67.2	6%	0.059	32%	0.316	C	S	.	.	H	α-helix	trans	-64.6	-48.4	176.4	-177.9	-105.4	0	0	0	112.1	W218 E219 L222 P329 L332 L360 V361 E362 T366 G367 Y369 S409 T438 R440	W218-Y364 HydrophobicContact CE3-CD2 4.16Å; W218-Y364 AromaticContact CE3-CE2 3.9Å; W218-Y364 HydrophobicContact CE3-CE2 3.9Å; W218-Y364 HydrophobicContact CH2-CD2 4.18Å; W218-Y364 HydrophobicContact CH2-CG 4.35Å; W218-Y364 HydrophobicContact CZ3-CD1 4.13Å; W218-Y364 AromaticContact CZ3-CD2 3.36Å; W218-Y364 HydrophobicContact CZ3-CD2 3.36Å; W218-Y364 HydrophobicContact CZ3-CE1 4.34Å; W218-Y364 AromaticContact CZ3-CE2 3.59Å; W218-Y364 HydrophobicContact CZ3-CE2 3.59Å; W218-Y364 AromaticContact CZ3-CG 3.63Å; W218-Y364 HydrophobicContact CZ3-CG 3.63Å; E219-Y364 HydrophobicContact CB-CE1 3.74Å; E219-Y364 HydrophobicContact CG-CD1 4.49Å; E219-Y364 HydrophobicContact CG-CE1 3.65Å; L222-Y364 HydrophobicContact CD2-CD1 4.47Å; P329-Y364 HydrophobicContact CG-CD2 4.33Å; P329-Y364 HydrophobicContact CG-CE2 4.01Å; L332-Y364 HydrophobicContact CD1-CD2 3.71Å; L332-Y364 HydrophobicContact CD1-CG 4.31Å; L360-Y364 WeakPolarHBondContact O-CB 3.36Å; L360-Y364 PolarHBondContact O-N 3.14Å; V361-Y364 PolarHBondContact O-N 3.44Å; E362-Y364 VanDerWaalsContact C-N 3.27Å; E362-Y364 PolarHBondContact O-N 3.17Å; Y364-T366 PolarHBondContact O-N 3.35Å; Y364-G367 PolarHBondContact O-N 3.5Å; Y364-Y369 AromaticContact CD2-CE1 3.77Å; Y364-Y369 HydrophobicContact CD2-CE1 3.77Å; Y364-Y369 HydrophobicContact CE2-CE1 4.48Å; Y364-Y369 HydrophobicContact CG-CE1 4.45Å; Y364-S409 PolarHBondContact OH-OG 3.05Å; Y364-T438 HydrophobicContact CD1-CG2 4.22Å; Y364-R440 PolarHBondContact O-NH1 2.88Å
365	A	95.6	Very high	85	Confident	25 Å²	25	72.5 Å²	72.5	21%	0.207	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-47.9	-179.2	0	0	0	0	0	112.1	V361 E362 R440	V361-A365 VanDerWaalsContact O-CB 3.23Å; V361-A365 WeakPolarHBondContact O-CB 3.26Å; V361-A365 PolarHBondContact O-N 2.87Å; E362-A365 PolarHBondContact O-N 3.35Å; A365-R440 WeakPolarHBondContact O-CG 3.48Å
366	T	93.3	Very high	82.8	Confident	62 Å²	62	72.9 Å²	72.9	38%	0.38	35%	0.345	S	S	.	.	H	α-helix	trans	-78	-20	-176.3	58.1	0	0	0	0	113.4	E362 N363 Y364 Q368	E362-T366 HydrophobicContact CG-CG2 4.24Å; E362-T366 WeakPolarHBondContact O-CB 3.34Å; E362-T366 VanDerWaalsContact O-CG2 3.31Å; E362-T366 WeakPolarHBondContact O-CG2 3.33Å; E362-T366 PolarHBondContact O-N 3.31Å; E362-T366 PolarHBondContact O-OG1 2.76Å; N363-T366 PolarHBondContact O-OG1 3.43Å; Y364-T366 PolarHBondContact O-N 3.35Å; T366-Q368 PolarHBondContact O-N 3.42Å; T366-Q368 WeakPolarHBondContact OG1-CG 3.3Å; T366-Q368 PolarHBondContact OG1-N 3.29Å
367	G	90.4	Very high	80.7	Confident	5 Å²	5	75.3 Å²	75.3	5%	0.052	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	17.4	-174.1	0	0	0	0	0	113.7	N363 Y364 Y369 F370	N363-G367 PolarHBondContact O-N 3.1Å; N363-G367 VanDerWaalsContact O-N 3.09Å; Y364-G367 PolarHBondContact O-N 3.5Å; G367-Y369 PolarHBondContact O-N 2.96Å; G367-Y369 VanDerWaalsContact O-N 3.12Å; G367-F370 VanDerWaalsContact O-CB 3.23Å; G367-F370 WeakPolarHBondContact O-CB 3.11Å; G367-F370 PolarHBondContact O-N 3.17Å
368	Q	85.1	Confident	78.8	Confident	137 Å²	137	76.1 Å²	76.1	64%	0.64	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.1	178.4	-76.9	-178.7	30.3	0	0	113.1	N363 T366 F370	N363-Q368 PolarHBondContact O-N 3.06Å; T366-Q368 PolarHBondContact O-N 3.42Å; T366-Q368 WeakPolarHBondContact OG1-CG 3.3Å; T366-Q368 PolarHBondContact OG1-N 3.29Å; Q368-F370 PolarHBondContact O-N 3.37Å
369	Y	82	Confident	77	Confident	30 Å²	30	78.3 Å²	78.3	12%	0.118	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-22.7	172.7	64.7	-102.7	0	0	0	113.4	S331 L332 N363 Y364 G367 N371 E415 R440	S331-Y369 WeakPolarHBondContact CB-O 3.5Å; S331-Y369 WeakPolarHBondContact OG-CD2 3.27Å; L332-Y369 HydrophobicContact CD1-CD1 3.9Å; L332-Y369 HydrophobicContact CD1-CE1 4.15Å; L332-Y369 HydrophobicContact CD1-CG 4.37Å; L332-Y369 HydrophobicContact CD2-CD1 3.87Å; L332-Y369 HydrophobicContact CD2-CG 3.94Å; L332-Y369 HydrophobicContact CG-CD1 3.91Å; L332-Y369 HydrophobicContact CG-CG 3.92Å; N363-Y369 WeakPolarHBondContact O-CD1 3.49Å; Y364-Y369 AromaticContact CD2-CE1 3.77Å; Y364-Y369 HydrophobicContact CD2-CE1 3.77Å; Y364-Y369 HydrophobicContact CE2-CE1 4.48Å; Y364-Y369 HydrophobicContact CG-CE1 4.45Å; G367-Y369 PolarHBondContact O-N 2.96Å; G367-Y369 VanDerWaalsContact O-N 3.12Å; Y369-N371 PolarHBondContact O-N 2.96Å; Y369-N371 VanDerWaalsContact O-N 3.1Å; Y369-E415 PolarHBondContact OH-OE1 3.36Å; Y369-R440 PolarHBondContact OH-NH1 3.37Å; Y369-R440 PolarHBondContact OH-NH2 3.02Å
370	F	78.8	Confident	76.4	Confident	26 Å²	26	76.4 Å²	76.4	11%	0.114	38%	0.376	C	S	.	.	S	Bend	trans	-83.8	87.1	-175	-163.4	-96.6	0	0	0	109.4	G367 Q368 M374 H414 E415 Y418	G367-F370 VanDerWaalsContact O-CB 3.23Å; G367-F370 WeakPolarHBondContact O-CB 3.11Å; G367-F370 PolarHBondContact O-N 3.17Å; Q368-F370 PolarHBondContact O-N 3.37Å; F370-M374 HydrophobicContact CD2-SD 4.06Å; F370-M374 HydrophobicContact CE1-CB 4.1Å; F370-M374 HydrophobicContact CE1-SD 4.37Å; F370-M374 HydrophobicContact CE2-SD 3.37Å; F370-M374 WeakPolarHBondContact CE2-SD 3.38Å; F370-M374 HydrophobicContact CZ-CB 3.87Å; F370-M374 HydrophobicContact CZ-CG 4.34Å; F370-M374 HydrophobicContact CZ-SD 3.53Å; F370-M374 VanDerWaalsContact CZ-SD 3.53Å; F370-H414 AromaticContact CD1-CD2 3.93Å; F370-H414 AromaticContact CE1-CD2 3.55Å; F370-H414 AromaticContact CE1-NE2 3.62Å; F370-E415 HydrophobicContact CD1-CB 4.43Å; F370-E415 HydrophobicContact CD2-CG 4.19Å; F370-E415 HydrophobicContact CE2-CG 4.35Å; F370-E415 HydrophobicContact CG-CB 4.44Å; F370-Y418 AromaticContact CE2-CD1 3.35Å; F370-Y418 HydrophobicContact CE2-CD1 3.35Å; F370-Y418 HydrophobicContact CE2-CD2 4.49Å; F370-Y418 AromaticContact CE2-CE1 3.81Å; F370-Y418 HydrophobicContact CE2-CE1 3.81Å; F370-Y418 AromaticContact CE2-CG 3.74Å; F370-Y418 HydrophobicContact CE2-CG 3.74Å; F370-Y418 VanDerWaalsContact CZ-CB 3.41Å; F370-Y418 AromaticContact CZ-CD1 3.53Å; F370-Y418 HydrophobicContact CZ-CD1 3.53Å; F370-Y418 HydrophobicContact CZ-CD2 4.02Å; F370-Y418 HydrophobicContact CZ-CE1 4.27Å; F370-Y418 AromaticContact CZ-CG 3.37Å; F370-Y418 HydrophobicContact CZ-CG 3.37Å
371	N	69.2	Low	76.2	Confident	103 Å²	103	77.7 Å²	77.7	55%	0.551	38%	0.381	S	S	*	.			trans	-68.7	147.8	-169.7	-161.1	-11.8	0	0	0	113.2	Y369 R373 M374	Y369-N371 PolarHBondContact O-N 2.96Å; Y369-N371 VanDerWaalsContact O-N 3.1Å; N371-R373 PolarHBondContact O-N 3.14Å; N371-M374 PolarHBondContact O-N 3.16Å
372	K	55.1	Low	76.1	Confident	159 Å²	159	79.5 Å²	79.5	69%	0.691	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-54.9	-18.3	-179.5	-67.4	176.8	-179.1	173.5	0	114.7	M374 R375	K372-M374 PolarHBondContact O-N 3.42Å; K372-R375 WeakPolarHBondContact O-CB 3.5Å; K372-R375 WeakPolarHBondContact O-CD 3.26Å; K372-R375 WeakPolarHBondContact O-CG 3.33Å; K372-R375 PolarHBondContact O-N 3.25Å; K372-R375 VanDerWaalsContact O-N 3.14Å
373	R	55.5	Low	76	Confident	221 Å²	221	79.2 Å²	79.2	83%	0.834	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-69.3	-15.6	178.9	-73.3	-173.9	176.8	177.4	-0.5	113.8	N371 R375	N371-R373 PolarHBondContact O-N 3.14Å; R373-R375 PolarHBondContact O-N 2.81Å
374	M	55.8	Low	76.1	Confident	73 Å²	73	81.9 Å²	81.9	36%	0.36	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-80.8	2.2	171	-70.3	174.1	174	0	0	113.5	F370 N371 K372 I376 Y418	F370-M374 HydrophobicContact CD2-SD 4.06Å; F370-M374 HydrophobicContact CE1-CB 4.1Å; F370-M374 HydrophobicContact CE1-SD 4.37Å; F370-M374 HydrophobicContact CE2-SD 3.37Å; F370-M374 WeakPolarHBondContact CE2-SD 3.38Å; F370-M374 HydrophobicContact CZ-CB 3.87Å; F370-M374 HydrophobicContact CZ-CG 4.34Å; F370-M374 HydrophobicContact CZ-SD 3.53Å; F370-M374 VanDerWaalsContact CZ-SD 3.53Å; N371-M374 PolarHBondContact O-N 3.16Å; K372-M374 PolarHBondContact O-N 3.42Å; M374-I376 VanDerWaalsContact C-N 3.26Å; M374-I376 PolarHBondContact O-N 2.89Å; M374-Y418 HydrophobicContact CB-CD2 4.07Å; M374-Y418 HydrophobicContact CB-CE2 4.25Å; M374-Y418 HydrophobicContact CE-CE1 4.27Å; M374-Y418 HydrophobicContact CE-CE2 3.99Å; M374-Y418 VanDerWaalsContact CE-OH 3.24Å; M374-Y418 WeakPolarHBondContact CE-OH 3.44Å; M374-Y418 HydrophobicContact CG-CD2 4.16Å; M374-Y418 HydrophobicContact CG-CE2 3.83Å; M374-Y418 HydrophobicContact SD-CD1 4.33Å; M374-Y418 HydrophobicContact SD-CD2 4.01Å; M374-Y418 HydrophobicContact SD-CE1 3.92Å; M374-Y418 HydrophobicContact SD-CE2 3.56Å; M374-Y418 VanDerWaalsContact SD-CE2 3.56Å; M374-Y418 HydrophobicContact SD-CG 4.36Å; M374-Y418 VanDerWaalsContact SD-CZ 3.51Å
375	R	51.7	Low	76.2	Confident	172 Å²	172	86.3 Å²	86.3	65%	0.649	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24	178.5	-84.9	175.5	128.8	176.3	-2.6	115	K372 R373 E377	K372-R375 WeakPolarHBondContact O-CB 3.5Å; K372-R375 WeakPolarHBondContact O-CD 3.26Å; K372-R375 WeakPolarHBondContact O-CG 3.33Å; K372-R375 PolarHBondContact O-N 3.25Å; K372-R375 VanDerWaalsContact O-N 3.14Å; R373-R375 PolarHBondContact O-N 2.81Å; R375-E377 VanDerWaalsContact C-N 3.31Å; R375-E377 PolarHBondContact O-N 3.31Å
376	I	52.1	Low	76.2	Confident	145 Å²	145	89.1 Å²	89.1	74%	0.744	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-73.2	-21.7	-165.3	-58.4	178.1	0	0	0	112.6	M374	M374-I376 VanDerWaalsContact C-N 3.26Å; M374-I376 PolarHBondContact O-N 2.89Å
377	E	53.3	Low	76.4	Confident	107 Å²	107	86.6 Å²	86.6	50%	0.5	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-109.4	5.7	-175.1	-74.2	-173.7	147.1	0	0	115.6	R375	R375-E377 VanDerWaalsContact C-N 3.31Å; R375-E377 PolarHBondContact O-N 3.31Å
378	S	58.1	Low	76.8	Confident	18 Å²	18	88.1 Å²	88.1	13%	0.126	42%	0.422	C	S	.	.			trans	-87.8	-0.3	-177.7	-56	0	0	0	0	114.9	H414	S378-H414 PolarHBondContact OG-CE1 3.37Å; S378-H414 PolarHBondContact OG-ND1 2.89Å
379	S	62.1	Low	77.3	Confident	104 Å²	104	81.6 Å²	81.6	73%	0.727	39%	0.392	S	S	*	.			trans	-75.9	118.7	169.4	55.3	0	0	0	0	108.8
380	G	84.9	Confident	77.9	Confident	24 Å²	24	83.3 Å²	83.3	25%	0.247	41%	0.406	C	S	.	.			trans	140	32.4	-179	0	0	0	0	0	114.3	K463 L464	G380-K463 CarbonylContact O-C 3.6Å; G380-K463 WeakPolarHBondContact O-CA 3.34Å; G380-L464 WeakPolarHBondContact O-CB 3.09Å; G380-L464 PolarHBondContact O-N 2.84Å
381	F	92.9	Very high	78.5	Confident	27 Å²	27	87.4 Å²	87.4	12%	0.118	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.5	175.3	-74.6	-97.2	0	0	0	111	K417 C420 I429 V462 K463	F381-K417 HydrophobicContact CB-CD 4.44Å; F381-K417 HydrophobicContact CD1-CG 4.49Å; F381-K417 HydrophobicContact CD2-CB 4.13Å; F381-K417 HydrophobicContact CD2-CD 3.84Å; F381-K417 HydrophobicContact CD2-CG 3.72Å; F381-K417 HydrophobicContact CE2-CB 3.8Å; F381-K417 HydrophobicContact CE2-CD 4.38Å; F381-K417 HydrophobicContact CE2-CG 3.84Å; F381-K417 HydrophobicContact CG-CD 4.23Å; F381-K417 HydrophobicContact CG-CG 4.07Å; F381-K417 HydrophobicContact CZ-CB 4.3Å; F381-K417 HydrophobicContact CZ-CG 4.28Å; F381-C420 HydrophobicContact CE1-CB 4.36Å; F381-C420 HydrophobicContact CZ-CB 4Å; F381-I429 HydrophobicContact CD1-CD1 4.47Å; F381-I429 HydrophobicContact CE1-CD1 3.87Å; F381-I429 HydrophobicContact CE1-CG1 4.24Å; F381-I429 HydrophobicContact CZ-CD1 4.29Å; F381-V462 CarbonylContact C-O 3.52Å; F381-V462 WeakPolarHBondContact CA-O 3.5Å; F381-K463 HydrophobicContact CD1-CB 4.18Å; F381-K463 HydrophobicContact CE1-CB 3.68Å; F381-K463 HydrophobicContact CE1-CG 4.15Å; F381-K463 HydrophobicContact CE2-CG 4.39Å; F381-K463 HydrophobicContact CZ-CB 3.99Å; F381-K463 HydrophobicContact CZ-CD 4.36Å; F381-K463 HydrophobicContact CZ-CG 3.92Å
382	V	94.6	Very high	79.7	Confident	56 Å²	56	85.1 Å²	85.1	34%	0.339	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.8	171.1	178.1	0	0	0	0	109.2	Y384 Y461 V462 L464	V382-Y384 HydrophobicContact CB-CE2 4.17Å; V382-Y384 HydrophobicContact CG1-CD2 4.37Å; V382-Y384 HydrophobicContact CG1-CE2 3.74Å; V382-Y461 CarbonylContact O-C 3.58Å; V382-Y461 WeakPolarHBondContact O-CA 3.36Å; V382-V462 PolarHBondContact N-O 3.32Å; V382-V462 PolarHBondContact O-N 3.47Å; V382-L464 HydrophobicContact CG2-CD1 4.04Å; V382-L464 HydrophobicContact CG2-CD2 3.55Å; V382-L464 HydrophobicContact CG2-CG 3.91Å
383	K	95.7	Very high	81.7	Confident	109 Å²	109	79.7 Å²	79.7	47%	0.474	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.8	-179.2	-177	-175.8	-179.2	-176.3	0	110.4	L385 V460 Y461	K383-L385 HydrophobicContact CD-CD2 4.43Å; K383-V460 CarbonylContact C-O 3.51Å; K383-V460 WeakPolarHBondContact CA-O 3.45Å; K383-Y461 HydrophobicContact CB-CD1 3.95Å; K383-Y461 HydrophobicContact CB-CE1 3.8Å; K383-Y461 HydrophobicContact CD-CE1 3.73Å; K383-Y461 WeakPolarHBondContact CE-OH 3.07Å; K383-Y461 HydrophobicContact CG-CD1 4.1Å; K383-Y461 HydrophobicContact CG-CE1 3.62Å
384	Y	96.8	Very high	83.6	Confident	102 Å²	102	72 Å²	72	40%	0.4	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	112.6	168.4	-63.7	-93.4	0	0	0	108.3	V382 F449 A459 V460 V462	V382-Y384 HydrophobicContact CB-CE2 4.17Å; V382-Y384 HydrophobicContact CG1-CD2 4.37Å; V382-Y384 HydrophobicContact CG1-CE2 3.74Å; Y384-F449 HydrophobicContact CD1-CE1 4.27Å; Y384-F449 AromaticContact CD1-CZ 3.92Å; Y384-F449 HydrophobicContact CD1-CZ 3.92Å; Y384-F449 AromaticContact CD2-CE1 3.95Å; Y384-F449 HydrophobicContact CD2-CE1 3.95Å; Y384-F449 HydrophobicContact CD2-CE2 4.32Å; Y384-F449 AromaticContact CD2-CZ 3.67Å; Y384-F449 HydrophobicContact CD2-CZ 3.67Å; Y384-F449 AromaticContact CE1-CE1 3.98Å; Y384-F449 HydrophobicContact CE1-CE1 3.98Å; Y384-F449 HydrophobicContact CE1-CZ 4.11Å; Y384-F449 HydrophobicContact CE2-CD1 4.35Å; Y384-F449 AromaticContact CE2-CE1 3.64Å; Y384-F449 HydrophobicContact CE2-CE1 3.64Å; Y384-F449 AromaticContact CE2-CZ 3.88Å; Y384-F449 HydrophobicContact CE2-CZ 3.88Å; Y384-F449 HydrophobicContact CG-CE1 4.25Å; Y384-F449 HydrophobicContact CG-CE2 4.45Å; Y384-F449 AromaticContact CG-CZ 3.69Å; Y384-F449 HydrophobicContact CG-CZ 3.69Å; Y384-F449 AromaticContact CZ-CE1 3.65Å; Y384-A459 CarbonylContact O-C 3.04Å; Y384-A459 WeakPolarHBondContact O-CA 3.16Å; Y384-V460 PolarHBondContact N-O 3.31Å; Y384-V460 PolarHBondContact O-N 3.15Å; Y384-V462 HydrophobicContact CD2-CG2 3.69Å; Y384-V462 HydrophobicContact CE2-CB 4.09Å; Y384-V462 HydrophobicContact CE2-CG2 3.56Å
385	L	96.6	Very high	85.5	Confident	107 Å²	107	70.2 Å²	70.2	56%	0.56	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	150.8	175	-76.4	169.2	0	0	0	110.4	K383 A387	K383-L385 HydrophobicContact CD-CD2 4.43Å; L385-A387 PolarHBondContact O-N 2.92Å
386	H	96.9	Very high	87.5	Confident	84 Å²	84	66.5 Å²	66.5	39%	0.389	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.6	40.6	175.6	-48.3	-59.4	0	0	0	113.8	Y454 S455 P456 T458	H386-Y454 HydrophobicContact CB-CD2 3.95Å; H386-Y454 HydrophobicContact CB-CE2 3.49Å; H386-Y454 VanDerWaalsContact CB-CE2 3.49Å; H386-Y454 CarbonylContact O-C 3.6Å; H386-Y454 WeakPolarHBondContact O-CA 3.45Å; H386-Y454 WeakPolarHBondContact O-CD2 3.38Å; H386-S455 CarbonylContact C-O 3.53Å; H386-S455 WeakPolarHBondContact CA-O 3.38Å; H386-S455 PolarHBondContact O-N 2.87Å; H386-P456 PolarHBondContact ND1-O 3.16Å; H386-T458 VanDerWaalsContact CA-O 3.31Å; H386-T458 WeakPolarHBondContact CA-O 3.43Å; H386-T458 PolarHBondContact N-O 2.93Å; H386-T458 VanDerWaalsContact N-O 3.15Å
387	A	97.5	Very high	89.3	Confident	10 Å²	10	61 Å²	61	8%	0.083	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145	-175.1	0	0	0	0	0	110.6	L385 V453 T458 V460	L385-A387 PolarHBondContact O-N 2.92Å; A387-V453 CarbonylContact C-O 3.46Å; A387-V453 WeakPolarHBondContact CA-O 3.34Å; A387-T458 PolarHBondContact N-O 3.3Å; A387-T458 CarbonylContact O-C 3.57Å; A387-T458 WeakPolarHBondContact O-CB 3.29Å; A387-T458 PolarHBondContact O-OG1 3.16Å; A387-V460 HydrophobicContact CB-CB 4.39Å; A387-V460 HydrophobicContact CB-CG2 3.88Å; A387-V460 WeakPolarHBondContact O-CG2 3.41Å
388	D	97.5	Very high	90.8	Very high	37 Å²	37	64.9 Å²	64.9	20%	0.198	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.5	175.6	-160.1	3.3	0	0	0	111.9	V430 A452 V453 T458	D388-V430 WeakPolarHBondContact OD1-CG1 3.33Å; D388-A452 WeakPolarHBondContact O-CA 3.45Å; D388-V453 HydrophobicContact CB-CG2 4.08Å; D388-V453 PolarHBondContact N-O 3.44Å; D388-V453 PolarHBondContact O-N 2.89Å; D388-T458 WeakPolarHBondContact CB-OG1 3.36Å
389	L	97.1	Very high	92	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.359	C	S	.	.			trans	-130.6	62.1	175.7	-68.8	171.6	0	0	0	109.6	S391 L392 V430 K446 F449 T450 A452 V460	L389-S391 PolarHBondContact O-N 3.14Å; L389-L392 HydrophobicContact CB-CB 4.25Å; L389-L392 HydrophobicContact CD2-CB 4.45Å; L389-L392 HydrophobicContact CD2-CD1 4.26Å; L389-L392 PolarHBondContact O-N 3.46Å; L389-V430 HydrophobicContact CB-CG2 4.16Å; L389-K446 HydrophobicContact CB-CD 4.47Å; L389-K446 HydrophobicContact CB-CG 4.44Å; L389-K446 HydrophobicContact CD1-CB 4.08Å; L389-K446 HydrophobicContact CD1-CG 3.86Å; L389-K446 VanDerWaalsContact O-CE 3.3Å; L389-K446 WeakPolarHBondContact O-CE 3.39Å; L389-K446 PolarHBondContact O-NZ 2.85Å; L389-F449 HydrophobicContact CD1-CD2 4.09Å; L389-F449 HydrophobicContact CD2-CD2 4.48Å; L389-T450 WeakPolarHBondContact CD2-O 3.24Å; L389-A452 HydrophobicContact CD2-CB 4.12Å; L389-V460 HydrophobicContact CD1-CG1 4.45Å
390	P	94.1	Very high	93.4	Very high	66 Å²	66	62.6 Å²	62.6	43%	0.429	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	123.3	-175.8	27.8	-34.4	0	0	0	110.2	L392 V453	P390-L392 PolarHBondContact O-N 3.42Å; P390-V453 VanDerWaalsContact CD-CG2 3.47Å; P390-V453 HydrophobicContact CG-CG2 3.75Å
391	S	90.7	Very high	93.5	Very high	112 Å²	112	65.3 Å²	65.3	78%	0.783	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	12.3	-178.7	-56.1	0	0	0	0	115.7	L389 D394	L389-S391 PolarHBondContact O-N 3.14Å; S391-D394 VanDerWaalsContact CA-OD2 3.24Å; S391-D394 WeakPolarHBondContact CA-OD2 3.34Å
392	L	95.6	Very high	93.3	Very high	55 Å²	55	66.8 Å²	66.8	29%	0.288	34%	0.344	S	S	.	.	S	Bend	trans	-103.9	139.7	178.5	-67	177.3	0	0	0	110.2	L389 P390 D394 K446 N451	L389-L392 HydrophobicContact CB-CB 4.25Å; L389-L392 HydrophobicContact CD2-CB 4.45Å; L389-L392 HydrophobicContact CD2-CD1 4.26Å; L389-L392 PolarHBondContact O-N 3.46Å; P390-L392 PolarHBondContact O-N 3.42Å; L392-D394 PolarHBondContact O-N 3.23Å; L392-K446 VanDerWaalsContact O-CD 3.3Å; L392-K446 WeakPolarHBondContact O-CD 3.02Å; L392-K446 WeakPolarHBondContact O-CE 3.49Å; L392-K446 PolarHBondContact O-NZ 3.15Å; L392-N451 HydrophobicContact CD1-CB 4.05Å; L392-N451 WeakPolarHBondContact CD1-O 3.24Å
393	H	96.5	Very high	92.8	Very high	45 Å²	45	72.1 Å²	72.1	21%	0.208	37%	0.365	C	S	.	.	S	Bend	trans	55.8	25.8	173.1	-42.9	-55.7	0	0	0	114.2	K446 S447 N448 T450	H393-K446 HydrophobicContact CB-CB 4.27Å; H393-K446 WeakPolarHBondContact O-CA 2.99Å; H393-S447 PolarHBondContact O-N 2.78Å; H393-S447 PolarHBondContact O-OG 3.44Å; H393-S447 VanDerWaalsContact O-OG 3.14Å; H393-N448 HydrophobicContact CB-CB 4.13Å; H393-N448 PolarHBondContact CD2-O 3.44Å; H393-T450 PolarHBondContact CE1-OG1 2.88Å; H393-T450 PolarHBondContact NE2-N 2.93Å; H393-T450 PolarHBondContact NE2-O 3.42Å; H393-T450 PolarHBondContact NE2-OG1 3.32Å; H393-T450 VanDerWaalsContact NE2-OG1 3.07Å
394	D	96	Very high	92.5	Very high	59 Å²	59	72.3 Å²	72.3	32%	0.316	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-69.5	139.4	173.1	-73.5	-49.7	0	0	0	109.9	S391 L392 K446	S391-D394 VanDerWaalsContact CA-OD2 3.24Å; S391-D394 WeakPolarHBondContact CA-OD2 3.34Å; L392-D394 PolarHBondContact O-N 3.23Å; D394-K446 IonicContact OD1-NZ 2.66Å; D394-K446 PolarHBondContact OD1-NZ 3.01Å; D394-K446 IonicContact OD2-NZ 3.27Å; D394-K446 PolarHBondContact OD2-NZ 3.21Å
395	Y	95.1	Very high	92.4	Very high	35 Å²	35	67.6 Å²	67.6	14%	0.137	36%	0.358	C	S	.	.			trans	-140.4	148.7	171.4	66	-86.7	0	0	0	108.8	C397 T404 G405 C406 Q423 C426 F445	Y395-C397 HydrophobicContact CE2-CB 4.15Å; Y395-T404 CarbonylContact C-O 3.59Å; Y395-G405 CarbonylContact O-C 3.57Å; Y395-C406 HydrophobicContact CD2-CB 4.38Å; Y395-C406 HydrophobicContact CE2-CB 3.99Å; Y395-C406 VanDerWaalsContact O-CB 3.27Å; Y395-C406 WeakPolarHBondContact O-CB 3.46Å; Y395-C406 PolarHBondContact O-N 3.16Å; Y395-Q423 PolarHBondContact OH-OE1 3.07Å; Y395-C426 VanDerWaalsContact OH-CB 3.23Å; Y395-C426 WeakPolarHBondContact OH-CB 3.16Å; Y395-F445 HydrophobicContact CE1-CB 4.22Å; Y395-F445 WeakPolarHBondContact CE1-O 3.46Å; Y395-F445 VanDerWaalsContact OH-CB 3.23Å; Y395-F445 WeakPolarHBondContact OH-CB 3.42Å
396	P	93.1	Very high	92.3	Very high	94 Å²	94	62.5 Å²	62.5	61%	0.61	33%	0.331	S	S	*	.			trans	-71.7	144.4	177.1	29.9	-35	0	0	0	110.7
397	C	90.9	Very high	92.3	Very high	30 Å²	30	59 Å²	59	20%	0.203	32%	0.316	C	S	.	.			trans	-140.8	162.9	171.1	72.8	0	0	0	0	111.1	Y395 S400 C406	Y395-C397 HydrophobicContact CE2-CB 4.15Å; C397-S400 WeakPolarHBondContact O-CB 3.12Å; C397-C406 HydrophobicContact CB-CB 3.61Å; C397-C406 WeakPolarHBondContact CB-SG 3.38Å; C397-C406 WeakPolarHBondContact SG-CA 3.18Å; C397-C406 WeakPolarHBondContact SG-CB 3.5Å; C397-C406 CovalentContact SG-SG 2.01Å; C397-C406 PolarHBondContact SG-SG 2.67Å
398	R	84.2	Confident	92.1	Very high	188 Å²	188	59.6 Å²	59.6	71%	0.709	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	143.5	177.3	-165.4	-172	173	165.5	3.3	110.2	S400	R398-S400 PolarHBondContact O-N 2.5Å
399	D	82.9	Confident	92	Very high	61 Å²	61	57.8 Å²	57.8	33%	0.326	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	12.7	176.6	-50.5	-53.7	0	0	0	115.1	S217	S217-D399 WeakPolarHBondContact CB-O 3.37Å
400	S	91.2	Very high	91.9	Very high	14 Å²	14	57.8 Å²	57.8	10%	0.098	31%	0.308	C	S	.	.			trans	-63.9	146.9	172.7	-175.3	0	0	0	0	112.1	C397 R398 T402 G405 V407	C397-S400 WeakPolarHBondContact O-CB 3.12Å; R398-S400 PolarHBondContact O-N 2.5Å; S400-T402 VanDerWaalsContact CB-O 3.29Å; S400-T402 WeakPolarHBondContact CB-O 3.46Å; S400-T402 PolarHBondContact O-N 3.37Å; S400-T402 PolarHBondContact OG-N 2.92Å; S400-T402 VanDerWaalsContact OG-N 3.11Å; S400-T402 PolarHBondContact OG-O 2.89Å; S400-G405 WeakPolarHBondContact CB-O 3.12Å; S400-G405 PolarHBondContact OG-O 3.14Å; S400-V407 CarbonylContact C-O 3.53Å; S400-V407 VanDerWaalsContact CA-O 3.27Å; S400-V407 WeakPolarHBondContact CA-O 3.26Å; S400-V407 PolarHBondContact OG-N 2.93Å; S400-V407 PolarHBondContact OG-O 2.79Å
401	Y	87.8	Confident	91.9	Very high	80 Å²	80	56 Å²	56	31%	0.314	30%	0.298	S	S	.	.	S	Bend	trans	-70.7	-19.9	168.2	-60.6	-73.6	0	0	0	113.1	S217 E219 V407 S409 S436	S217-Y401 WeakPolarHBondContact OG-CD1 3.27Å; S217-Y401 VanDerWaalsContact OG-CE1 3.28Å; S217-Y401 WeakPolarHBondContact OG-CE1 3.42Å; E219-Y401 PolarHBondContact OE2-OH 3.29Å; Y401-V407 HydrophobicContact CD2-CB 4.48Å; Y401-V407 HydrophobicContact CD2-CG1 4.17Å; Y401-V407 WeakPolarHBondContact CD2-O 3.31Å; Y401-V407 PolarHBondContact N-O 3.4Å; Y401-S409 WeakPolarHBondContact OH-CB 3.24Å; Y401-S409 PolarHBondContact OH-OG 3.42Å; Y401-S436 WeakPolarHBondContact OH-CB 3.48Å
402	T	88	Confident	92	Very high	59 Å²	59	53.5 Å²	53.5	36%	0.362	28%	0.276	S	S	.	.	S	Bend	trans	-120	154	-178	75.9	0	0	0	0	110.7	S400 G405 V407	S400-T402 VanDerWaalsContact CB-O 3.29Å; S400-T402 WeakPolarHBondContact CB-O 3.46Å; S400-T402 PolarHBondContact O-N 3.37Å; S400-T402 PolarHBondContact OG-N 2.92Å; S400-T402 VanDerWaalsContact OG-N 3.11Å; S400-T402 PolarHBondContact OG-O 2.89Å; T402-G405 PolarHBondContact OG1-N 3.21Å; T402-G405 PolarHBondContact OG1-O 2.92Å; T402-V407 HydrophobicContact CG2-CB 4.32Å; T402-V407 HydrophobicContact CG2-CG2 4.01Å
403	Q	85.2	Confident	91.8	Very high	168 Å²	168	53 Å²	53	79%	0.785	27%	0.274	S	S	*	.	S	Bend	trans	-80.8	-22.6	-179.1	-62.3	-176	24.1	0	0	112.9
404	T	89.7	Confident	91.5	Very high	113 Å²	113	53.3 Å²	53.3	69%	0.693	28%	0.275	S	S	*	.	S	Bend	trans	-106.5	-30	-170.2	50.5	0	0	0	0	113.7	Y395	Y395-T404 CarbonylContact C-O 3.59Å
405	G	93.1	Very high	91.2	Very high	2 Å²	2	51 Å²	51	2%	0.021	26%	0.262	C	S	.	.	S	Bend	trans	-116.1	161.4	177.9	0	0	0	0	0	111.6	Y395 S400 T402 V407	Y395-G405 CarbonylContact O-C 3.57Å; S400-G405 WeakPolarHBondContact CB-O 3.12Å; S400-G405 PolarHBondContact OG-O 3.14Å; T402-G405 PolarHBondContact OG1-N 3.21Å; T402-G405 PolarHBondContact OG1-O 2.92Å; G405-V407 PolarHBondContact O-N 3.43Å
406	C	95.2	Very high	91.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	89.5	175.4	-175.5	0	0	0	0	108.8	Y395 C397 Q423 H444 F445	Y395-C406 HydrophobicContact CD2-CB 4.38Å; Y395-C406 HydrophobicContact CE2-CB 3.99Å; Y395-C406 VanDerWaalsContact O-CB 3.27Å; Y395-C406 WeakPolarHBondContact O-CB 3.46Å; Y395-C406 PolarHBondContact O-N 3.16Å; C397-C406 HydrophobicContact CB-CB 3.61Å; C397-C406 WeakPolarHBondContact CB-SG 3.38Å; C397-C406 WeakPolarHBondContact SG-CA 3.18Å; C397-C406 WeakPolarHBondContact SG-CB 3.5Å; C397-C406 CovalentContact SG-SG 2.01Å; C397-C406 PolarHBondContact SG-SG 2.67Å; C406-Q423 PolarHBondContact SG-OE1 3.33Å; C406-H444 CarbonylContact O-C 3.51Å; C406-H444 WeakPolarHBondContact O-CA 3.32Å; C406-F445 HydrophobicContact CB-CB 3.94Å; C406-F445 HydrophobicContact CB-CD2 4.41Å; C406-F445 PolarHBondContact O-N 3.19Å; C406-F445 WeakPolarHBondContact SG-CD2 3.19Å
407	V	95.8	Very high	91.1	Very high	11 Å²	11	46.7 Å²	46.7	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	112.7	-175.3	-168.7	0	0	0	0	108.7	S400 Y401 T402 G405 V442 V443 H444	S400-V407 CarbonylContact C-O 3.53Å; S400-V407 VanDerWaalsContact CA-O 3.27Å; S400-V407 WeakPolarHBondContact CA-O 3.26Å; S400-V407 PolarHBondContact OG-N 2.93Å; S400-V407 PolarHBondContact OG-O 2.79Å; Y401-V407 HydrophobicContact CD2-CB 4.48Å; Y401-V407 HydrophobicContact CD2-CG1 4.17Å; Y401-V407 WeakPolarHBondContact CD2-O 3.31Å; Y401-V407 PolarHBondContact N-O 3.4Å; T402-V407 HydrophobicContact CG2-CB 4.32Å; T402-V407 HydrophobicContact CG2-CG2 4.01Å; G405-V407 PolarHBondContact O-N 3.43Å; V407-V442 HydrophobicContact CG1-CG1 3.5Å; V407-V442 VanDerWaalsContact CG1-CG1 3.5Å; V407-V443 WeakPolarHBondContact CA-O 3.34Å; V407-H444 WeakPolarHBondContact CG2-ND1 3.29Å
408	I	94.8	Very high	91	Very high	22 Å²	22	47.7 Å²	47.7	11%	0.113	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	153.7	-174.1	-55.6	174.4	0	0	0	109	V443 F445	I408-V443 PolarHBondContact N-O 3.3Å; I408-V443 VanDerWaalsContact N-O 3.12Å; I408-V443 WeakPolarHBondContact O-CG2 3.41Å; I408-V443 PolarHBondContact O-N 3.22Å; I408-F445 HydrophobicContact CB-CE2 4.13Å; I408-F445 HydrophobicContact CD1-CD2 4.47Å; I408-F445 HydrophobicContact CD1-CE2 4.1Å; I408-F445 HydrophobicContact CG1-CE2 4.34Å
409	S	95.8	Very high	91.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	141.2	168.6	74.6	0	0	0	0	112.6	E219 Y364 Y401 R440 K441	E219-S409 WeakPolarHBondContact OE2-CB 3.36Å; E219-S409 PolarHBondContact OE2-OG 3.02Å; Y364-S409 PolarHBondContact OH-OG 3.05Å; Y401-S409 WeakPolarHBondContact OH-CB 3.24Å; Y401-S409 PolarHBondContact OH-OG 3.42Å; S409-R440 PolarHBondContact O-NE 3.29Å; S409-R440 PolarHBondContact O-NH2 3.09Å; S409-R440 PolarHBondContact OG-NE 2.94Å; S409-K441 CarbonylContact C-O 3.6Å; S409-K441 VanDerWaalsContact CA-O 3.23Å; S409-K441 WeakPolarHBondContact CA-O 3.29Å
410	V	94.9	Very high	91.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.5	178.7	-64.5	0	0	0	0	109.9	N412 E415 A416 L419 W431 R440 K441 V443	V410-N412 VanDerWaalsContact C-N 3.27Å; V410-N412 PolarHBondContact O-N 2.93Å; V410-E415 WeakPolarHBondContact CA-OE2 3.21Å; V410-E415 HydrophobicContact CB-CB 4.39Å; V410-E415 HydrophobicContact CB-CG 4.38Å; V410-E415 HydrophobicContact CG1-CG 4.29Å; V410-A416 HydrophobicContact CB-CB 4.31Å; V410-A416 HydrophobicContact CG1-CB 4.12Å; V410-A416 HydrophobicContact CG2-CB 3.98Å; V410-L419 HydrophobicContact CG1-CD1 3.87Å; V410-W431 HydrophobicContact CG2-CH2 4.14Å; V410-W431 HydrophobicContact CG2-CZ3 3.75Å; V410-R440 VanDerWaalsContact CA-NH2 3.31Å; V410-K441 HydrophobicContact CG2-CB 4.22Å; V410-K441 WeakPolarHBondContact CG2-O 2.99Å; V410-K441 PolarHBondContact N-O 2.93Å; V410-K441 PolarHBondContact O-N 2.7Å; V410-V443 HydrophobicContact CG1-CG2 3.87Å; V410-V443 HydrophobicContact CG2-CB 4.41Å; V410-V443 HydrophobicContact CG2-CG1 3.61Å; V410-V443 HydrophobicContact CG2-CG2 3.86Å
411	A	93.6	Very high	91.7	Very high	27 Å²	27	38.5 Å²	38.5	22%	0.223	20%	0.201	C	C	.	.	S	Bend	trans	-64.8	-35.4	175.8	0	0	0	0	0	111.4	E415 R440	A411-E415 WeakPolarHBondContact CB-OE2 3.46Å; A411-E415 PolarHBondContact N-OE2 3.24Å; A411-R440 VanDerWaalsContact N-CZ 3.33Å
412	N	91.6	Very high	91.7	Very high	61 Å²	61	39.1 Å²	39.1	33%	0.326	21%	0.208	S	C	.	.	S	Bend	trans	-159.9	173.2	-178.1	57.3	60.7	0	0	0	111.8	V410 H414 E415 A416	V410-N412 VanDerWaalsContact C-N 3.27Å; V410-N412 PolarHBondContact O-N 2.93Å; N412-H414 PolarHBondContact O-N 3.01Å; N412-H414 WeakPolarHBondContact OD1-CA 3.4Å; N412-H414 VanDerWaalsContact OD1-CB 3.25Å; N412-H414 WeakPolarHBondContact OD1-CB 3.39Å; N412-H414 PolarHBondContact OD1-N 3.13Å; N412-E415 PolarHBondContact O-N 3.01Å; N412-E415 PolarHBondContact OD1-N 3.09Å; N412-A416 PolarHBondContact O-N 3.16Å
413	L	91.9	Very high	91.8	Very high	45 Å²	45	38 Å²	38	24%	0.236	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-28	-179.8	-178.6	63.4	0	0	0	113	A416 K417 W431 Y461	L413-A416 PolarHBondContact O-N 3.17Å; L413-K417 HydrophobicContact CD1-CG 4.45Å; L413-K417 HydrophobicContact CG-CD 4.34Å; L413-K417 HydrophobicContact CG-CG 4.49Å; L413-K417 WeakPolarHBondContact O-CG 3.39Å; L413-K417 PolarHBondContact O-N 3.17Å; L413-W431 HydrophobicContact CB-CH2 4.1Å; L413-W431 HydrophobicContact CB-CZ3 4Å; L413-W431 HydrophobicContact CD1-CE3 3.8Å; L413-W431 HydrophobicContact CD1-CZ3 3.99Å; L413-W431 VanDerWaalsContact N-CH2 3.35Å; L413-Y461 HydrophobicContact CD1-CD1 4.06Å; L413-Y461 HydrophobicContact CD1-CD2 3.75Å; L413-Y461 HydrophobicContact CD1-CE1 3.91Å; L413-Y461 HydrophobicContact CD1-CE2 3.59Å; L413-Y461 HydrophobicContact CD1-CG 3.98Å; L413-Y461 HydrophobicContact CD2-CD1 4.21Å; L413-Y461 HydrophobicContact CD2-CE1 3.48Å; L413-Y461 VanDerWaalsContact CD2-CE1 3.48Å; L413-Y461 HydrophobicContact CD2-CE2 4.37Å; L413-Y461 HydrophobicContact CG-CE1 4.32Å
414	H	89.5	Confident	92	Very high	50 Å²	50	37.1 Å²	37.1	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-69.1	-44.8	179.8	179.9	39.6	0	0	0	111.3	F370 S378 N412 A416 K417 Y418	F370-H414 AromaticContact CD1-CD2 3.93Å; F370-H414 AromaticContact CE1-CD2 3.55Å; F370-H414 AromaticContact CE1-NE2 3.62Å; S378-H414 PolarHBondContact OG-CE1 3.37Å; S378-H414 PolarHBondContact OG-ND1 2.89Å; N412-H414 PolarHBondContact O-N 3.01Å; N412-H414 WeakPolarHBondContact OD1-CA 3.4Å; N412-H414 VanDerWaalsContact OD1-CB 3.25Å; N412-H414 WeakPolarHBondContact OD1-CB 3.39Å; N412-H414 PolarHBondContact OD1-N 3.13Å; H414-A416 VanDerWaalsContact C-N 3.32Å; H414-A416 PolarHBondContact O-N 2.87Å; H414-K417 PolarHBondContact O-N 3.18Å; H414-Y418 PolarHBondContact O-N 3.11Å
415	E	90.9	Very high	92	Very high	10 Å²	10	33.5 Å²	33.5	5%	0.047	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-43.7	172.4	-177.3	178.2	-163.2	0	0	111.3	Y369 F370 V410 A411 N412 K417 Y418 L419 R440	Y369-E415 PolarHBondContact OH-OE1 3.36Å; F370-E415 HydrophobicContact CD1-CB 4.43Å; F370-E415 HydrophobicContact CD2-CG 4.19Å; F370-E415 HydrophobicContact CE2-CG 4.35Å; F370-E415 HydrophobicContact CG-CB 4.44Å; V410-E415 WeakPolarHBondContact CA-OE2 3.21Å; V410-E415 HydrophobicContact CB-CB 4.39Å; V410-E415 HydrophobicContact CB-CG 4.38Å; V410-E415 HydrophobicContact CG1-CG 4.29Å; A411-E415 WeakPolarHBondContact CB-OE2 3.46Å; A411-E415 PolarHBondContact N-OE2 3.24Å; N412-E415 PolarHBondContact O-N 3.01Å; N412-E415 PolarHBondContact OD1-N 3.09Å; E415-K417 PolarHBondContact O-N 2.8Å; E415-Y418 PolarHBondContact O-N 3.37Å; E415-L419 HydrophobicContact CG-CD1 4.07Å; E415-L419 HydrophobicContact CG-CG 4.32Å; E415-L419 WeakPolarHBondContact O-CG 3.09Å; E415-L419 PolarHBondContact O-N 2.97Å; E415-R440 IonicContact OE1-CZ 3.5Å; E415-R440 IonicContact OE1-NH1 3.32Å; E415-R440 IonicContact OE1-NH2 3.7Å; E415-R440 PolarHBondContact OE1-NH2 3.08Å; E415-R440 IonicContact OE2-CZ 2.77Å; E415-R440 IonicContact OE2-NH1 3.09Å; E415-R440 PolarHBondContact OE2-NH1 3Å; E415-R440 IonicContact OE2-NH2 3.66Å; E415-R440 PolarHBondContact OE2-NH2 2.88Å
416	A	93.4	Very high	92.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.5	-49.4	176.9	0	0	0	0	0	112.1	V410 N412 L413 H414 Y418 L419 C420 I429 W431 F445	V410-A416 HydrophobicContact CB-CB 4.31Å; V410-A416 HydrophobicContact CG1-CB 4.12Å; V410-A416 HydrophobicContact CG2-CB 3.98Å; N412-A416 PolarHBondContact O-N 3.16Å; L413-A416 PolarHBondContact O-N 3.17Å; H414-A416 VanDerWaalsContact C-N 3.32Å; H414-A416 PolarHBondContact O-N 2.87Å; A416-Y418 VanDerWaalsContact C-N 3.32Å; A416-Y418 PolarHBondContact O-N 3.23Å; A416-L419 PolarHBondContact O-N 3.31Å; A416-C420 PolarHBondContact O-N 3.43Å; A416-I429 HydrophobicContact CB-CD1 4.11Å; A416-I429 HydrophobicContact CB-CG2 4.38Å; A416-I429 WeakPolarHBondContact O-CD1 3.38Å; A416-W431 HydrophobicContact CB-CZ3 4.08Å; A416-F445 WeakPolarHBondContact O-CE1 3.04Å
417	K	92.7	Very high	92.1	Very high	39 Å²	39	37.2 Å²	37.2	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-43.5	178.3	-74	177.7	175.8	-173	0	111.7	F381 L413 H414 E415 C420 S421 I429	F381-K417 HydrophobicContact CB-CD 4.44Å; F381-K417 HydrophobicContact CD1-CG 4.49Å; F381-K417 HydrophobicContact CD2-CB 4.13Å; F381-K417 HydrophobicContact CD2-CD 3.84Å; F381-K417 HydrophobicContact CD2-CG 3.72Å; F381-K417 HydrophobicContact CE2-CB 3.8Å; F381-K417 HydrophobicContact CE2-CD 4.38Å; F381-K417 HydrophobicContact CE2-CG 3.84Å; F381-K417 HydrophobicContact CG-CD 4.23Å; F381-K417 HydrophobicContact CG-CG 4.07Å; F381-K417 HydrophobicContact CZ-CB 4.3Å; F381-K417 HydrophobicContact CZ-CG 4.28Å; L413-K417 HydrophobicContact CD1-CG 4.45Å; L413-K417 HydrophobicContact CG-CD 4.34Å; L413-K417 HydrophobicContact CG-CG 4.49Å; L413-K417 WeakPolarHBondContact O-CG 3.39Å; L413-K417 PolarHBondContact O-N 3.17Å; H414-K417 PolarHBondContact O-N 3.18Å; E415-K417 PolarHBondContact O-N 2.8Å; K417-C420 PolarHBondContact O-N 2.96Å; K417-S421 WeakPolarHBondContact O-CB 3.31Å; K417-S421 PolarHBondContact O-N 2.84Å; K417-S421 PolarHBondContact O-OG 3Å; K417-S421 VanDerWaalsContact O-OG 3.1Å; K417-I429 HydrophobicContact CG-CD1 4.31Å
418	Y	89.3	Confident	92.1	Very high	52 Å²	52	36.7 Å²	36.7	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-48.4	176.6	170.2	-96	0	0	0	112.5	F370 M374 H414 E415 A416 C420 S421 I422	F370-Y418 AromaticContact CE2-CD1 3.35Å; F370-Y418 HydrophobicContact CE2-CD1 3.35Å; F370-Y418 HydrophobicContact CE2-CD2 4.49Å; F370-Y418 AromaticContact CE2-CE1 3.81Å; F370-Y418 HydrophobicContact CE2-CE1 3.81Å; F370-Y418 AromaticContact CE2-CG 3.74Å; F370-Y418 HydrophobicContact CE2-CG 3.74Å; F370-Y418 VanDerWaalsContact CZ-CB 3.41Å; F370-Y418 AromaticContact CZ-CD1 3.53Å; F370-Y418 HydrophobicContact CZ-CD1 3.53Å; F370-Y418 HydrophobicContact CZ-CD2 4.02Å; F370-Y418 HydrophobicContact CZ-CE1 4.27Å; F370-Y418 AromaticContact CZ-CG 3.37Å; F370-Y418 HydrophobicContact CZ-CG 3.37Å; M374-Y418 HydrophobicContact CB-CD2 4.07Å; M374-Y418 HydrophobicContact CB-CE2 4.25Å; M374-Y418 HydrophobicContact CE-CE1 4.27Å; M374-Y418 HydrophobicContact CE-CE2 3.99Å; M374-Y418 VanDerWaalsContact CE-OH 3.24Å; M374-Y418 WeakPolarHBondContact CE-OH 3.44Å; M374-Y418 HydrophobicContact CG-CD2 4.16Å; M374-Y418 HydrophobicContact CG-CE2 3.83Å; M374-Y418 HydrophobicContact SD-CD1 4.33Å; M374-Y418 HydrophobicContact SD-CD2 4.01Å; M374-Y418 HydrophobicContact SD-CE1 3.92Å; M374-Y418 HydrophobicContact SD-CE2 3.56Å; M374-Y418 VanDerWaalsContact SD-CE2 3.56Å; M374-Y418 HydrophobicContact SD-CG 4.36Å; M374-Y418 VanDerWaalsContact SD-CZ 3.51Å; H414-Y418 PolarHBondContact O-N 3.11Å; E415-Y418 PolarHBondContact O-N 3.37Å; A416-Y418 VanDerWaalsContact C-N 3.32Å; A416-Y418 PolarHBondContact O-N 3.23Å; Y418-C420 VanDerWaalsContact C-N 3.27Å; Y418-C420 PolarHBondContact O-N 3.01Å; Y418-S421 WeakPolarHBondContact O-CA 3.31Å; Y418-S421 WeakPolarHBondContact O-CB 3.35Å; Y418-S421 PolarHBondContact O-N 3.39Å; Y418-I422 HydrophobicContact CD1-CD1 4.46Å; Y418-I422 HydrophobicContact CD2-CG2 4.41Å; Y418-I422 HydrophobicContact CE1-CD1 3.86Å; Y418-I422 HydrophobicContact CE1-CG2 4.36Å; Y418-I422 HydrophobicContact CE2-CG2 3.93Å; Y418-I422 PolarHBondContact O-N 3.34Å
419	L	90.6	Very high	92.3	Very high	35 Å²	35	35.6 Å²	35.6	18%	0.183	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-39.1	178.5	-70	177.1	0	0	0	111.5	V410 E415 A416 I422 Q423 F445	V410-L419 HydrophobicContact CG1-CD1 3.87Å; E415-L419 HydrophobicContact CG-CD1 4.07Å; E415-L419 HydrophobicContact CG-CG 4.32Å; E415-L419 WeakPolarHBondContact O-CG 3.09Å; E415-L419 PolarHBondContact O-N 2.97Å; A416-L419 PolarHBondContact O-N 3.31Å; L419-I422 HydrophobicContact CD2-CD1 4.21Å; L419-I422 VanDerWaalsContact O-CG1 3.29Å; L419-I422 WeakPolarHBondContact O-CG1 3.31Å; L419-Q423 WeakPolarHBondContact O-CG 3.37Å; L419-Q423 PolarHBondContact O-N 2.9Å; L419-Q423 PolarHBondContact O-NE2 3.26Å; L419-F445 HydrophobicContact CB-CE1 4.17Å; L419-F445 HydrophobicContact CB-CZ 3.79Å; L419-F445 HydrophobicContact CD1-CZ 4.31Å
420	C	92.9	Very high	92.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-34.7	172.4	-173.3	0	0	0	0	112.7	F381 A416 K417 Y418 Q423 C426 I429 F445 K463	F381-C420 HydrophobicContact CE1-CB 4.36Å; F381-C420 HydrophobicContact CZ-CB 4Å; A416-C420 PolarHBondContact O-N 3.43Å; K417-C420 PolarHBondContact O-N 2.96Å; Y418-C420 VanDerWaalsContact C-N 3.27Å; Y418-C420 PolarHBondContact O-N 3.01Å; C420-Q423 PolarHBondContact O-N 3.11Å; C420-C426 WeakPolarHBondContact CA-SG 3.47Å; C420-C426 HydrophobicContact CB-CB 3.93Å; C420-C426 WeakPolarHBondContact CB-SG 3.4Å; C420-C426 WeakPolarHBondContact O-CB 3.49Å; C420-C426 WeakPolarHBondContact SG-CB 3.31Å; C420-C426 CovalentContact SG-SG 2.04Å; C420-C426 PolarHBondContact SG-SG 2.83Å; C420-I429 HydrophobicContact CB-CD1 3.7Å; C420-I429 HydrophobicContact CB-CG1 3.87Å; C420-F445 HydrophobicContact CB-CD1 3.8Å; C420-F445 HydrophobicContact CB-CE1 3.79Å; C420-K463 PolarHBondContact O-NZ 3.47Å
421	S	89.9	Confident	92.5	Very high	34 Å²	34	38 Å²	38	24%	0.238	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-40.2	178.7	-73.6	0	0	0	0	112.5	K417 Y418 K463	K417-S421 WeakPolarHBondContact O-CB 3.31Å; K417-S421 PolarHBondContact O-N 2.84Å; K417-S421 PolarHBondContact O-OG 3Å; K417-S421 VanDerWaalsContact O-OG 3.1Å; Y418-S421 WeakPolarHBondContact O-CA 3.31Å; Y418-S421 WeakPolarHBondContact O-CB 3.35Å; Y418-S421 PolarHBondContact O-N 3.39Å; S421-K463 PolarHBondContact O-NZ 2.87Å
422	I	87.7	Confident	92.6	Very high	93 Å²	93	37.2 Å²	37.2	48%	0.477	20%	0.202	S	C	.	.	H	α-helix	trans	-81.6	-16.4	-179.9	66	172.1	0	0	0	113.8	Y418 L419	Y418-I422 HydrophobicContact CD1-CD1 4.46Å; Y418-I422 HydrophobicContact CD2-CG2 4.41Å; Y418-I422 HydrophobicContact CE1-CD1 3.86Å; Y418-I422 HydrophobicContact CE1-CG2 4.36Å; Y418-I422 HydrophobicContact CE2-CG2 3.93Å; Y418-I422 PolarHBondContact O-N 3.34Å; L419-I422 HydrophobicContact CD2-CD1 4.21Å; L419-I422 VanDerWaalsContact O-CG1 3.29Å; L419-I422 WeakPolarHBondContact O-CG1 3.31Å
423	Q	90.2	Very high	92.7	Very high	35 Å²	35	36.6 Å²	36.6	16%	0.164	21%	0.21	C	C	.	.			trans	-85.2	117.1	175	-74.9	179.7	45.4	0	0	110.3	Y395 C406 L419 C420 G425 C426	Y395-Q423 PolarHBondContact OH-OE1 3.07Å; C406-Q423 PolarHBondContact SG-OE1 3.33Å; L419-Q423 WeakPolarHBondContact O-CG 3.37Å; L419-Q423 PolarHBondContact O-N 2.9Å; L419-Q423 PolarHBondContact O-NE2 3.26Å; C420-Q423 PolarHBondContact O-N 3.11Å; Q423-G425 PolarHBondContact O-N 3.32Å; Q423-C426 HydrophobicContact CB-CB 3.83Å; Q423-C426 PolarHBondContact O-N 3.13Å; Q423-C426 VanDerWaalsContact O-N 3.11Å
424	V	88.4	Confident	92.8	Very high	151 Å²	151	40.4 Å²	40.4	92%	0.915	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-39.4	-178	179.3	0	0	0	0	112.3
425	G	90	Very high	93.2	Very high	37 Å²	37	43.9 Å²	43.9	38%	0.381	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-2.3	-177.9	0	0	0	0	0	115.5	Q423 S447	Q423-G425 PolarHBondContact O-N 3.32Å; G425-S447 VanDerWaalsContact O-CA 3.24Å; G425-S447 WeakPolarHBondContact O-CA 3.48Å
426	C	94.8	Very high	93.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.247	C	C	.	.			trans	-87.7	119.2	-175.3	-172.8	0	0	0	0	112.4	Y395 C420 Q423 F445 K463	Y395-C426 VanDerWaalsContact OH-CB 3.23Å; Y395-C426 WeakPolarHBondContact OH-CB 3.16Å; C420-C426 WeakPolarHBondContact CA-SG 3.47Å; C420-C426 HydrophobicContact CB-CB 3.93Å; C420-C426 WeakPolarHBondContact CB-SG 3.4Å; C420-C426 WeakPolarHBondContact O-CB 3.49Å; C420-C426 WeakPolarHBondContact SG-CB 3.31Å; C420-C426 CovalentContact SG-SG 2.04Å; C420-C426 PolarHBondContact SG-SG 2.83Å; Q423-C426 HydrophobicContact CB-CB 3.83Å; Q423-C426 PolarHBondContact O-N 3.13Å; Q423-C426 VanDerWaalsContact O-N 3.11Å; C426-F445 VanDerWaalsContact SG-CD1 3.55Å; C426-K463 WeakPolarHBondContact O-CD 3.45Å
427	L	95.5	Very high	93.5	Very high	79 Å²	79	48.3 Å²	48.3	41%	0.414	26%	0.262	S	S	.	.			trans	-116.8	-18.5	174	-63.8	-171.9	0	0	0	113.5	K446 S447 K463	L427-K446 PolarHBondContact N-O 3.03Å; L427-S447 WeakPolarHBondContact CD1-O 3.03Å; L427-S447 WeakPolarHBondContact CG-O 3.49Å; L427-K463 WeakPolarHBondContact O-CB 3.24Å; L427-K463 PolarHBondContact O-N 3.32Å
428	A	96.8	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	158.6	176.4	0	0	0	0	0	112.8	K446 F449 V460 Y461 V462	A428-K446 HydrophobicContact CB-CB 4.09Å; A428-K446 PolarHBondContact N-O 2.03Å; A428-K446 PolarHBondContact O-N 3.06Å; A428-F449 HydrophobicContact CB-CB 4.32Å; A428-V460 HydrophobicContact CB-CG1 3.97Å; A428-Y461 CarbonylContact C-O 3.55Å; A428-Y461 VanDerWaalsContact CA-O 3.25Å; A428-Y461 WeakPolarHBondContact CA-O 3.32Å; A428-V462 HydrophobicContact CB-CG2 4.3Å
429	I	97.5	Very high	94	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	118.7	178.5	-49.8	171.1	0	0	0	108	F381 A416 K417 C420 V443 H444 F445 V460 Y461	F381-I429 HydrophobicContact CD1-CD1 4.47Å; F381-I429 HydrophobicContact CE1-CD1 3.87Å; F381-I429 HydrophobicContact CE1-CG1 4.24Å; F381-I429 HydrophobicContact CZ-CD1 4.29Å; A416-I429 HydrophobicContact CB-CD1 4.11Å; A416-I429 HydrophobicContact CB-CG2 4.38Å; A416-I429 WeakPolarHBondContact O-CD1 3.38Å; K417-I429 HydrophobicContact CG-CD1 4.31Å; C420-I429 HydrophobicContact CB-CD1 3.7Å; C420-I429 HydrophobicContact CB-CG1 3.87Å; I429-V443 HydrophobicContact CG2-CB 4.01Å; I429-V443 HydrophobicContact CG2-CG1 4.45Å; I429-V443 HydrophobicContact CG2-CG2 4.37Å; I429-H444 CarbonylContact C-O 3.54Å; I429-H444 WeakPolarHBondContact CA-O 3.44Å; I429-F445 HydrophobicContact CD1-CE1 4.17Å; I429-F445 HydrophobicContact CG1-CD1 3.91Å; I429-F445 HydrophobicContact CG1-CE1 4.03Å; I429-F445 HydrophobicContact CG2-CD1 4.49Å; I429-F445 HydrophobicContact CG2-CE1 4.39Å; I429-V460 CarbonylContact O-C 3.52Å; I429-V460 VanDerWaalsContact O-CA 3.32Å; I429-V460 WeakPolarHBondContact O-CA 3.31Å; I429-Y461 PolarHBondContact N-O 3.23Å; I429-Y461 PolarHBondContact O-N 2.8Å
430	V	98.2	Very high	94.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	115.3	166.2	-174.5	0	0	0	0	108.3	D388 L389 T432 V443 H444 K446 T458 V460	D388-V430 WeakPolarHBondContact OD1-CG1 3.33Å; L389-V430 HydrophobicContact CB-CG2 4.16Å; V430-T432 HydrophobicContact CG1-CG2 4.25Å; V430-V443 WeakPolarHBondContact O-CA 3.4Å; V430-V443 WeakPolarHBondContact O-CB 3.01Å; V430-H444 HydrophobicContact CB-CB 4.04Å; V430-H444 HydrophobicContact CG2-CB 4.34Å; V430-H444 PolarHBondContact N-O 3.33Å; V430-H444 PolarHBondContact O-N 3.46Å; V430-K446 HydrophobicContact CG2-CD 4.44Å; V430-K446 HydrophobicContact CG2-CG 3.85Å; V430-T458 HydrophobicContact CG1-CG2 4.4Å; V430-V460 HydrophobicContact CG2-CG2 4.33Å
431	W	97.6	Very high	94.5	Very high	49 Å²	49	48 Å²	48	19%	0.186	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.8	175.5	-171.8	-87.7	0	0	0	110	V410 L413 A416 K441 V443 T458 A459 Y461	V410-W431 HydrophobicContact CG2-CH2 4.14Å; V410-W431 HydrophobicContact CG2-CZ3 3.75Å; L413-W431 HydrophobicContact CB-CH2 4.1Å; L413-W431 HydrophobicContact CB-CZ3 4Å; L413-W431 HydrophobicContact CD1-CE3 3.8Å; L413-W431 HydrophobicContact CD1-CZ3 3.99Å; L413-W431 VanDerWaalsContact N-CH2 3.35Å; A416-W431 HydrophobicContact CB-CZ3 4.08Å; W431-K441 HydrophobicContact CH2-CB 3.94Å; W431-K441 HydrophobicContact CH2-CG 4.08Å; W431-K441 HydrophobicContact CZ2-CB 3.95Å; W431-K441 HydrophobicContact CZ2-CD 4.34Å; W431-K441 HydrophobicContact CZ2-CG 3.66Å; W431-V443 HydrophobicContact CD2-CG1 4.23Å; W431-V443 HydrophobicContact CE3-CG1 3.54Å; W431-V443 HydrophobicContact CZ3-CG1 3.82Å; W431-T458 VanDerWaalsContact O-CA 3.3Å; W431-T458 WeakPolarHBondContact O-CA 3.44Å; W431-A459 VanDerWaalsContact CB-O 3.32Å; W431-A459 WeakPolarHBondContact CB-O 3.49Å; W431-A459 PolarHBondContact N-O 2.87Å; W431-A459 PolarHBondContact O-N 3.47Å; W431-A459 VanDerWaalsContact O-N 3.08Å; W431-Y461 HydrophobicContact CB-CD2 4.07Å; W431-Y461 HydrophobicContact CB-CE2 3.65Å; W431-Y461 HydrophobicContact CD2-CE2 4.41Å; W431-Y461 HydrophobicContact CG-CE2 4.02Å
432	T	96	Very high	94.8	Very high	11 Å²	11	47 Å²	47	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	167.4	-173.3	82.5	0	0	0	0	113.2	V430 Q434 V442	V430-T432 HydrophobicContact CG1-CG2 4.25Å; T432-Q434 VanDerWaalsContact C-N 3.29Å; T432-Q434 WeakPolarHBondContact OG1-CB 3.35Å; T432-Q434 PolarHBondContact OG1-N 2.88Å; T432-Q434 VanDerWaalsContact OG1-N 3.09Å; T432-V442 PolarHBondContact OG1-O 2.04Å
433	G	93	Very high	95.3	Very high	48 Å²	48	42.5 Å²	42.5	50%	0.495	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-21.1	167.7	0	0	0	0	0	114.1	K441	G433-K441 PolarHBondContact O-NZ 2.03Å; G433-K441 VanDerWaalsContact O-NZ 3.13Å
434	Q	95.1	Very high	95.6	Very high	125 Å²	125	43.1 Å²	43.1	58%	0.584	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	149.8	-170.3	-61.7	-179.6	-13.3	0	0	112.8	T432 V442	T432-Q434 VanDerWaalsContact C-N 3.29Å; T432-Q434 WeakPolarHBondContact OG1-CB 3.35Å; T432-Q434 PolarHBondContact OG1-N 2.88Å; T432-Q434 VanDerWaalsContact OG1-N 3.09Å; Q434-V442 HydrophobicContact CB-CB 4.05Å; Q434-V442 HydrophobicContact CB-CG2 4.33Å; Q434-V442 PolarHBondContact O-N 3.05Å
435	Q	96.5	Very high	96	Very high	123 Å²	123	35.9 Å²	35.9	58%	0.575	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.8	178.4	-73.1	179.1	-20	0	0	111.2	R440 K441	Q435-R440 CarbonylContact C-O 3.56Å; Q435-R440 WeakPolarHBondContact CA-O 3.41Å; Q435-K441 HydrophobicContact CG-CD 4.29Å
436	S	95.9	Very high	96.4	Very high	19 Å²	19	34.3 Å²	34.3	13%	0.133	18%	0.184	C	C	.	.			trans	-78.3	176.9	170.7	76.1	0	0	0	0	111	E219 Y401 T438 G439 R440	E219-S436 WeakPolarHBondContact OE1-CB 3.35Å; E219-S436 PolarHBondContact OE1-OG 2.95Å; Y401-S436 WeakPolarHBondContact OH-CB 3.48Å; S436-T438 PolarHBondContact O-N 3.18Å; S436-T438 PolarHBondContact OG-N 2.91Å; S436-T438 PolarHBondContact OG-OG1 3.09Å; S436-G439 PolarHBondContact O-N 3.49Å; S436-R440 PolarHBondContact N-O 3.37Å
437	W	95.6	Very high	96.5	Very high	83 Å²	83	36.5 Å²	36.5	31%	0.314	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.6	178.6	74.7	-89.6	0	0	0	113.7	E219 L222 K223 L226 V361 G439	E219-W437 PolarHBondContact O-NE1 3.47Å; L222-W437 HydrophobicContact CG-CZ2 4.43Å; K223-W437 HydrophobicContact CB-CD2 4.13Å; K223-W437 HydrophobicContact CB-CH2 4.34Å; K223-W437 HydrophobicContact CB-CZ2 3.65Å; K223-W437 HydrophobicContact CD-CB 4.27Å; K223-W437 HydrophobicContact CD-CD2 3.94Å; K223-W437 HydrophobicContact CD-CG 3.78Å; K223-W437 HydrophobicContact CG-CD2 3.87Å; K223-W437 HydrophobicContact CG-CE3 4.25Å; K223-W437 HydrophobicContact CG-CG 4.26Å; K223-W437 HydrophobicContact CG-CH2 4.46Å; K223-W437 HydrophobicContact CG-CZ2 4.13Å; L226-W437 HydrophobicContact CD2-CH2 3.87Å; L226-W437 HydrophobicContact CD2-CZ3 3.89Å; V361-W437 HydrophobicContact CB-CH2 4.42Å; V361-W437 HydrophobicContact CG1-CH2 3.54Å; V361-W437 HydrophobicContact CG1-CZ3 3.81Å; V361-W437 HydrophobicContact CG2-CH2 3.94Å; W437-G439 VanDerWaalsContact C-N 3.33Å
438	T	96	Very high	96.5	Very high	22 Å²	22	36.2 Å²	36.2	14%	0.135	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.5	173.6	60.5	0	0	0	0	113	E219 V361 Y364 S436 R440	E219-T438 HydrophobicContact CG-CG2 4.41Å; E219-T438 WeakPolarHBondContact OE1-CG2 3.04Å; E219-T438 PolarHBondContact OE1-OG1 2.81Å; V361-T438 HydrophobicContact CG1-CG2 4.43Å; Y364-T438 HydrophobicContact CD1-CG2 4.22Å; S436-T438 PolarHBondContact O-N 3.18Å; S436-T438 PolarHBondContact OG-N 2.91Å; S436-T438 PolarHBondContact OG-OG1 3.09Å; T438-R440 PolarHBondContact O-N 2.72Å; T438-R440 WeakPolarHBondContact OG1-CD 3.29Å; T438-R440 VanDerWaalsContact OG1-CG 3.29Å; T438-R440 WeakPolarHBondContact OG1-CG 3.34Å
439	G	96.2	Very high	96.4	Very high	39 Å²	39	38.5 Å²	38.5	40%	0.402	21%	0.209	S	C	.	.	S	Bend	trans	79.3	-0.2	-176.3	0	0	0	0	0	114.4	S436 W437	S436-G439 PolarHBondContact O-N 3.49Å; W437-G439 VanDerWaalsContact C-N 3.33Å
440	R	96.6	Very high	96.3	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.015	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-66	149.7	175.2	-67.7	168.6	63.5	87.9	-2.2	110.6	Y364 A365 Y369 S409 V410 A411 E415 Q435 S436 T438	Y364-R440 PolarHBondContact O-NH1 2.88Å; A365-R440 WeakPolarHBondContact O-CG 3.48Å; Y369-R440 PolarHBondContact OH-NH1 3.37Å; Y369-R440 PolarHBondContact OH-NH2 3.02Å; S409-R440 PolarHBondContact O-NE 3.29Å; S409-R440 PolarHBondContact O-NH2 3.09Å; S409-R440 PolarHBondContact OG-NE 2.94Å; V410-R440 VanDerWaalsContact CA-NH2 3.31Å; A411-R440 VanDerWaalsContact N-CZ 3.33Å; E415-R440 IonicContact OE1-CZ 3.5Å; E415-R440 IonicContact OE1-NH1 3.32Å; E415-R440 IonicContact OE1-NH2 3.7Å; E415-R440 PolarHBondContact OE1-NH2 3.08Å; E415-R440 IonicContact OE2-CZ 2.77Å; E415-R440 IonicContact OE2-NH1 3.09Å; E415-R440 PolarHBondContact OE2-NH1 3Å; E415-R440 IonicContact OE2-NH2 3.66Å; E415-R440 PolarHBondContact OE2-NH2 2.88Å; Q435-R440 CarbonylContact C-O 3.56Å; Q435-R440 WeakPolarHBondContact CA-O 3.41Å; S436-R440 PolarHBondContact N-O 3.37Å; T438-R440 PolarHBondContact O-N 2.72Å; T438-R440 WeakPolarHBondContact OG1-CD 3.29Å; T438-R440 VanDerWaalsContact OG1-CG 3.29Å; T438-R440 WeakPolarHBondContact OG1-CG 3.34Å
441	K	96.8	Very high	96.2	Very high	54 Å²	54	47.6 Å²	47.6	24%	0.235	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.6	-179	-76.4	-73.5	179.5	-173.7	0	111	S409 V410 W431 G433 Q435	S409-K441 CarbonylContact C-O 3.6Å; S409-K441 VanDerWaalsContact CA-O 3.23Å; S409-K441 WeakPolarHBondContact CA-O 3.29Å; V410-K441 HydrophobicContact CG2-CB 4.22Å; V410-K441 WeakPolarHBondContact CG2-O 2.99Å; V410-K441 PolarHBondContact N-O 2.93Å; V410-K441 PolarHBondContact O-N 2.7Å; W431-K441 HydrophobicContact CH2-CB 3.94Å; W431-K441 HydrophobicContact CH2-CG 4.08Å; W431-K441 HydrophobicContact CZ2-CB 3.95Å; W431-K441 HydrophobicContact CZ2-CD 4.34Å; W431-K441 HydrophobicContact CZ2-CG 3.66Å; G433-K441 PolarHBondContact O-NZ 2.03Å; G433-K441 VanDerWaalsContact O-NZ 3.13Å; Q435-K441 HydrophobicContact CG-CD 4.29Å
442	V	96.9	Very high	96.2	Very high	13 Å²	13	47.5 Å²	47.5	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.9	173.6	-178.8	0	0	0	0	108.7	V407 T432 Q434	V407-V442 HydrophobicContact CG1-CG1 3.5Å; V407-V442 VanDerWaalsContact CG1-CG1 3.5Å; T432-V442 PolarHBondContact OG1-O 2.04Å; Q434-V442 HydrophobicContact CB-CB 4.05Å; Q434-V442 HydrophobicContact CB-CG2 4.33Å; Q434-V442 PolarHBondContact O-N 3.05Å
443	V	97.3	Very high	96.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	150.8	-178.9	-60.8	0	0	0	0	110.7	V407 I408 V410 I429 V430 W431 F445	V407-V443 WeakPolarHBondContact CA-O 3.34Å; I408-V443 PolarHBondContact N-O 3.3Å; I408-V443 VanDerWaalsContact N-O 3.12Å; I408-V443 WeakPolarHBondContact O-CG2 3.41Å; I408-V443 PolarHBondContact O-N 3.22Å; V410-V443 HydrophobicContact CG1-CG2 3.87Å; V410-V443 HydrophobicContact CG2-CB 4.41Å; V410-V443 HydrophobicContact CG2-CG1 3.61Å; V410-V443 HydrophobicContact CG2-CG2 3.86Å; I429-V443 HydrophobicContact CG2-CB 4.01Å; I429-V443 HydrophobicContact CG2-CG1 4.45Å; I429-V443 HydrophobicContact CG2-CG2 4.37Å; V430-V443 WeakPolarHBondContact O-CA 3.4Å; V430-V443 WeakPolarHBondContact O-CB 3.01Å; W431-V443 HydrophobicContact CD2-CG1 4.23Å; W431-V443 HydrophobicContact CE3-CG1 3.54Å; W431-V443 HydrophobicContact CZ3-CG1 3.82Å; V443-F445 HydrophobicContact CG2-CE2 3.8Å; V443-F445 HydrophobicContact CG2-CZ 3.86Å
444	H	97.6	Very high	96.4	Very high	47 Å²	47	56.4 Å²	56.4	22%	0.218	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.9	174	-56.3	-117.8	0	0	0	109.3	C406 V407 I429 V430	C406-H444 CarbonylContact O-C 3.51Å; C406-H444 WeakPolarHBondContact O-CA 3.32Å; V407-H444 WeakPolarHBondContact CG2-ND1 3.29Å; I429-H444 CarbonylContact C-O 3.54Å; I429-H444 WeakPolarHBondContact CA-O 3.44Å; V430-H444 HydrophobicContact CB-CB 4.04Å; V430-H444 HydrophobicContact CG2-CB 4.34Å; V430-H444 PolarHBondContact N-O 3.33Å; V430-H444 PolarHBondContact O-N 3.46Å
445	F	97.1	Very high	96.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.8	170.6	-58.4	-85.6	0	0	0	109.9	Y395 C406 I408 A416 L419 C420 C426 I429 V443	Y395-F445 HydrophobicContact CE1-CB 4.22Å; Y395-F445 WeakPolarHBondContact CE1-O 3.46Å; Y395-F445 VanDerWaalsContact OH-CB 3.23Å; Y395-F445 WeakPolarHBondContact OH-CB 3.42Å; C406-F445 HydrophobicContact CB-CB 3.94Å; C406-F445 HydrophobicContact CB-CD2 4.41Å; C406-F445 PolarHBondContact O-N 3.19Å; C406-F445 WeakPolarHBondContact SG-CD2 3.19Å; I408-F445 HydrophobicContact CB-CE2 4.13Å; I408-F445 HydrophobicContact CD1-CD2 4.47Å; I408-F445 HydrophobicContact CD1-CE2 4.1Å; I408-F445 HydrophobicContact CG1-CE2 4.34Å; A416-F445 WeakPolarHBondContact O-CE1 3.04Å; L419-F445 HydrophobicContact CB-CE1 4.17Å; L419-F445 HydrophobicContact CB-CZ 3.79Å; L419-F445 HydrophobicContact CD1-CZ 4.31Å; C420-F445 HydrophobicContact CB-CD1 3.8Å; C420-F445 HydrophobicContact CB-CE1 3.79Å; C426-F445 VanDerWaalsContact SG-CD1 3.55Å; I429-F445 HydrophobicContact CD1-CE1 4.17Å; I429-F445 HydrophobicContact CG1-CD1 3.91Å; I429-F445 HydrophobicContact CG1-CE1 4.03Å; I429-F445 HydrophobicContact CG2-CD1 4.49Å; I429-F445 HydrophobicContact CG2-CE1 4.39Å; V443-F445 HydrophobicContact CG2-CE2 3.8Å; V443-F445 HydrophobicContact CG2-CZ 3.86Å
446	K	97.7	Very high	96.4	Very high	3 Å²	3	49.6 Å²	49.6	1%	0.013	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.8	-169.6	-59.8	-61.5	-162.6	161.9	0	110.8	L389 L392 H393 D394 L427 A428 V430 N448	L389-K446 HydrophobicContact CB-CD 4.47Å; L389-K446 HydrophobicContact CB-CG 4.44Å; L389-K446 HydrophobicContact CD1-CB 4.08Å; L389-K446 HydrophobicContact CD1-CG 3.86Å; L389-K446 VanDerWaalsContact O-CE 3.3Å; L389-K446 WeakPolarHBondContact O-CE 3.39Å; L389-K446 PolarHBondContact O-NZ 2.85Å; L392-K446 VanDerWaalsContact O-CD 3.3Å; L392-K446 WeakPolarHBondContact O-CD 3.02Å; L392-K446 WeakPolarHBondContact O-CE 3.49Å; L392-K446 PolarHBondContact O-NZ 3.15Å; H393-K446 HydrophobicContact CB-CB 4.27Å; H393-K446 WeakPolarHBondContact O-CA 2.99Å; D394-K446 IonicContact OD1-NZ 2.66Å; D394-K446 PolarHBondContact OD1-NZ 3.01Å; D394-K446 IonicContact OD2-NZ 3.27Å; D394-K446 PolarHBondContact OD2-NZ 3.21Å; L427-K446 PolarHBondContact N-O 3.03Å; A428-K446 HydrophobicContact CB-CB 4.09Å; A428-K446 PolarHBondContact N-O 2.03Å; A428-K446 PolarHBondContact O-N 3.06Å; V430-K446 HydrophobicContact CG2-CD 4.44Å; V430-K446 HydrophobicContact CG2-CG 3.85Å; K446-N448 VanDerWaalsContact C-N 3.34Å
447	S	96.5	Very high	96.4	Very high	46 Å²	46	56.2 Å²	56.2	32%	0.322	30%	0.302	S	S	.	.	S	Bend	trans	-85.1	-5.5	-177.3	59	0	0	0	0	114.5	H393 G425 L427	H393-S447 PolarHBondContact O-N 2.78Å; H393-S447 PolarHBondContact O-OG 3.44Å; H393-S447 VanDerWaalsContact O-OG 3.14Å; G425-S447 VanDerWaalsContact O-CA 3.24Å; G425-S447 WeakPolarHBondContact O-CA 3.48Å; L427-S447 WeakPolarHBondContact CD1-O 3.03Å; L427-S447 WeakPolarHBondContact CG-O 3.49Å
448	N	95.9	Very high	96.5	Very high	73 Å²	73	53.1 Å²	53.1	39%	0.39	29%	0.292	S	S	.	.			trans	-160.9	172.3	177.3	-154.7	-15	0	0	0	110.6	H393 K446	H393-N448 HydrophobicContact CB-CB 4.13Å; H393-N448 PolarHBondContact CD2-O 3.44Å; K446-N448 VanDerWaalsContact C-N 3.34Å
449	F	95.2	Very high	96.5	Very high	49 Å²	49	52.5 Å²	52.5	22%	0.215	29%	0.289	C	S	.	.			trans	-133.5	83.6	173.8	178.5	-110.6	0	0	0	110.2	Y384 L389 A428 A452 V460 V462	Y384-F449 HydrophobicContact CD1-CE1 4.27Å; Y384-F449 AromaticContact CD1-CZ 3.92Å; Y384-F449 HydrophobicContact CD1-CZ 3.92Å; Y384-F449 AromaticContact CD2-CE1 3.95Å; Y384-F449 HydrophobicContact CD2-CE1 3.95Å; Y384-F449 HydrophobicContact CD2-CE2 4.32Å; Y384-F449 AromaticContact CD2-CZ 3.67Å; Y384-F449 HydrophobicContact CD2-CZ 3.67Å; Y384-F449 AromaticContact CE1-CE1 3.98Å; Y384-F449 HydrophobicContact CE1-CE1 3.98Å; Y384-F449 HydrophobicContact CE1-CZ 4.11Å; Y384-F449 HydrophobicContact CE2-CD1 4.35Å; Y384-F449 AromaticContact CE2-CE1 3.64Å; Y384-F449 HydrophobicContact CE2-CE1 3.64Å; Y384-F449 AromaticContact CE2-CZ 3.88Å; Y384-F449 HydrophobicContact CE2-CZ 3.88Å; Y384-F449 HydrophobicContact CG-CE1 4.25Å; Y384-F449 HydrophobicContact CG-CE2 4.45Å; Y384-F449 AromaticContact CG-CZ 3.69Å; Y384-F449 HydrophobicContact CG-CZ 3.69Å; Y384-F449 AromaticContact CZ-CE1 3.65Å; L389-F449 HydrophobicContact CD1-CD2 4.09Å; L389-F449 HydrophobicContact CD2-CD2 4.48Å; A428-F449 HydrophobicContact CB-CB 4.32Å; F449-A452 HydrophobicContact CD2-CB 4.46Å; F449-A452 HydrophobicContact CE2-CB 3.7Å; F449-A452 HydrophobicContact CZ-CB 4.09Å; F449-V460 HydrophobicContact CD2-CB 4.48Å; F449-V460 HydrophobicContact CD2-CG1 3.77Å; F449-V460 HydrophobicContact CE2-CB 4.08Å; F449-V460 HydrophobicContact CE2-CG1 3.86Å; F449-V460 HydrophobicContact CE2-CG2 4.4Å; F449-V462 HydrophobicContact CB-CG1 4.06Å; F449-V462 HydrophobicContact CB-CG2 3.83Å; F449-V462 HydrophobicContact CD1-CG1 4.37Å; F449-V462 HydrophobicContact CD1-CG2 3.58Å; F449-V462 HydrophobicContact CD2-CG2 3.64Å; F449-V462 HydrophobicContact CE1-CG2 3.97Å; F449-V462 HydrophobicContact CE2-CG2 4.04Å; F449-V462 HydrophobicContact CG-CG1 4.36Å; F449-V462 HydrophobicContact CG-CG2 3.39Å; F449-V462 HydrophobicContact CZ-CG2 4.19Å
450	T	95.6	Very high	96.6	Very high	63 Å²	63	50.7 Å²	50.7	39%	0.387	27%	0.27	S	S	.	.			trans	-139.3	154.1	171.9	60.3	0	0	0	0	110.1	L389 H393 A452	L389-T450 WeakPolarHBondContact CD2-O 3.24Å; H393-T450 PolarHBondContact CE1-OG1 2.88Å; H393-T450 PolarHBondContact NE2-N 2.93Å; H393-T450 PolarHBondContact NE2-O 3.42Å; H393-T450 PolarHBondContact NE2-OG1 3.32Å; H393-T450 VanDerWaalsContact NE2-OG1 3.07Å; T450-A452 VanDerWaalsContact C-N 3.26Å; T450-A452 PolarHBondContact O-N 2.83Å
451	N	95.7	Very high	96.7	Very high	129 Å²	129	51.5 Å²	51.5	69%	0.69	27%	0.273	S	S	*	.	S	Bend	trans	56.6	37.9	-179.6	-54.1	-33.2	0	0	0	113.4	L392 V453	L392-N451 HydrophobicContact CD1-CB 4.05Å; L392-N451 WeakPolarHBondContact CD1-O 3.24Å; N451-V453 PolarHBondContact O-N 2.95Å
452	A	96.3	Very high	96.6	Very high	46 Å²	46	50.1 Å²	50.1	38%	0.38	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-61	136.8	175	0	0	0	0	0	110.5	D388 L389 F449 T450	D388-A452 WeakPolarHBondContact O-CA 3.45Å; L389-A452 HydrophobicContact CD2-CB 4.12Å; F449-A452 HydrophobicContact CD2-CB 4.46Å; F449-A452 HydrophobicContact CE2-CB 3.7Å; F449-A452 HydrophobicContact CZ-CB 4.09Å; T450-A452 VanDerWaalsContact C-N 3.26Å; T450-A452 PolarHBondContact O-N 2.83Å
453	V	97.1	Very high	96.4	Very high	67 Å²	67	52.1 Å²	52.1	41%	0.406	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	153.2	176.6	-59.1	0	0	0	0	109.9	A387 D388 P390 N451 S455	A387-V453 CarbonylContact C-O 3.46Å; A387-V453 WeakPolarHBondContact CA-O 3.34Å; D388-V453 HydrophobicContact CB-CG2 4.08Å; D388-V453 PolarHBondContact N-O 3.44Å; D388-V453 PolarHBondContact O-N 2.89Å; P390-V453 VanDerWaalsContact CD-CG2 3.47Å; P390-V453 HydrophobicContact CG-CG2 3.75Å; N451-V453 PolarHBondContact O-N 2.95Å; V453-S455 PolarHBondContact O-N 3.38Å
454	Y	97.3	Very high	96	Very high	180 Å²	180	56.8 Å²	56.8	71%	0.706	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.1	172.8	179.6	-94.3	0	0	0	110.3	H386 P456	H386-Y454 HydrophobicContact CB-CD2 3.95Å; H386-Y454 HydrophobicContact CB-CE2 3.49Å; H386-Y454 VanDerWaalsContact CB-CE2 3.49Å; H386-Y454 CarbonylContact O-C 3.6Å; H386-Y454 WeakPolarHBondContact O-CA 3.45Å; H386-Y454 WeakPolarHBondContact O-CD2 3.38Å; Y454-P456 HydrophobicContact CE1-CB 4.41Å; Y454-P456 HydrophobicContact CE1-CG 4.46Å
455	S	96.7	Very high	94.7	Very high	21 Å²	21	60 Å²	60	15%	0.147	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	113.9	174.5	171.7	0	0	0	0	109.7	H386 V453 E457 T458	H386-S455 CarbonylContact C-O 3.53Å; H386-S455 WeakPolarHBondContact CA-O 3.38Å; H386-S455 PolarHBondContact O-N 2.87Å; V453-S455 PolarHBondContact O-N 3.38Å; S455-E457 PolarHBondContact O-N 3.02Å; S455-T458 WeakPolarHBondContact CB-OG1 3.32Å; S455-T458 PolarHBondContact O-N 3.02Å; S455-T458 PolarHBondContact OG-OG1 3.32Å; S455-T458 VanDerWaalsContact OG-OG1 3.08Å
456	P	95.3	Very high	92.6	Very high	83 Å²	83	73.3 Å²	73.3	54%	0.539	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	-21.2	-174.2	26.3	-33.1	0	0	0	113.4	H386 Y454	H386-P456 PolarHBondContact ND1-O 3.16Å; Y454-P456 HydrophobicContact CE1-CB 4.41Å; Y454-P456 HydrophobicContact CE1-CG 4.46Å
457	E	94.6	Very high	92.3	Very high	159 Å²	159	76.8 Å²	76.8	74%	0.743	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	-7.6	-172.8	-58.9	-174	173.4	0	0	114	S455	S455-E457 PolarHBondContact O-N 3.02Å
458	T	97.4	Very high	92.1	Very high	18 Å²	18	78.4 Å²	78.4	11%	0.11	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	161.5	-172.9	61.4	0	0	0	0	112.6	H386 A387 D388 V430 W431 S455	H386-T458 VanDerWaalsContact CA-O 3.31Å; H386-T458 WeakPolarHBondContact CA-O 3.43Å; H386-T458 PolarHBondContact N-O 2.93Å; H386-T458 VanDerWaalsContact N-O 3.15Å; A387-T458 PolarHBondContact N-O 3.3Å; A387-T458 CarbonylContact O-C 3.57Å; A387-T458 WeakPolarHBondContact O-CB 3.29Å; A387-T458 PolarHBondContact O-OG1 3.16Å; D388-T458 WeakPolarHBondContact CB-OG1 3.36Å; V430-T458 HydrophobicContact CG1-CG2 4.4Å; W431-T458 VanDerWaalsContact O-CA 3.3Å; W431-T458 WeakPolarHBondContact O-CA 3.44Å; S455-T458 WeakPolarHBondContact CB-OG1 3.32Å; S455-T458 PolarHBondContact O-N 3.02Å; S455-T458 PolarHBondContact OG-OG1 3.32Å; S455-T458 VanDerWaalsContact OG-OG1 3.08Å
459	A	97.9	Very high	91.9	Very high	9 Å²	9	78.7 Å²	78.7	7%	0.074	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	143.1	169.4	0	0	0	0	0	110	Y384 W431 Y461	Y384-A459 CarbonylContact O-C 3.04Å; Y384-A459 WeakPolarHBondContact O-CA 3.16Å; W431-A459 VanDerWaalsContact CB-O 3.32Å; W431-A459 WeakPolarHBondContact CB-O 3.49Å; W431-A459 PolarHBondContact N-O 2.87Å; W431-A459 PolarHBondContact O-N 3.47Å; W431-A459 VanDerWaalsContact O-N 3.08Å; A459-Y461 HydrophobicContact CB-CE2 4.33Å
460	V	98	Very high	91.7	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.1	176.6	-174.4	0	0	0	0	110.2	K383 Y384 A387 L389 A428 I429 V430 F449 V462	K383-V460 CarbonylContact C-O 3.51Å; K383-V460 WeakPolarHBondContact CA-O 3.45Å; Y384-V460 PolarHBondContact N-O 3.31Å; Y384-V460 PolarHBondContact O-N 3.15Å; A387-V460 HydrophobicContact CB-CB 4.39Å; A387-V460 HydrophobicContact CB-CG2 3.88Å; A387-V460 WeakPolarHBondContact O-CG2 3.41Å; L389-V460 HydrophobicContact CD1-CG1 4.45Å; A428-V460 HydrophobicContact CB-CG1 3.97Å; I429-V460 CarbonylContact O-C 3.52Å; I429-V460 VanDerWaalsContact O-CA 3.32Å; I429-V460 WeakPolarHBondContact O-CA 3.31Å; V430-V460 HydrophobicContact CG2-CG2 4.33Å; F449-V460 HydrophobicContact CD2-CB 4.48Å; F449-V460 HydrophobicContact CD2-CG1 3.77Å; F449-V460 HydrophobicContact CE2-CB 4.08Å; F449-V460 HydrophobicContact CE2-CG1 3.86Å; F449-V460 HydrophobicContact CE2-CG2 4.4Å; V460-V462 HydrophobicContact CG1-CG2 3.95Å
461	Y	97	Very high	91.4	Very high	22 Å²	22	81.6 Å²	81.6	9%	0.086	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114.3	171	-62.6	-93.9	0	0	0	108.9	V382 K383 L413 A428 I429 W431 A459	V382-Y461 CarbonylContact O-C 3.58Å; V382-Y461 WeakPolarHBondContact O-CA 3.36Å; K383-Y461 HydrophobicContact CB-CD1 3.95Å; K383-Y461 HydrophobicContact CB-CE1 3.8Å; K383-Y461 HydrophobicContact CD-CE1 3.73Å; K383-Y461 WeakPolarHBondContact CE-OH 3.07Å; K383-Y461 HydrophobicContact CG-CD1 4.1Å; K383-Y461 HydrophobicContact CG-CE1 3.62Å; L413-Y461 HydrophobicContact CD1-CD1 4.06Å; L413-Y461 HydrophobicContact CD1-CD2 3.75Å; L413-Y461 HydrophobicContact CD1-CE1 3.91Å; L413-Y461 HydrophobicContact CD1-CE2 3.59Å; L413-Y461 HydrophobicContact CD1-CG 3.98Å; L413-Y461 HydrophobicContact CD2-CD1 4.21Å; L413-Y461 HydrophobicContact CD2-CE1 3.48Å; L413-Y461 VanDerWaalsContact CD2-CE1 3.48Å; L413-Y461 HydrophobicContact CD2-CE2 4.37Å; L413-Y461 HydrophobicContact CG-CE1 4.32Å; A428-Y461 CarbonylContact C-O 3.55Å; A428-Y461 VanDerWaalsContact CA-O 3.25Å; A428-Y461 WeakPolarHBondContact CA-O 3.32Å; I429-Y461 PolarHBondContact N-O 3.23Å; I429-Y461 PolarHBondContact O-N 2.8Å; W431-Y461 HydrophobicContact CB-CD2 4.07Å; W431-Y461 HydrophobicContact CB-CE2 3.65Å; W431-Y461 HydrophobicContact CD2-CE2 4.41Å; W431-Y461 HydrophobicContact CG-CE2 4.02Å; A459-Y461 HydrophobicContact CB-CE2 4.33Å
462	V	96	Very high	91.2	Very high	24 Å²	24	78.4 Å²	78.4	15%	0.145	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.1	-176.6	-176.3	0	0	0	0	109.4	F381 V382 Y384 A428 F449 V460 L464	F381-V462 CarbonylContact C-O 3.52Å; F381-V462 WeakPolarHBondContact CA-O 3.5Å; V382-V462 PolarHBondContact N-O 3.32Å; V382-V462 PolarHBondContact O-N 3.47Å; Y384-V462 HydrophobicContact CD2-CG2 3.69Å; Y384-V462 HydrophobicContact CE2-CB 4.09Å; Y384-V462 HydrophobicContact CE2-CG2 3.56Å; A428-V462 HydrophobicContact CB-CG2 4.3Å; F449-V462 HydrophobicContact CB-CG1 4.06Å; F449-V462 HydrophobicContact CB-CG2 3.83Å; F449-V462 HydrophobicContact CD1-CG1 4.37Å; F449-V462 HydrophobicContact CD1-CG2 3.58Å; F449-V462 HydrophobicContact CD2-CG2 3.64Å; F449-V462 HydrophobicContact CE1-CG2 3.97Å; F449-V462 HydrophobicContact CE2-CG2 4.04Å; F449-V462 HydrophobicContact CG-CG1 4.36Å; F449-V462 HydrophobicContact CG-CG2 3.39Å; F449-V462 HydrophobicContact CZ-CG2 4.19Å; V460-V462 HydrophobicContact CG1-CG2 3.95Å; V462-L464 PolarHBondContact O-N 2.75Å
463	K	92.4	Very high	90.8	Very high	55 Å²	55	80.7 Å²	80.7	24%	0.239	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	120.1	176	-165.2	177.3	-174.6	177.2	0	108.3	G380 F381 C420 S421 C426 L427 S465	G380-K463 CarbonylContact O-C 3.6Å; G380-K463 WeakPolarHBondContact O-CA 3.34Å; F381-K463 HydrophobicContact CD1-CB 4.18Å; F381-K463 HydrophobicContact CE1-CB 3.68Å; F381-K463 HydrophobicContact CE1-CG 4.15Å; F381-K463 HydrophobicContact CE2-CG 4.39Å; F381-K463 HydrophobicContact CZ-CB 3.99Å; F381-K463 HydrophobicContact CZ-CD 4.36Å; F381-K463 HydrophobicContact CZ-CG 3.92Å; C420-K463 PolarHBondContact O-NZ 3.47Å; S421-K463 PolarHBondContact O-NZ 2.87Å; C426-K463 WeakPolarHBondContact O-CD 3.45Å; L427-K463 WeakPolarHBondContact O-CB 3.24Å; L427-K463 PolarHBondContact O-N 3.32Å; K463-S465 PolarHBondContact O-N 3.42Å
464	L	88	Confident	90.3	Very high	98 Å²	98	81.8 Å²	81.8	51%	0.513	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-66.5	122.7	167.6	-68.2	175	0	0	0	107	G380 V382 V462 R466	G380-L464 WeakPolarHBondContact O-CB 3.09Å; G380-L464 PolarHBondContact O-N 2.84Å; V382-L464 HydrophobicContact CG2-CD1 4.04Å; V382-L464 HydrophobicContact CG2-CD2 3.55Å; V382-L464 HydrophobicContact CG2-CG 3.91Å; V462-L464 PolarHBondContact O-N 2.75Å; L464-R466 PolarHBondContact O-N 3.42Å
465	S	70.7	Confident	89.7	Confident	114 Å²	114	73.6 Å²	73.6	80%	0.797	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-54.8	131.3	168.8	50.9	0	0	0	0	108.6	K463	K463-S465 PolarHBondContact O-N 3.42Å
466	R	52.7	Low	89.1	Confident	280 Å²	280	78.4 Å²	78.4	100%	1.057	39%	0.391	S	S	*	.			trans	-70.1	0	158.6	-85.4	-168.6	-179.2	166.7	4.1	109.3	L464	L464-R466 PolarHBondContact O-N 3.42Å

Retrieved 466 of 466 residues in 434.2 ms (Link to these results)

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