A0A077ZAV1_TRITR Loading...

Ubiquitin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAV1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 285 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	58.2	Low	53.3	Low	244 Å²	244	136.8 Å²	136.8	100%	1.202	84%	0.84	S	S	*	*				0	125.4	0	-74.2	-179.3	166.4	0	0	107
2	G	60.5	Low	52.4	Low	78 Å²	78	135.6 Å²	135.6	80%	0.804	83%	0.832	S	S	*	*			trans	-63.3	137.6	-154	0	0	0	0	0	116
3	S	48.6	Very low	52	Low	128 Å²	128	139 Å²	139	90%	0.895	83%	0.829	S	S	*	*			trans	-86.1	119.1	160.1	-57.9	0	0	0	0	108.6
4	C	64.9	Low	51.4	Low	127 Å²	127	135.8 Å²	135.8	86%	0.858	82%	0.817	S	S	*	*			trans	-116.1	131.7	172.8	30.2	0	0	0	0	110.5
5	L	54.4	Low	51	Low	181 Å²	181	136.7 Å²	136.7	95%	0.948	82%	0.815	S	S	*	*			trans	-77.6	147.5	-178.7	-63.3	133.9	0	0	0	111
6	G	46.5	Very low	50.6	Low	81 Å²	81	138.3 Å²	138.3	84%	0.835	82%	0.818	S	S	*	*			trans	-147.3	74.2	170.7	0	0	0	0	0	111.4	G8	G6-G8 PolarHBondContact O-N 3.44Å
7	R	52.5	Low	50.2	Low	250 Å²	250	138.6 Å²	138.6	94%	0.943	81%	0.812	S	S	*	*			trans	-80.3	104.1	169.2	-174.6	176.1	-176.8	-166.1	-0	107.7
8	G	47.9	Very low	49.8	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	82%	0.818	S	S	*	*			trans	-101.3	113.4	174.3	0	0	0	0	0	110.5	G6	G6-G8 PolarHBondContact O-N 3.44Å
9	H	54.9	Low	49.4	Very low	154 Å²	154	143 Å²	143	71%	0.713	82%	0.821	S	S	*	*			trans	-63.5	133.9	-169.6	-164.9	-113.8	0	0	0	113.5	A11	H9-A11 PolarHBondContact O-N 3.4Å; H9-A11 VanDerWaalsContact O-N 3.11Å
10	V	49.8	Very low	48.8	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	80%	0.804	S	S	*	*			trans	-67.7	103.3	159.1	175.7	0	0	0	0	106.4	T12	V10-T12 PolarHBondContact O-N 2.88Å
11	A	47.8	Very low	48.8	Very low	56 Å²	56	140.6 Å²	140.6	46%	0.463	80%	0.804	S	S	.	*			trans	-83.3	89.3	-179.3	0	0	0	0	0	110.5	H9 F13	H9-A11 PolarHBondContact O-N 3.4Å; H9-A11 VanDerWaalsContact O-N 3.11Å; A11-F13 HydrophobicContact CB-CD2 3.49Å; A11-F13 VanDerWaalsContact CB-CD2 3.49Å; A11-F13 HydrophobicContact CB-CE2 3.26Å; A11-F13 HydrophobicContact CB-CZ 4.23Å; A11-F13 PolarHBondContact O-N 2.78Å
12	T	42.8	Very low	48	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	77%	0.774	S	S	*	*			trans	-76.9	96.8	153.7	-38.4	0	0	0	0	106.1	V10	V10-T12 PolarHBondContact O-N 2.88Å
13	F	47.1	Very low	47.4	Very low	180 Å²	180	138 Å²	138	79%	0.789	78%	0.779	S	S	*	*			trans	-99.9	118	171.3	-75.2	-66.9	0	0	0	109.2	A11	A11-F13 HydrophobicContact CB-CD2 3.49Å; A11-F13 VanDerWaalsContact CB-CD2 3.49Å; A11-F13 HydrophobicContact CB-CE2 3.26Å; A11-F13 HydrophobicContact CB-CZ 4.23Å; A11-F13 PolarHBondContact O-N 2.78Å
14	S	44.2	Very low	47.3	Very low	94 Å²	94	135 Å²	135	66%	0.657	77%	0.768	S	S	*	*			trans	-60.3	148.1	177.2	-59.7	0	0	0	0	113.3	D16	S14-D16 PolarHBondContact O-N 2.72Å
15	D	45.5	Very low	46.9	Very low	149 Å²	149	137 Å²	137	80%	0.797	76%	0.762	S	S	*	*			trans	-0.5	102.1	143	-57.3	-88.7	0	0	0	116.3
16	D	44.6	Very low	47.3	Very low	162 Å²	162	131.7 Å²	131.7	87%	0.866	74%	0.74	S	S	*	*			trans	-169.3	74	156.4	-87.9	-48.8	0	0	0	109.3	S14	S14-D16 PolarHBondContact O-N 2.72Å
17	M	43.1	Very low	48.3	Very low	145 Å²	145	133.3 Å²	133.3	71%	0.714	72%	0.724	S	S	*	*			trans	-163.6	57.2	162.9	-157.8	83.1	117.7	0	0	112.2	N19 T20	M17-N19 PolarHBondContact O-N 2.64Å; M17-T20 WeakPolarHBondContact CE-OG1 3.37Å; M17-T20 WeakPolarHBondContact CG-OG1 3.33Å; M17-T20 PolarHBondContact SD-OG1 2.79Å; M17-T20 VanDerWaalsContact SD-OG1 3.42Å
18	E	43.2	Very low	49.4	Very low	195 Å²	195	126 Å²	126	91%	0.911	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	127.7	160.6	-75.6	173.5	114.8	0	0	108.4
19	N	41.4	Very low	50.6	Low	165 Å²	165	123.1 Å²	123.1	88%	0.882	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.3	13.3	179.1	-65.6	-7.4	0	0	0	120.7	M17	M17-N19 PolarHBondContact O-N 2.64Å
20	T	37.7	Very low	51.2	Low	78 Å²	78	118.4 Å²	118.4	48%	0.479	66%	0.658	S	S	.	*			trans	-91.7	117.7	162	-55.4	0	0	0	0	109.8	M17 T22	M17-T20 WeakPolarHBondContact CE-OG1 3.37Å; M17-T20 WeakPolarHBondContact CG-OG1 3.33Å; M17-T20 PolarHBondContact SD-OG1 2.79Å; M17-T20 VanDerWaalsContact SD-OG1 3.42Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 2.83Å
21	I	49.2	Very low	52	Low	157 Å²	157	119.2 Å²	119.2	81%	0.805	65%	0.653	S	S	*	*			trans	-57.2	92.4	175.8	-61.2	163.8	0	0	0	108.1	I23	I21-I23 PolarHBondContact O-N 3.41Å; I21-I23 VanDerWaalsContact O-N 3.11Å
22	T	40.7	Very low	52.6	Low	93 Å²	93	124.2 Å²	124.2	57%	0.571	67%	0.667	S	S	*	*			trans	-73.1	102	175.6	53.2	0	0	0	0	108.5	T20 G24	T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 2.83Å; T22-G24 PolarHBondContact O-N 2.94Å
23	I	47.9	Very low	53.6	Low	175 Å²	175	126.6 Å²	126.6	90%	0.897	66%	0.662	S	S	*	*	S	Bend	trans	-57.7	77.7	161	-67.5	163	0	0	0	108.2	I21	I21-I23 PolarHBondContact O-N 3.41Å; I21-I23 VanDerWaalsContact O-N 3.11Å
24	G	47.9	Very low	54.7	Low	66 Å²	66	120.5 Å²	120.5	68%	0.68	64%	0.637	S	S	*	*			trans	-172.9	18.6	-172.3	0	0	0	0	0	116.4	T22	T22-G24 PolarHBondContact O-N 2.94Å
25	K	55.8	Low	55.5	Low	167 Å²	167	124.4 Å²	124.4	73%	0.726	64%	0.642	S	S	*	*			trans	-133.5	40.9	-177.6	-64.6	176.1	178.6	171	0	112.7	K27	K25-K27 PolarHBondContact O-N 3Å
26	S	62.9	Low	56.7	Low	70 Å²	70	119.4 Å²	119.4	49%	0.49	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-64.1	129.9	162.3	50.4	0	0	0	0	108.1
27	K	68.4	Low	57.8	Low	116 Å²	116	119 Å²	119	50%	0.504	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-81.5	139.9	171.4	-69.6	178.4	-172.8	157.5	0	108.1	K25 L97 P98	K25-K27 PolarHBondContact O-N 3Å; K27-L97 PolarHBondContact N-O 3.47Å; K27-P98 WeakPolarHBondContact CD-O 3.35Å; K27-P98 PolarHBondContact NZ-O 2.98Å
28	P	74.1	Confident	58.9	Low	97 Å²	97	112.8 Å²	112.8	63%	0.63	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-59.1	149.2	172.3	27.3	-34.2	0	0	0	109.6	T30	P28-T30 PolarHBondContact O-N 2.87Å; P28-T30 VanDerWaalsContact O-N 3.15Å
29	L	73.1	Confident	60	Low	16 Å²	16	111.1 Å²	111.1	8%	0.084	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-52.9	119.9	179.1	-179.8	67.2	0	0	0	109.8	Q31 F83 A86 Q87 L90 L97 G100 L102	L29-Q31 PolarHBondContact O-N 3.08Å; L29-F83 HydrophobicContact CD2-CD1 4.01Å; L29-F83 HydrophobicContact CG-CD1 4.45Å; L29-A86 HydrophobicContact CD2-CB 3.63Å; L29-Q87 VanDerWaalsContact CB-OE1 3.3Å; L29-L90 HydrophobicContact CB-CD1 4.45Å; L29-L90 HydrophobicContact CD1-CD1 4.48Å; L29-L97 HydrophobicContact CB-CD1 4.35Å; L29-L97 HydrophobicContact CD1-CD1 3.82Å; L29-G100 WeakPolarHBondContact CA-O 3.45Å; L29-L102 HydrophobicContact CD1-CD1 4.11Å; L29-L102 HydrophobicContact CD1-CD2 4.11Å; L29-L102 HydrophobicContact CD1-CG 3.62Å
30	T	67.8	Low	61.5	Low	55 Å²	55	108.3 Å²	108.3	34%	0.337	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-64.2	126	176.3	54	0	0	0	0	109	P28 E32 G100	P28-T30 PolarHBondContact O-N 2.87Å; P28-T30 VanDerWaalsContact O-N 3.15Å; T30-E32 PolarHBondContact O-N 2.88Å; T30-G100 PolarHBondContact N-O 3.03Å; T30-G100 PolarHBondContact OG1-O 2.93Å; T30-G100 VanDerWaalsContact OG1-O 3.09Å
31	Q	66.4	Low	62.9	Low	146 Å²	146	108 Å²	108	68%	0.682	56%	0.559	S	S	*	*			trans	-68.5	2.4	175.4	-61.2	178.9	-38.7	0	0	113.2	L29 R33 F83	L29-Q31 PolarHBondContact O-N 3.08Å; Q31-R33 PolarHBondContact O-N 2.86Å; Q31-F83 HydrophobicContact CB-CD1 4.44Å; Q31-F83 HydrophobicContact CB-CD2 3.98Å; Q31-F83 HydrophobicContact CB-CE1 4.44Å; Q31-F83 HydrophobicContact CB-CE2 3.97Å; Q31-F83 HydrophobicContact CB-CG 4.21Å; Q31-F83 HydrophobicContact CB-CZ 4.2Å; Q31-F83 HydrophobicContact CG-CB 4.09Å; Q31-F83 HydrophobicContact CG-CD1 4.39Å; Q31-F83 HydrophobicContact CG-CD2 3.81Å; Q31-F83 HydrophobicContact CG-CE2 4.32Å; Q31-F83 HydrophobicContact CG-CG 3.83Å; Q31-F83 VanDerWaalsContact O-CZ 3.25Å; Q31-F83 WeakPolarHBondContact O-CZ 3.43Å
32	E	60.3	Low	63.8	Low	160 Å²	160	101.2 Å²	101.2	75%	0.748	52%	0.524	S	S	*	.			trans	-79.4	118.7	-177.9	-67.5	-153.9	123.3	0	0	111.1	T30 I34	T30-E32 PolarHBondContact O-N 2.88Å; E32-I34 PolarHBondContact O-N 2.77Å; E32-I34 VanDerWaalsContact O-N 3.16Å
33	R	65.1	Low	65.6	Low	173 Å²	173	97.5 Å²	97.5	65%	0.653	50%	0.502	S	S	*	.			trans	-64.2	114.8	168.3	-67.5	-175.1	173.3	-166.5	-5.5	108.8	Q31 K35 E79	Q31-R33 PolarHBondContact O-N 2.86Å; R33-K35 PolarHBondContact O-N 3.4Å; R33-E79 PolarHBondContact NH2-O 3.21Å
34	I	68.8	Low	67.2	Low	51 Å²	51	92.6 Å²	92.6	26%	0.262	48%	0.478	S	S	.	.			trans	-59.7	111.2	176.7	-58.9	172.4	0	0	0	108.3	E32 W36 V117 L120 S121	E32-I34 PolarHBondContact O-N 2.77Å; E32-I34 VanDerWaalsContact O-N 3.16Å; I34-W36 PolarHBondContact O-N 3.32Å; I34-V117 HydrophobicContact CD1-CG1 4.48Å; I34-V117 HydrophobicContact CG2-CB 4.5Å; I34-V117 HydrophobicContact CG2-CG1 3.91Å; I34-L120 HydrophobicContact CD1-CD1 4Å; I34-S121 WeakPolarHBondContact O-CB 3.43Å; I34-S121 PolarHBondContact O-OG 3.15Å
35	K	62	Low	68.7	Low	177 Å²	177	93.1 Å²	93.1	77%	0.77	47%	0.468	S	S	*	.			trans	-85.1	109	176.3	-65.9	177.1	-173.9	172.1	0	108.4	R33 M124	R33-K35 PolarHBondContact O-N 3.4Å; K35-M124 HydrophobicContact CB-CE 4.35Å; K35-M124 HydrophobicContact CD-CE 4.42Å
36	W	70.6	Confident	70.1	Confident	44 Å²	44	89.2 Å²	89.2	17%	0.167	45%	0.452	C	S	.	.			trans	-122.8	157.2	175.2	74.1	-75.9	0	0	0	111.9	I34 L47 V117 Y118 S121 P123 M124	I34-W36 PolarHBondContact O-N 3.32Å; W36-L47 HydrophobicContact CH2-CD1 4.23Å; W36-L47 HydrophobicContact CZ2-CD1 4.08Å; W36-V117 HydrophobicContact CB-CB 4.46Å; W36-V117 HydrophobicContact CB-CG2 4.12Å; W36-V117 HydrophobicContact CD2-CB 4.5Å; W36-V117 HydrophobicContact CD2-CG2 3.87Å; W36-V117 HydrophobicContact CE3-CG2 4.15Å; W36-V117 HydrophobicContact CG-CB 4.14Å; W36-V117 HydrophobicContact CG-CG2 3.85Å; W36-V117 PolarHBondContact NE1-O 3.05Å; W36-Y118 VanDerWaalsContact CZ2-CA 3.46Å; W36-Y118 VanDerWaalsContact CZ2-CB 3.46Å; W36-S121 PolarHBondContact NE1-O 2.76Å; W36-S121 PolarHBondContact NE1-OG 3.33Å; W36-P123 HydrophobicContact CD2-CB 4Å; W36-P123 HydrophobicContact CE3-CB 4.21Å; W36-P123 HydrophobicContact CH2-CB 3.7Å; W36-P123 HydrophobicContact CH2-CG 3.85Å; W36-P123 HydrophobicContact CZ2-CB 3.46Å; W36-P123 VanDerWaalsContact CZ2-CB 3.46Å; W36-P123 VanDerWaalsContact CZ2-CD 3.47Å; W36-P123 HydrophobicContact CZ2-CG 3.54Å; W36-P123 HydrophobicContact CZ3-CB 4.08Å; W36-P123 WeakPolarHBondContact O-CA 3.5Å; W36-M124 PolarHBondContact O-N 3.2Å
37	K	67	Low	71	Confident	154 Å²	154	86.3 Å²	86.3	67%	0.67	43%	0.431	S	S	*	.			trans	-119.4	133.2	172.9	60.9	178.8	-176.9	177.1	0	108
38	S	66	Low	71.7	Confident	14 Å²	14	84.2 Å²	84.2	10%	0.098	42%	0.424	C	S	.	.			trans	-78.9	141.2	166.4	59	0	0	0	0	109.1	V40	S38-V40 VanDerWaalsContact C-N 3.27Å; S38-V40 WeakPolarHBondContact CB-O 3.4Å; S38-V40 PolarHBondContact OG-O 2.98Å
39	D	66.5	Low	72.2	Confident	160 Å²	160	82.9 Å²	82.9	86%	0.856	42%	0.418	S	S	*	.	S	Bend	trans	-66.4	-35	176.1	-65.5	-42.1	0	0	0	111.4
40	V	73.7	Confident	72.7	Confident	105 Å²	105	86.1 Å²	86.1	64%	0.636	43%	0.431	S	S	*	.	S	Bend	trans	-104.4	133.7	173.4	-177.1	0	0	0	0	108.4	S38 V42	S38-V40 VanDerWaalsContact C-N 3.27Å; S38-V40 WeakPolarHBondContact CB-O 3.4Å; S38-V40 PolarHBondContact OG-O 2.98Å; V40-V42 WeakPolarHBondContact O-CG2 3.46Å; V40-V42 PolarHBondContact O-N 3.33Å; V40-V42 VanDerWaalsContact O-N 3.14Å
41	P	66.4	Low	73.7	Confident	72 Å²	72	86.1 Å²	86.1	47%	0.468	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-60.2	116.7	172	22.6	-31	0	0	0	110.2	V127	P41-V127 HydrophobicContact CB-CG2 3.44Å; P41-V127 VanDerWaalsContact CB-CG2 3.44Å
42	V	69.3	Low	74.6	Confident	14 Å²	14	82.5 Å²	82.5	9%	0.085	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	141.6	179.3	180	0	0	0	0	108.9	V40 E46 L47 V127	V40-V42 WeakPolarHBondContact O-CG2 3.46Å; V40-V42 PolarHBondContact O-N 3.33Å; V40-V42 VanDerWaalsContact O-N 3.14Å; V42-E46 HydrophobicContact CG1-CB 3.88Å; V42-E46 HydrophobicContact CG1-CG 3.99Å; V42-L47 HydrophobicContact CG1-CB 4.11Å; V42-V127 PolarHBondContact O-N 2.97Å; V42-V127 VanDerWaalsContact O-N 3.16Å
43	S	78.3	Confident	75.9	Confident	15 Å²	15	81 Å²	81	11%	0.105	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	154.2	174.5	93	0	0	0	0	111.4	T45 E46 L47 V127 E129	S43-T45 VanDerWaalsContact C-N 3.26Å; S43-T45 PolarHBondContact O-N 3.03Å; S43-T45 PolarHBondContact OG-N 2.85Å; S43-E46 PolarHBondContact O-N 3.46Å; S43-E46 WeakPolarHBondContact OG-CB 3.43Å; S43-E46 PolarHBondContact OG-N 3.24Å; S43-L47 WeakPolarHBondContact O-CB 3.08Å; S43-L47 PolarHBondContact O-N 3.4Å; S43-V127 VanDerWaalsContact CA-O 3.29Å; S43-V127 WeakPolarHBondContact CA-O 3.38Å; S43-E129 PolarHBondContact OG-OE2 3.27Å
44	L	80	Confident	77	Confident	73 Å²	73	74.4 Å²	74.4	38%	0.382	38%	0.379	S	S	.	.	H	α-helix	trans	-58.7	-41.1	175.7	-178.7	64.1	0	0	0	111.4	L47 I48 L122 L126	L44-L47 WeakPolarHBondContact O-CB 3.37Å; L44-L47 PolarHBondContact O-N 3.22Å; L44-I48 HydrophobicContact CD1-CD1 4.14Å; L44-I48 HydrophobicContact CD1-CG1 4.33Å; L44-I48 HydrophobicContact CD2-CD1 4.45Å; L44-I48 HydrophobicContact CG-CD1 3.84Å; L44-I48 HydrophobicContact CG-CG1 4.44Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.39Å; L44-I48 PolarHBondContact O-N 3.44Å; L44-L122 HydrophobicContact CD1-CD2 4.05Å; L44-L126 HydrophobicContact CB-CD2 4.11Å; L44-L126 HydrophobicContact CD1-CD2 3.91Å
45	T	80.9	Confident	77.8	Confident	77 Å²	77	72.7 Å²	72.7	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-47.8	177.8	-37.2	0	0	0	0	111	S43 L47 I48 S49 E129	S43-T45 VanDerWaalsContact C-N 3.26Å; S43-T45 PolarHBondContact O-N 3.03Å; S43-T45 PolarHBondContact OG-N 2.85Å; T45-L47 VanDerWaalsContact C-N 3.29Å; T45-L47 PolarHBondContact O-N 2.88Å; T45-I48 PolarHBondContact O-N 3.02Å; T45-S49 PolarHBondContact O-N 3.14Å; T45-S49 PolarHBondContact O-OG 2.72Å; T45-S49 VanDerWaalsContact O-OG 3.13Å; T45-E129 WeakPolarHBondContact CB-OE2 3.36Å; T45-E129 PolarHBondContact OG1-OE2 3.38Å
46	E	84.2	Confident	78.9	Confident	85 Å²	85	71 Å²	71	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-63.4	-38.3	178.9	-171.8	-171.4	147.1	0	0	111.1	V42 S43 S49 K50	V42-E46 HydrophobicContact CG1-CB 3.88Å; V42-E46 HydrophobicContact CG1-CG 3.99Å; S43-E46 PolarHBondContact O-N 3.46Å; S43-E46 WeakPolarHBondContact OG-CB 3.43Å; S43-E46 PolarHBondContact OG-N 3.24Å; E46-S49 PolarHBondContact O-N 2.81Å; E46-K50 HydrophobicContact CG-CD 4.46Å; E46-K50 WeakPolarHBondContact O-CB 3.42Å; E46-K50 VanDerWaalsContact O-CG 3.29Å; E46-K50 WeakPolarHBondContact O-CG 2.94Å; E46-K50 PolarHBondContact O-N 2.9Å; E46-K50 VanDerWaalsContact OE1-CE 3.29Å; E46-K50 WeakPolarHBondContact OE1-CE 3.4Å; E46-K50 IonicContact OE1-NZ 3.54Å; E46-K50 PolarHBondContact OE1-NZ 2.94Å
47	L	82.1	Confident	79.6	Confident	8 Å²	8	72.6 Å²	72.6	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-64.1	-44.9	175.2	-175.5	71.5	0	0	0	111.7	W36 V42 S43 L44 T45 K50 R51 L122 P123 L126	W36-L47 HydrophobicContact CH2-CD1 4.23Å; W36-L47 HydrophobicContact CZ2-CD1 4.08Å; V42-L47 HydrophobicContact CG1-CB 4.11Å; S43-L47 WeakPolarHBondContact O-CB 3.08Å; S43-L47 PolarHBondContact O-N 3.4Å; L44-L47 WeakPolarHBondContact O-CB 3.37Å; L44-L47 PolarHBondContact O-N 3.22Å; T45-L47 VanDerWaalsContact C-N 3.29Å; T45-L47 PolarHBondContact O-N 2.88Å; L47-K50 PolarHBondContact O-N 3.41Å; L47-R51 WeakPolarHBondContact O-CB 3.46Å; L47-R51 PolarHBondContact O-N 3.07Å; L47-L122 HydrophobicContact CD2-CD2 3.73Å; L47-P123 HydrophobicContact CD2-CG 4.03Å; L47-L126 HydrophobicContact CD2-CD2 4Å
48	I	83.2	Confident	80.4	Confident	72 Å²	72	65.6 Å²	65.6	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-48.8	176.6	-69.3	166.6	0	0	0	109.5	L44 T45 K50 R51 D52	L44-I48 HydrophobicContact CD1-CD1 4.14Å; L44-I48 HydrophobicContact CD1-CG1 4.33Å; L44-I48 HydrophobicContact CD2-CD1 4.45Å; L44-I48 HydrophobicContact CG-CD1 3.84Å; L44-I48 HydrophobicContact CG-CG1 4.44Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.39Å; L44-I48 PolarHBondContact O-N 3.44Å; T45-I48 PolarHBondContact O-N 3.02Å; I48-K50 VanDerWaalsContact C-N 3.32Å; I48-K50 PolarHBondContact O-N 3.02Å; I48-R51 WeakPolarHBondContact O-CA 3.39Å; I48-R51 WeakPolarHBondContact O-CB 3.33Å; I48-R51 PolarHBondContact O-N 3.17Å; I48-D52 PolarHBondContact O-N 3Å
49	S	84.6	Confident	81.1	Confident	70 Å²	70	67 Å²	67	49%	0.49	36%	0.358	S	S	.	.	H	α-helix	trans	-57.8	-43	177	-62	0	0	0	0	112.3	T45 E46 R51 D52 E53	T45-S49 PolarHBondContact O-N 3.14Å; T45-S49 PolarHBondContact O-OG 2.72Å; T45-S49 VanDerWaalsContact O-OG 3.13Å; E46-S49 PolarHBondContact O-N 2.81Å; S49-R51 VanDerWaalsContact C-N 3.34Å; S49-R51 PolarHBondContact O-N 3.31Å; S49-D52 PolarHBondContact O-N 3.26Å; S49-E53 VanDerWaalsContact O-CB 3.29Å; S49-E53 WeakPolarHBondContact O-CB 3.46Å; S49-E53 PolarHBondContact O-N 3.41Å
50	K	84.2	Confident	81.7	Confident	84 Å²	84	63.7 Å²	63.7	37%	0.365	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-36.3	174.5	-76.2	178.2	-177.2	171.2	0	112.8	E46 L47 I48 F54	E46-K50 HydrophobicContact CG-CD 4.46Å; E46-K50 WeakPolarHBondContact O-CB 3.42Å; E46-K50 VanDerWaalsContact O-CG 3.29Å; E46-K50 WeakPolarHBondContact O-CG 2.94Å; E46-K50 PolarHBondContact O-N 2.9Å; E46-K50 VanDerWaalsContact OE1-CE 3.29Å; E46-K50 WeakPolarHBondContact OE1-CE 3.4Å; E46-K50 IonicContact OE1-NZ 3.54Å; E46-K50 PolarHBondContact OE1-NZ 2.94Å; L47-K50 PolarHBondContact O-N 3.41Å; I48-K50 VanDerWaalsContact C-N 3.32Å; I48-K50 PolarHBondContact O-N 3.02Å; K50-F54 WeakPolarHBondContact O-CB 3.3Å; K50-F54 PolarHBondContact O-N 3.3Å
51	R	88	Confident	81.5	Confident	54 Å²	54	67.3 Å²	67.3	20%	0.204	36%	0.361	C	S	.	.	H	α-helix	trans	-66.7	-46.2	176.7	-174.1	176.2	75.8	160.6	4.6	110.5	L47 I48 S49 F54 W55 E79 C119	L47-R51 WeakPolarHBondContact O-CB 3.46Å; L47-R51 PolarHBondContact O-N 3.07Å; I48-R51 WeakPolarHBondContact O-CA 3.39Å; I48-R51 WeakPolarHBondContact O-CB 3.33Å; I48-R51 PolarHBondContact O-N 3.17Å; S49-R51 VanDerWaalsContact C-N 3.34Å; S49-R51 PolarHBondContact O-N 3.31Å; R51-F54 PolarHBondContact O-N 3.18Å; R51-W55 PolarHBondContact O-N 3.07Å; R51-E79 IonicContact CZ-OE2 2.79Å; R51-E79 IonicContact NH1-OE1 3.31Å; R51-E79 PolarHBondContact NH1-OE1 2.71Å; R51-E79 IonicContact NH1-OE2 2.71Å; R51-E79 PolarHBondContact NH1-OE2 3.42Å; R51-C119 HydrophobicContact CG-CB 4.28Å
52	D	86.1	Confident	81.8	Confident	71 Å²	71	68.8 Å²	68.8	38%	0.38	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-46.1	176	-83.3	-74.1	0	0	0	111.5	I48 S49 F54 W55 E56	I48-D52 PolarHBondContact O-N 3Å; S49-D52 PolarHBondContact O-N 3.26Å; D52-F54 VanDerWaalsContact C-N 3.27Å; D52-F54 PolarHBondContact O-N 3.47Å; D52-W55 PolarHBondContact O-N 3.15Å; D52-W55 VanDerWaalsContact O-N 3.13Å; D52-E56 WeakPolarHBondContact O-CB 3.35Å; D52-E56 VanDerWaalsContact O-CG 3.32Å; D52-E56 WeakPolarHBondContact O-CG 3.41Å; D52-E56 PolarHBondContact O-N 3.39Å
53	E	87.7	Confident	82.1	Confident	129 Å²	129	70.4 Å²	70.4	60%	0.603	38%	0.381	S	S	*	.	H	α-helix	trans	-57.1	-41.9	175	-173.9	178.6	176.4	0	0	111.7	S49 T57	S49-E53 VanDerWaalsContact O-CB 3.29Å; S49-E53 WeakPolarHBondContact O-CB 3.46Å; S49-E53 PolarHBondContact O-N 3.41Å; E53-T57 WeakPolarHBondContact O-CB 3.27Å; E53-T57 VanDerWaalsContact O-CG2 3.31Å; E53-T57 WeakPolarHBondContact O-CG2 3.39Å; E53-T57 PolarHBondContact O-N 2.81Å; E53-T57 PolarHBondContact O-OG1 3.46Å
54	F	87.7	Confident	82.4	Confident	33 Å²	33	75.4 Å²	75.4	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-62.7	-48	174.8	-180	-94.5	0	0	0	112.1	K50 R51 D52 E56 T57 A58 W68 V115 P116 Y118 C119	K50-F54 WeakPolarHBondContact O-CB 3.3Å; K50-F54 PolarHBondContact O-N 3.3Å; R51-F54 PolarHBondContact O-N 3.18Å; D52-F54 VanDerWaalsContact C-N 3.27Å; D52-F54 PolarHBondContact O-N 3.47Å; F54-E56 VanDerWaalsContact C-N 3.32Å; F54-E56 PolarHBondContact O-N 3.25Å; F54-T57 PolarHBondContact O-N 2.82Å; F54-T57 PolarHBondContact O-OG1 3.18Å; F54-A58 HydrophobicContact CD1-CB 4.47Å; F54-A58 HydrophobicContact CE1-CB 4.1Å; F54-A58 HydrophobicContact CZ-CB 4.15Å; F54-A58 WeakPolarHBondContact O-CB 3.33Å; F54-A58 PolarHBondContact O-N 3.41Å; F54-W68 HydrophobicContact CE1-CH2 4.35Å; F54-W68 AromaticContact CE1-CZ3 3.9Å; F54-W68 HydrophobicContact CE1-CZ3 3.9Å; F54-W68 AromaticContact CZ-CH2 3.96Å; F54-W68 HydrophobicContact CZ-CH2 3.96Å; F54-W68 AromaticContact CZ-CZ3 3.99Å; F54-W68 HydrophobicContact CZ-CZ3 3.99Å; F54-V115 HydrophobicContact CE1-CG1 4.31Å; F54-P116 HydrophobicContact CD2-CG 3.92Å; F54-P116 HydrophobicContact CE1-CG 4.46Å; F54-P116 HydrophobicContact CE2-CG 3.56Å; F54-P116 HydrophobicContact CZ-CG 3.87Å; F54-Y118 HydrophobicContact CB-CE2 4.05Å; F54-Y118 VanDerWaalsContact CD2-OH 3.32Å; F54-Y118 WeakPolarHBondContact CD2-OH 3.4Å; F54-Y118 HydrophobicContact CG-CE2 4.39Å; F54-C119 WeakPolarHBondContact CD1-SG 3.04Å
55	W	85.9	Confident	82.8	Confident	16 Å²	16	79 Å²	79	6%	0.061	41%	0.41	C	S	.	.	H	α-helix	trans	-69.5	-27	-178.7	-72.3	118	0	0	0	113.8	R51 D52 P59 W68 L71 K72 A75 V115 C119	R51-W55 PolarHBondContact O-N 3.07Å; D52-W55 PolarHBondContact O-N 3.15Å; D52-W55 VanDerWaalsContact O-N 3.13Å; W55-P59 WeakPolarHBondContact O-CD 3.47Å; W55-W68 HydrophobicContact CE3-CE3 4.2Å; W55-W68 AromaticContact CZ3-CE3 3.71Å; W55-W68 HydrophobicContact CZ3-CE3 3.71Å; W55-W68 HydrophobicContact CZ3-CZ3 4.16Å; W55-L71 HydrophobicContact CH2-CB 4.13Å; W55-L71 HydrophobicContact CZ3-CB 4.16Å; W55-K72 HydrophobicContact CB-CD 4.13Å; W55-K72 HydrophobicContact CD2-CB 3.99Å; W55-K72 HydrophobicContact CD2-CD 4.08Å; W55-K72 HydrophobicContact CD2-CG 3.79Å; W55-K72 HydrophobicContact CE3-CB 3.64Å; W55-K72 HydrophobicContact CE3-CD 4.24Å; W55-K72 HydrophobicContact CE3-CG 3.97Å; W55-K72 HydrophobicContact CG-CD 4.01Å; W55-K72 HydrophobicContact CG-CG 4.12Å; W55-K72 VanDerWaalsContact CH2-CA 3.46Å; W55-K72 HydrophobicContact CH2-CB 3.97Å; W55-K72 HydrophobicContact CZ2-CB 4.3Å; W55-K72 HydrophobicContact CZ2-CG 4.45Å; W55-K72 HydrophobicContact CZ3-CB 3.59Å; W55-K72 HydrophobicContact CZ3-CG 4.33Å; W55-A75 HydrophobicContact CZ2-CB 4.14Å; W55-V115 HydrophobicContact CH2-CG1 4.22Å; W55-V115 HydrophobicContact CZ2-CG1 4.22Å; W55-C119 HydrophobicContact CZ2-CB 4.12Å
56	E	84.6	Confident	83.2	Confident	142 Å²	142	81.2 Å²	81.2	66%	0.664	42%	0.415	S	S	*	.	H	α-helix	trans	-76.6	-35.1	174.7	-69	-64.8	111.1	0	0	111.8	D52 F54	D52-E56 WeakPolarHBondContact O-CB 3.35Å; D52-E56 VanDerWaalsContact O-CG 3.32Å; D52-E56 WeakPolarHBondContact O-CG 3.41Å; D52-E56 PolarHBondContact O-N 3.39Å; F54-E56 VanDerWaalsContact C-N 3.32Å; F54-E56 PolarHBondContact O-N 3.25Å
57	T	86	Confident	83.5	Confident	76 Å²	76	77.6 Å²	77.6	47%	0.466	40%	0.398	S	S	.	.	H	α-helix	trans	-87.3	-28.3	-179	55.2	0	0	0	0	113.6	E53 F54 A60	E53-T57 WeakPolarHBondContact O-CB 3.27Å; E53-T57 VanDerWaalsContact O-CG2 3.31Å; E53-T57 WeakPolarHBondContact O-CG2 3.39Å; E53-T57 PolarHBondContact O-N 2.81Å; E53-T57 PolarHBondContact O-OG1 3.46Å; F54-T57 PolarHBondContact O-N 2.82Å; F54-T57 PolarHBondContact O-OG1 3.18Å; T57-A60 WeakPolarHBondContact O-CB 3.45Å; T57-A60 PolarHBondContact O-N 3.45Å
58	A	83.9	Confident	83.9	Confident	7 Å²	7	77.7 Å²	77.7	6%	0.058	40%	0.398	C	S	.	.	H	α-helix	trans	-56.8	-44.5	-176.4	0	0	0	0	0	114	F54 A60 F61 W68	F54-A58 HydrophobicContact CD1-CB 4.47Å; F54-A58 HydrophobicContact CE1-CB 4.1Å; F54-A58 HydrophobicContact CZ-CB 4.15Å; F54-A58 WeakPolarHBondContact O-CB 3.33Å; F54-A58 PolarHBondContact O-N 3.41Å; A58-A60 PolarHBondContact O-N 3.17Å; A58-F61 PolarHBondContact O-N 3.1Å; A58-W68 HydrophobicContact CB-CD2 3.74Å; A58-W68 HydrophobicContact CB-CE3 3.71Å; A58-W68 HydrophobicContact CB-CG 4.46Å; A58-W68 HydrophobicContact CB-CH2 3.84Å; A58-W68 HydrophobicContact CB-CZ2 3.85Å; A58-W68 HydrophobicContact CB-CZ3 3.76Å; A58-W68 PolarHBondContact O-NE1 3.14Å
59	P	80.5	Confident	84.3	Confident	43 Å²	43	79.4 Å²	79.4	28%	0.279	41%	0.408	S	S	.	.	H	α-helix	trans	-64.8	-18.3	176	-21.4	33.4	0	0	0	114.6	W55 K65 W68	W55-P59 WeakPolarHBondContact O-CD 3.47Å; P59-K65 HydrophobicContact CB-CB 4.39Å; P59-K65 HydrophobicContact CB-CG 4.14Å; P59-W68 HydrophobicContact CG-CB 4.06Å; P59-W68 HydrophobicContact CG-CG 4.31Å
60	A	77.3	Confident	84.6	Confident	91 Å²	91	76.6 Å²	76.6	75%	0.752	39%	0.389	S	S	*	.	H	α-helix	trans	-85.1	-21.8	-178.8	0	0	0	0	0	113	T57 A58	T57-A60 WeakPolarHBondContact O-CB 3.45Å; T57-A60 PolarHBondContact O-N 3.45Å; A58-A60 PolarHBondContact O-N 3.17Å
61	F	70	Confident	84.9	Confident	182 Å²	182	72.7 Å²	72.7	80%	0.798	37%	0.372	S	S	*	.	H	α-helix	trans	-98.4	-41.6	-171.2	-148.9	-101	0	0	0	113	A58	A58-F61 PolarHBondContact O-N 3.1Å
62	E	72.3	Confident	85	Confident	102 Å²	102	72.9 Å²	72.9	48%	0.477	38%	0.375	S	S	.	.	S	Bend	trans	-147.1	137.7	-173.1	-74	178.5	168.4	0	0	112.7	W68	E62-W68 PolarHBondContact O-NE1 3.21Å
63	G	76	Confident	85.2	Confident	48 Å²	48	71 Å²	71	50%	0.495	37%	0.369	S	S	.	.	S	Bend	trans	77	-164.4	165.1	0	0	0	0	0	116.6	Y113	G63-Y113 WeakPolarHBondContact CA-OH 3.49Å
64	R	85.4	Confident	85.4	Confident	121 Å²	121	64.9 Å²	64.9	46%	0.457	34%	0.341	S	S	.	.			trans	-86.9	134.9	-178.1	-78.3	179.2	-176.1	-104	5	110.1	E66 I67 W68 Y113	R64-E66 WeakPolarHBondContact CB-OE2 3.49Å; R64-E66 PolarHBondContact O-N 3.46Å; R64-I67 HydrophobicContact CB-CB 4.44Å; R64-I67 HydrophobicContact CB-CG1 3.9Å; R64-I67 PolarHBondContact O-N 3.16Å; R64-I67 VanDerWaalsContact O-N 3.15Å; R64-W68 PolarHBondContact O-N 3.27Å; R64-Y113 PolarHBondContact N-OH 2.68Å
65	K	87.6	Confident	85.4	Confident	148 Å²	148	63.5 Å²	63.5	64%	0.643	34%	0.335	S	S	*	.	H	α-helix	trans	-59.6	-33.5	176.2	-177.4	-177.4	177.4	-170.1	0	111.1	P59 I67 W68 D69	P59-K65 HydrophobicContact CB-CB 4.39Å; P59-K65 HydrophobicContact CB-CG 4.14Å; K65-I67 VanDerWaalsContact C-N 3.32Å; K65-I67 PolarHBondContact O-N 2.85Å; K65-W68 PolarHBondContact O-N 2.91Å; K65-D69 WeakPolarHBondContact O-CB 3.39Å; K65-D69 PolarHBondContact O-N 3.33Å
66	E	89.2	Confident	85.5	Confident	123 Å²	123	66 Å²	66	58%	0.575	35%	0.349	S	S	*	.	H	α-helix	trans	-61.1	-39.9	178.7	-59.6	86.5	165.9	0	0	111.9	R64 D69 A70	R64-E66 WeakPolarHBondContact CB-OE2 3.49Å; R64-E66 PolarHBondContact O-N 3.46Å; E66-D69 PolarHBondContact O-N 3.29Å; E66-A70 WeakPolarHBondContact O-CB 3.44Å; E66-A70 PolarHBondContact O-N 2.93Å
67	I	90.2	Very high	85.7	Confident	9 Å²	9	61.1 Å²	61.1	5%	0.046	33%	0.326	C	S	.	.	H	α-helix	trans	-71	-40.8	177.7	-58.4	-62.1	0	0	0	110.4	R64 K65 A70 L71 A93 I95 D107 Y113	R64-I67 HydrophobicContact CB-CB 4.44Å; R64-I67 HydrophobicContact CB-CG1 3.9Å; R64-I67 PolarHBondContact O-N 3.16Å; R64-I67 VanDerWaalsContact O-N 3.15Å; K65-I67 VanDerWaalsContact C-N 3.32Å; K65-I67 PolarHBondContact O-N 2.85Å; I67-A70 PolarHBondContact O-N 2.89Å; I67-L71 HydrophobicContact CG2-CD1 4.06Å; I67-L71 HydrophobicContact CG2-CG 4.38Å; I67-L71 WeakPolarHBondContact O-CB 3.39Å; I67-L71 VanDerWaalsContact O-CG 3.26Å; I67-L71 WeakPolarHBondContact O-CG 3.5Å; I67-L71 PolarHBondContact O-N 2.75Å; I67-A93 HydrophobicContact CD1-CB 4.37Å; I67-I95 HydrophobicContact CD1-CD1 4.46Å; I67-I95 HydrophobicContact CD1-CG1 4.13Å; I67-I95 HydrophobicContact CG2-CD1 3.9Å; I67-I95 HydrophobicContact CG2-CG1 4.1Å; I67-D107 HydrophobicContact CD1-CB 4.33Å; I67-D107 WeakPolarHBondContact CD1-OD1 3.48Å; I67-D107 HydrophobicContact CG1-CB 4.3Å; I67-Y113 HydrophobicContact CB-CE1 3.95Å; I67-Y113 HydrophobicContact CB-CE2 4.25Å; I67-Y113 HydrophobicContact CG2-CD1 4.03Å; I67-Y113 HydrophobicContact CG2-CD2 3.84Å; I67-Y113 HydrophobicContact CG2-CE1 3.75Å; I67-Y113 HydrophobicContact CG2-CE2 3.59Å; I67-Y113 HydrophobicContact CG2-CG 4.07Å
68	W	91.2	Very high	85.7	Confident	10 Å²	10	58.2 Å²	58.2	4%	0.038	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-39.6	174.4	-78.4	113	0	0	0	113	F54 W55 A58 P59 E62 R64 K65 L71 K72 Y113 V115	F54-W68 HydrophobicContact CE1-CH2 4.35Å; F54-W68 AromaticContact CE1-CZ3 3.9Å; F54-W68 HydrophobicContact CE1-CZ3 3.9Å; F54-W68 AromaticContact CZ-CH2 3.96Å; F54-W68 HydrophobicContact CZ-CH2 3.96Å; F54-W68 AromaticContact CZ-CZ3 3.99Å; F54-W68 HydrophobicContact CZ-CZ3 3.99Å; W55-W68 HydrophobicContact CE3-CE3 4.2Å; W55-W68 AromaticContact CZ3-CE3 3.71Å; W55-W68 HydrophobicContact CZ3-CE3 3.71Å; W55-W68 HydrophobicContact CZ3-CZ3 4.16Å; A58-W68 HydrophobicContact CB-CD2 3.74Å; A58-W68 HydrophobicContact CB-CE3 3.71Å; A58-W68 HydrophobicContact CB-CG 4.46Å; A58-W68 HydrophobicContact CB-CH2 3.84Å; A58-W68 HydrophobicContact CB-CZ2 3.85Å; A58-W68 HydrophobicContact CB-CZ3 3.76Å; A58-W68 PolarHBondContact O-NE1 3.14Å; P59-W68 HydrophobicContact CG-CB 4.06Å; P59-W68 HydrophobicContact CG-CG 4.31Å; E62-W68 PolarHBondContact O-NE1 3.21Å; R64-W68 PolarHBondContact O-N 3.27Å; K65-W68 PolarHBondContact O-N 2.91Å; W68-L71 HydrophobicContact CE3-CD1 4.14Å; W68-L71 HydrophobicContact CZ3-CD1 4.37Å; W68-L71 PolarHBondContact O-N 2.99Å; W68-K72 WeakPolarHBondContact O-CB 3.35Å; W68-K72 PolarHBondContact O-N 2.95Å; W68-Y113 AromaticContact CD1-CE1 3.97Å; W68-Y113 HydrophobicContact CD2-CD1 4.1Å; W68-Y113 AromaticContact CE2-CD1 3.57Å; W68-Y113 HydrophobicContact CH2-CD1 4.44Å; W68-Y113 AromaticContact CZ2-CD1 3.76Å; W68-Y113 HydrophobicContact CZ2-CD1 3.76Å; W68-Y113 AromaticContact NE1-CD1 3.67Å; W68-Y113 AromaticContact NE1-CE1 3.67Å; W68-V115 HydrophobicContact CZ3-CG2 4.09Å
69	D	91.1	Very high	85.6	Confident	108 Å²	108	60.8 Å²	60.8	58%	0.578	32%	0.321	S	S	*	.	H	α-helix	trans	-64.1	-44.3	175.8	-166.1	69.3	0	0	0	111.3	K65 E66 K72 A73	K65-D69 WeakPolarHBondContact O-CB 3.39Å; K65-D69 PolarHBondContact O-N 3.33Å; E66-D69 PolarHBondContact O-N 3.29Å; D69-K72 PolarHBondContact O-N 2.81Å; D69-A73 WeakPolarHBondContact O-CB 3.25Å; D69-A73 PolarHBondContact O-N 3.46Å
70	A	92.1	Very high	85.8	Confident	11 Å²	11	65.4 Å²	65.4	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-43.7	173.6	0	0	0	0	0	112.4	E66 I67 A73 A74 I89 A93 I95	E66-A70 WeakPolarHBondContact O-CB 3.44Å; E66-A70 PolarHBondContact O-N 2.93Å; I67-A70 PolarHBondContact O-N 2.89Å; A70-A73 PolarHBondContact O-N 2.68Å; A70-A74 WeakPolarHBondContact O-CB 3.49Å; A70-A74 PolarHBondContact O-N 2.72Å; A70-I89 HydrophobicContact CB-CG2 3.97Å; A70-I89 VanDerWaalsContact O-CG2 3.3Å; A70-I89 WeakPolarHBondContact O-CG2 3.5Å; A70-A93 HydrophobicContact CB-CB 3.61Å; A70-I95 HydrophobicContact CB-CD1 3.97Å
71	L	90.1	Very high	86.1	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-41	176.2	-75.2	171.5	0	0	0	112	W55 I67 W68 A74 A75 L90 I95 L102 S105 Y113 V115	W55-L71 HydrophobicContact CH2-CB 4.13Å; W55-L71 HydrophobicContact CZ3-CB 4.16Å; I67-L71 HydrophobicContact CG2-CD1 4.06Å; I67-L71 HydrophobicContact CG2-CG 4.38Å; I67-L71 WeakPolarHBondContact O-CB 3.39Å; I67-L71 VanDerWaalsContact O-CG 3.26Å; I67-L71 WeakPolarHBondContact O-CG 3.5Å; I67-L71 PolarHBondContact O-N 2.75Å; W68-L71 HydrophobicContact CE3-CD1 4.14Å; W68-L71 HydrophobicContact CZ3-CD1 4.37Å; W68-L71 PolarHBondContact O-N 2.99Å; L71-A74 PolarHBondContact O-N 3.46Å; L71-A75 WeakPolarHBondContact O-CB 3.18Å; L71-A75 PolarHBondContact O-N 2.82Å; L71-L90 HydrophobicContact CD2-CD2 4.1Å; L71-I95 HydrophobicContact CD2-CD1 4.15Å; L71-I95 HydrophobicContact CD2-CG2 4.43Å; L71-I95 HydrophobicContact CG-CD1 4.09Å; L71-L102 HydrophobicContact CD2-CD2 4.24Å; L71-S105 WeakPolarHBondContact CD2-OG 3.46Å; L71-Y113 HydrophobicContact CD1-CD1 4.22Å; L71-Y113 HydrophobicContact CD1-CG 4.02Å; L71-V115 HydrophobicContact CD1-CG2 4.37Å
72	K	89.8	Confident	87	Confident	59 Å²	59	57.1 Å²	57.1	26%	0.257	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-47.5	175.8	-172.7	177.3	-176.5	174.5	0	110.6	W55 W68 D69 A75 L76	W55-K72 HydrophobicContact CB-CD 4.13Å; W55-K72 HydrophobicContact CD2-CB 3.99Å; W55-K72 HydrophobicContact CD2-CD 4.08Å; W55-K72 HydrophobicContact CD2-CG 3.79Å; W55-K72 HydrophobicContact CE3-CB 3.64Å; W55-K72 HydrophobicContact CE3-CD 4.24Å; W55-K72 HydrophobicContact CE3-CG 3.97Å; W55-K72 HydrophobicContact CG-CD 4.01Å; W55-K72 HydrophobicContact CG-CG 4.12Å; W55-K72 VanDerWaalsContact CH2-CA 3.46Å; W55-K72 HydrophobicContact CH2-CB 3.97Å; W55-K72 HydrophobicContact CZ2-CB 4.3Å; W55-K72 HydrophobicContact CZ2-CG 4.45Å; W55-K72 HydrophobicContact CZ3-CB 3.59Å; W55-K72 HydrophobicContact CZ3-CG 4.33Å; W68-K72 WeakPolarHBondContact O-CB 3.35Å; W68-K72 PolarHBondContact O-N 2.95Å; D69-K72 PolarHBondContact O-N 2.81Å; K72-A75 PolarHBondContact O-N 2.8Å; K72-L76 WeakPolarHBondContact O-CG 3.27Å; K72-L76 PolarHBondContact O-N 3.09Å
73	A	91.6	Very high	87.7	Confident	32 Å²	32	54 Å²	54	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-47.3	177.1	0	0	0	0	0	111	D69 A70 A75 L76 Q77 I89	D69-A73 WeakPolarHBondContact O-CB 3.25Å; D69-A73 PolarHBondContact O-N 3.46Å; A70-A73 PolarHBondContact O-N 2.68Å; A73-A75 VanDerWaalsContact C-N 3.33Å; A73-A75 PolarHBondContact O-N 2.84Å; A73-L76 PolarHBondContact O-N 2.78Å; A73-Q77 WeakPolarHBondContact O-CG 3.14Å; A73-Q77 PolarHBondContact O-N 2.94Å; A73-Q77 VanDerWaalsContact O-N 3.11Å; A73-I89 HydrophobicContact CB-CD1 3.85Å; A73-I89 HydrophobicContact CB-CG2 4.29Å
74	A	90.7	Very high	88.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-41.1	176.9	0	0	0	0	0	112.6	A70 L71 Q77 A78 A86 I89 L90 L102	A70-A74 WeakPolarHBondContact O-CB 3.49Å; A70-A74 PolarHBondContact O-N 2.72Å; L71-A74 PolarHBondContact O-N 3.46Å; A74-Q77 PolarHBondContact O-N 3.16Å; A74-A78 WeakPolarHBondContact O-CB 3.42Å; A74-A78 PolarHBondContact O-N 2.99Å; A74-A86 HydrophobicContact CB-CB 4.38Å; A74-I89 HydrophobicContact CB-CG2 4.34Å; A74-L90 HydrophobicContact CB-CD2 3.87Å; A74-L90 HydrophobicContact CB-CG 4.03Å; A74-L102 HydrophobicContact CB-CD2 4.37Å
75	A	88.4	Confident	88.6	Confident	3 Å²	3	53.1 Å²	53.1	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-43.8	176.4	0	0	0	0	0	112.3	W55 L71 K72 A73 Q77 A78 E79 L102 L120	W55-A75 HydrophobicContact CZ2-CB 4.14Å; L71-A75 WeakPolarHBondContact O-CB 3.18Å; L71-A75 PolarHBondContact O-N 2.82Å; K72-A75 PolarHBondContact O-N 2.8Å; A73-A75 VanDerWaalsContact C-N 3.33Å; A73-A75 PolarHBondContact O-N 2.84Å; A75-Q77 VanDerWaalsContact C-N 3.29Å; A75-Q77 PolarHBondContact O-N 2.74Å; A75-A78 PolarHBondContact O-N 3.13Å; A75-E79 WeakPolarHBondContact O-CG 3.36Å; A75-E79 PolarHBondContact O-N 3.3Å; A75-L102 HydrophobicContact CB-CD1 4.49Å; A75-L120 HydrophobicContact CB-CD2 3.92Å
76	L	87.4	Confident	88.7	Confident	68 Å²	68	46 Å²	46	36%	0.356	26%	0.255	S	S	.	.	H	α-helix	trans	-62.1	-36.4	176.9	-72.6	171.5	0	0	0	112.6	K72 A73 Q80	K72-L76 WeakPolarHBondContact O-CG 3.27Å; K72-L76 PolarHBondContact O-N 3.09Å; A73-L76 PolarHBondContact O-N 2.78Å; L76-Q80 WeakPolarHBondContact O-CG 3.27Å; L76-Q80 PolarHBondContact O-N 2.68Å; L76-Q80 PolarHBondContact O-NE2 3.42Å
77	Q	89.6	Confident	88.7	Confident	41 Å²	41	42 Å²	42	19%	0.192	24%	0.236	C	C	.	.	H	α-helix	trans	-74.9	-38.3	178.6	-60.1	-63.2	-26.4	0	0	111.4	A73 A74 A75 E79 Q80 G81 D82 L85 A86 I89	A73-Q77 WeakPolarHBondContact O-CG 3.14Å; A73-Q77 PolarHBondContact O-N 2.94Å; A73-Q77 VanDerWaalsContact O-N 3.11Å; A74-Q77 PolarHBondContact O-N 3.16Å; A75-Q77 VanDerWaalsContact C-N 3.29Å; A75-Q77 PolarHBondContact O-N 2.74Å; Q77-E79 VanDerWaalsContact C-N 3.3Å; Q77-E79 PolarHBondContact O-N 3.35Å; Q77-Q80 PolarHBondContact O-N 2.86Å; Q77-Q80 VanDerWaalsContact O-N 3.16Å; Q77-G81 PolarHBondContact O-N 3.09Å; Q77-D82 PolarHBondContact O-N 3.19Å; Q77-L85 HydrophobicContact CB-CD2 4.3Å; Q77-L85 HydrophobicContact CG-CD2 3.52Å; Q77-A86 HydrophobicContact CB-CB 3.97Å; Q77-I89 HydrophobicContact CG-CD1 3.96Å
78	A	85.5	Confident	88.7	Confident	14 Å²	14	44.4 Å²	44.4	12%	0.116	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-36.7	172	0	0	0	0	0	112.3	A74 A75 G81 F83 L102	A74-A78 WeakPolarHBondContact O-CB 3.42Å; A74-A78 PolarHBondContact O-N 2.99Å; A75-A78 PolarHBondContact O-N 3.13Å; A78-G81 PolarHBondContact O-N 2.93Å; A78-F83 HydrophobicContact CB-CD1 4.38Å; A78-F83 HydrophobicContact CB-CE1 4.19Å; A78-L102 HydrophobicContact CB-CD1 4.35Å
79	E	82.3	Confident	88.8	Confident	61 Å²	61	45.9 Å²	45.9	29%	0.285	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-40	173.2	-74.7	-177	170.3	0	0	112.2	R33 R51 A75 Q77 G81	R33-E79 PolarHBondContact NH2-O 3.21Å; R51-E79 IonicContact CZ-OE2 2.79Å; R51-E79 IonicContact NH1-OE1 3.31Å; R51-E79 PolarHBondContact NH1-OE1 2.71Å; R51-E79 IonicContact NH1-OE2 2.71Å; R51-E79 PolarHBondContact NH1-OE2 3.42Å; A75-E79 WeakPolarHBondContact O-CG 3.36Å; A75-E79 PolarHBondContact O-N 3.3Å; Q77-E79 VanDerWaalsContact C-N 3.3Å; Q77-E79 PolarHBondContact O-N 3.35Å; E79-G81 PolarHBondContact O-N 3.25Å
80	Q	84.6	Confident	88.7	Confident	140 Å²	140	40.8 Å²	40.8	65%	0.654	24%	0.239	S	C	*	.	H	α-helix	trans	-69.5	-17	175.3	-69	172	51.3	0	0	112.9	L76 Q77	L76-Q80 WeakPolarHBondContact O-CG 3.27Å; L76-Q80 PolarHBondContact O-N 2.68Å; L76-Q80 PolarHBondContact O-NE2 3.42Å; Q77-Q80 PolarHBondContact O-N 2.86Å; Q77-Q80 VanDerWaalsContact O-N 3.16Å
81	G	84.2	Confident	88.6	Confident	34 Å²	34	44.5 Å²	44.5	35%	0.351	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	6.8	-177.4	0	0	0	0	0	113.8	Q77 A78 E79 F83	Q77-G81 PolarHBondContact O-N 3.09Å; A78-G81 PolarHBondContact O-N 2.93Å; E79-G81 PolarHBondContact O-N 3.25Å; G81-F83 VanDerWaalsContact O-CD2 3.3Å; G81-F83 WeakPolarHBondContact O-CD2 3.29Å; G81-F83 PolarHBondContact O-N 3.34Å
82	D	88.7	Confident	88.6	Confident	66 Å²	66	47.7 Å²	47.7	35%	0.353	29%	0.29	S	S	.	.			trans	-89.7	80.5	173	-164.6	-17.7	0	0	0	110.4	Q77 A84 L85 A86	Q77-D82 PolarHBondContact O-N 3.19Å; D82-A84 VanDerWaalsContact C-N 3.28Å; D82-A84 PolarHBondContact OD1-N 3.32Å; D82-L85 HydrophobicContact CB-CB 4.3Å; D82-L85 VanDerWaalsContact CG-CB 3.45Å; D82-L85 WeakPolarHBondContact OD1-CB 3.48Å; D82-L85 PolarHBondContact OD1-N 3.18Å; D82-L85 WeakPolarHBondContact OD2-CB 3.49Å; D82-A86 WeakPolarHBondContact O-CB 3.33Å; D82-A86 PolarHBondContact O-N 3.04Å; D82-A86 VanDerWaalsContact O-N 3.15Å
83	F	86.2	Confident	88.6	Confident	36 Å²	36	46 Å²	46	16%	0.158	29%	0.288	C	S	.	.	H	α-helix	trans	-72	-23.5	177.4	-59.6	-80	0	0	0	112.8	L29 Q31 A78 G81 Q87	L29-F83 HydrophobicContact CD2-CD1 4.01Å; L29-F83 HydrophobicContact CG-CD1 4.45Å; Q31-F83 HydrophobicContact CB-CD1 4.44Å; Q31-F83 HydrophobicContact CB-CD2 3.98Å; Q31-F83 HydrophobicContact CB-CE1 4.44Å; Q31-F83 HydrophobicContact CB-CE2 3.97Å; Q31-F83 HydrophobicContact CB-CG 4.21Å; Q31-F83 HydrophobicContact CB-CZ 4.2Å; Q31-F83 HydrophobicContact CG-CB 4.09Å; Q31-F83 HydrophobicContact CG-CD1 4.39Å; Q31-F83 HydrophobicContact CG-CD2 3.81Å; Q31-F83 HydrophobicContact CG-CE2 4.32Å; Q31-F83 HydrophobicContact CG-CG 3.83Å; Q31-F83 VanDerWaalsContact O-CZ 3.25Å; Q31-F83 WeakPolarHBondContact O-CZ 3.43Å; A78-F83 HydrophobicContact CB-CD1 4.38Å; A78-F83 HydrophobicContact CB-CE1 4.19Å; G81-F83 VanDerWaalsContact O-CD2 3.3Å; G81-F83 WeakPolarHBondContact O-CD2 3.29Å; G81-F83 PolarHBondContact O-N 3.34Å; F83-Q87 WeakPolarHBondContact O-CB 3.5Å; F83-Q87 PolarHBondContact O-N 3.42Å
84	A	88.8	Confident	88.5	Confident	76 Å²	76	47.9 Å²	47.9	63%	0.628	30%	0.298	S	S	*	.	H	α-helix	trans	-71.3	-45.5	179.7	0	0	0	0	0	110.3	D82 Q87 A88	D82-A84 VanDerWaalsContact C-N 3.28Å; D82-A84 PolarHBondContact OD1-N 3.32Å; A84-Q87 PolarHBondContact O-N 3.16Å; A84-A88 PolarHBondContact O-N 3.02Å
85	L	90.5	Very high	88.3	Confident	74 Å²	74	48.2 Å²	48.2	39%	0.387	30%	0.299	S	S	.	.	H	α-helix	trans	-66	-41.4	173.9	-162	154.5	0	0	0	110.8	Q77 D82 Q87 A88 I89	Q77-L85 HydrophobicContact CB-CD2 4.3Å; Q77-L85 HydrophobicContact CG-CD2 3.52Å; D82-L85 HydrophobicContact CB-CB 4.3Å; D82-L85 VanDerWaalsContact CG-CB 3.45Å; D82-L85 WeakPolarHBondContact OD1-CB 3.48Å; D82-L85 PolarHBondContact OD1-N 3.18Å; D82-L85 WeakPolarHBondContact OD2-CB 3.49Å; L85-Q87 VanDerWaalsContact C-N 3.34Å; L85-Q87 PolarHBondContact O-N 3.15Å; L85-A88 PolarHBondContact O-N 3.01Å; L85-I89 HydrophobicContact CD2-CD1 3.43Å; L85-I89 VanDerWaalsContact CD2-CD1 3.43Å; L85-I89 HydrophobicContact CD2-CG1 3.98Å; L85-I89 WeakPolarHBondContact O-CG1 3.43Å; L85-I89 PolarHBondContact O-N 2.82Å
86	A	90.6	Very high	88.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.5	-45.6	174.2	0	0	0	0	0	112.1	L29 A74 Q77 D82 I89 L90	L29-A86 HydrophobicContact CD2-CB 3.63Å; A74-A86 HydrophobicContact CB-CB 4.38Å; Q77-A86 HydrophobicContact CB-CB 3.97Å; D82-A86 WeakPolarHBondContact O-CB 3.33Å; D82-A86 PolarHBondContact O-N 3.04Å; D82-A86 VanDerWaalsContact O-N 3.15Å; A86-I89 PolarHBondContact O-N 3.17Å; A86-L90 WeakPolarHBondContact O-CG 3.25Å; A86-L90 PolarHBondContact O-N 3.04Å; A86-L90 VanDerWaalsContact O-N 3.11Å
87	Q	89.1	Confident	88.2	Confident	38 Å²	38	47.2 Å²	47.2	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-43.9	175.6	-175.2	65.6	44.2	0	0	111.5	L29 F83 A84 L85 I89 L90 D91	L29-Q87 VanDerWaalsContact CB-OE1 3.3Å; F83-Q87 WeakPolarHBondContact O-CB 3.5Å; F83-Q87 PolarHBondContact O-N 3.42Å; A84-Q87 PolarHBondContact O-N 3.16Å; L85-Q87 VanDerWaalsContact C-N 3.34Å; L85-Q87 PolarHBondContact O-N 3.15Å; Q87-I89 VanDerWaalsContact C-N 3.28Å; Q87-I89 PolarHBondContact O-N 3.16Å; Q87-L90 PolarHBondContact O-N 3.29Å; Q87-L90 VanDerWaalsContact O-N 3.11Å; Q87-D91 PolarHBondContact NE2-OD1 3.26Å; Q87-D91 WeakPolarHBondContact O-CB 3.29Å; Q87-D91 VanDerWaalsContact O-CG 3.25Å; Q87-D91 PolarHBondContact O-N 2.89Å
88	A	91.2	Very high	87.7	Confident	60 Å²	60	47.7 Å²	47.7	50%	0.496	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-36.4	177.9	0	0	0	0	0	112.7	A84 L85 G92	A84-A88 PolarHBondContact O-N 3.02Å; L85-A88 PolarHBondContact O-N 3.01Å; A88-G92 PolarHBondContact O-N 2.99Å
89	I	91.6	Very high	87.3	Confident	41 Å²	41	51.2 Å²	51.2	21%	0.21	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-46.4	173.4	-67.3	166.3	0	0	0	110.6	A70 A73 A74 Q77 L85 A86 Q87 G92 A93	A70-I89 HydrophobicContact CB-CG2 3.97Å; A70-I89 VanDerWaalsContact O-CG2 3.3Å; A70-I89 WeakPolarHBondContact O-CG2 3.5Å; A73-I89 HydrophobicContact CB-CD1 3.85Å; A73-I89 HydrophobicContact CB-CG2 4.29Å; A74-I89 HydrophobicContact CB-CG2 4.34Å; Q77-I89 HydrophobicContact CG-CD1 3.96Å; L85-I89 HydrophobicContact CD2-CD1 3.43Å; L85-I89 VanDerWaalsContact CD2-CD1 3.43Å; L85-I89 HydrophobicContact CD2-CG1 3.98Å; L85-I89 WeakPolarHBondContact O-CG1 3.43Å; L85-I89 PolarHBondContact O-N 2.82Å; A86-I89 PolarHBondContact O-N 3.17Å; Q87-I89 VanDerWaalsContact C-N 3.28Å; Q87-I89 PolarHBondContact O-N 3.16Å; I89-G92 PolarHBondContact O-N 3.03Å; I89-A93 PolarHBondContact O-N 3.42Å; I89-A93 VanDerWaalsContact O-N 3.09Å
90	L	90.1	Very high	87.2	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-43.9	179.7	-65.1	173	0	0	0	111.9	L29 L71 A74 A86 Q87 G92 A93 C94 I95 L97 L102	L29-L90 HydrophobicContact CB-CD1 4.45Å; L29-L90 HydrophobicContact CD1-CD1 4.48Å; L71-L90 HydrophobicContact CD2-CD2 4.1Å; A74-L90 HydrophobicContact CB-CD2 3.87Å; A74-L90 HydrophobicContact CB-CG 4.03Å; A86-L90 WeakPolarHBondContact O-CG 3.25Å; A86-L90 PolarHBondContact O-N 3.04Å; A86-L90 VanDerWaalsContact O-N 3.11Å; Q87-L90 PolarHBondContact O-N 3.29Å; Q87-L90 VanDerWaalsContact O-N 3.11Å; L90-G92 VanDerWaalsContact C-N 3.35Å; L90-A93 CarbonylContact O-C 3.55Å; L90-A93 PolarHBondContact O-N 3.44Å; L90-C94 PolarHBondContact O-N 2.65Å; L90-I95 HydrophobicContact CB-CB 4.4Å; L90-I95 HydrophobicContact CD2-CB 4.11Å; L90-I95 HydrophobicContact CD2-CD1 3.89Å; L90-I95 HydrophobicContact CD2-CG2 4.05Å; L90-I95 PolarHBondContact O-N 3.24Å; L90-L97 HydrophobicContact CD1-CD1 3.76Å; L90-L97 HydrophobicContact CD1-CG 4.37Å; L90-L102 HydrophobicContact CD1-CD2 3.93Å; L90-L102 HydrophobicContact CD2-CD2 3.92Å; L90-L102 HydrophobicContact CG-CD2 4.48Å
91	D	89.3	Confident	87.1	Confident	88 Å²	88	43.2 Å²	43.2	47%	0.471	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-41.3	177.7	-67	-22.2	0	0	0	110.9	Q87 A93 C94	Q87-D91 PolarHBondContact NE2-OD1 3.26Å; Q87-D91 WeakPolarHBondContact O-CB 3.29Å; Q87-D91 VanDerWaalsContact O-CG 3.25Å; Q87-D91 PolarHBondContact O-N 2.89Å; D91-A93 PolarHBondContact O-N 2.77Å; D91-C94 PolarHBondContact O-N 2.92Å; D91-C94 VanDerWaalsContact O-N 3.16Å
92	G	90.1	Very high	87.1	Confident	69 Å²	69	42.1 Å²	42.1	71%	0.711	27%	0.273	S	S	*	.	H	α-helix	trans	-65.5	-25.9	176.7	0	0	0	0	0	114	A88 I89 L90	A88-G92 PolarHBondContact O-N 2.99Å; I89-G92 PolarHBondContact O-N 3.03Å; L90-G92 VanDerWaalsContact C-N 3.35Å
93	A	90.1	Very high	86.9	Confident	24 Å²	24	44.9 Å²	44.9	20%	0.198	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	7.3	176.2	0	0	0	0	0	113.5	I67 A70 I89 L90 D91 I95	I67-A93 HydrophobicContact CD1-CB 4.37Å; A70-A93 HydrophobicContact CB-CB 3.61Å; I89-A93 PolarHBondContact O-N 3.42Å; I89-A93 VanDerWaalsContact O-N 3.09Å; L90-A93 CarbonylContact O-C 3.55Å; L90-A93 PolarHBondContact O-N 3.44Å; D91-A93 PolarHBondContact O-N 2.77Å; A93-I95 HydrophobicContact CB-CD1 3.65Å; A93-I95 HydrophobicContact CB-CG1 3.8Å; A93-I95 PolarHBondContact O-N 3.15Å
94	C	88.5	Confident	86.9	Confident	71 Å²	71	45.4 Å²	45.4	48%	0.48	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	32	-175.9	-62.3	0	0	0	0	113.8	L90 D91 E108	L90-C94 PolarHBondContact O-N 2.65Å; D91-C94 PolarHBondContact O-N 2.92Å; D91-C94 VanDerWaalsContact O-N 3.16Å; C94-E108 HydrophobicContact CB-CB 4.09Å
95	I	88.3	Confident	86.8	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.036	25%	0.251	C	S	.	.			trans	-86.3	121.6	-179.1	-60.2	167.6	0	0	0	109.6	I67 A70 L71 L90 A93 L97 Y106	I67-I95 HydrophobicContact CD1-CD1 4.46Å; I67-I95 HydrophobicContact CD1-CG1 4.13Å; I67-I95 HydrophobicContact CG2-CD1 3.9Å; I67-I95 HydrophobicContact CG2-CG1 4.1Å; A70-I95 HydrophobicContact CB-CD1 3.97Å; L71-I95 HydrophobicContact CD2-CD1 4.15Å; L71-I95 HydrophobicContact CD2-CG2 4.43Å; L71-I95 HydrophobicContact CG-CD1 4.09Å; L90-I95 HydrophobicContact CB-CB 4.4Å; L90-I95 HydrophobicContact CD2-CB 4.11Å; L90-I95 HydrophobicContact CD2-CD1 3.89Å; L90-I95 HydrophobicContact CD2-CG2 4.05Å; L90-I95 PolarHBondContact O-N 3.24Å; A93-I95 HydrophobicContact CB-CD1 3.65Å; A93-I95 HydrophobicContact CB-CG1 3.8Å; A93-I95 PolarHBondContact O-N 3.15Å; I95-L97 HydrophobicContact CG2-CD2 4.31Å; I95-Y106 CarbonylContact C-O 3.57Å; I95-Y106 WeakPolarHBondContact CA-O 3.47Å
96	S	86	Confident	86.7	Confident	47 Å²	47	41.7 Å²	41.7	33%	0.329	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-98.4	133.2	175.4	63	0	0	0	0	111.9	Y106	S96-Y106 PolarHBondContact N-O 2.8Å; S96-Y106 PolarHBondContact O-N 2.99Å; S96-Y106 WeakPolarHBondContact OG-CB 3.3Å; S96-Y106 PolarHBondContact OG-O 3.41Å
97	L	85.9	Confident	86.7	Confident	3 Å²	3	42 Å²	42	2%	0.016	25%	0.247	C	C	.	.			trans	-108.8	109.5	175.8	-57	-177.5	0	0	0	109.4	K27 L29 L90 I95 S105	K27-L97 PolarHBondContact N-O 3.47Å; L29-L97 HydrophobicContact CB-CD1 4.35Å; L29-L97 HydrophobicContact CD1-CD1 3.82Å; L90-L97 HydrophobicContact CD1-CD1 3.76Å; L90-L97 HydrophobicContact CD1-CG 4.37Å; I95-L97 HydrophobicContact CG2-CD2 4.31Å; L97-S105 VanDerWaalsContact CD2-OG 3.24Å; L97-S105 WeakPolarHBondContact CD2-OG 3.45Å
98	P	80.8	Confident	86.6	Confident	52 Å²	52	46.6 Å²	46.6	34%	0.338	27%	0.269	S	S	.	.	S	Bend	trans	-71.2	-36.7	177.6	26.4	-33.3	0	0	0	112.3	K27 Y106	K27-P98 WeakPolarHBondContact CD-O 3.35Å; K27-P98 PolarHBondContact NZ-O 2.98Å; P98-Y106 HydrophobicContact CG-CD2 3.78Å; P98-Y106 HydrophobicContact CG-CE2 3.47Å; P98-Y106 VanDerWaalsContact CG-CE2 3.47Å
99	D	76.9	Confident	86.2	Confident	87 Å²	87	48.5 Å²	48.5	47%	0.465	27%	0.271	S	S	.	.	S	Bend	trans	-91.2	-9	179.8	-67.8	-38.9	0	0	0	112.8	T101	D99-T101 HydrophobicContact CB-CG2 4.47Å; D99-T101 PolarHBondContact O-N 3.31Å
100	G	79.5	Confident	85.9	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	71.3	6.2	-168.7	0	0	0	0	0	113.4	L29 T30	L29-G100 WeakPolarHBondContact CA-O 3.45Å; T30-G100 PolarHBondContact N-O 3.03Å; T30-G100 PolarHBondContact OG1-O 2.93Å; T30-G100 VanDerWaalsContact OG1-O 3.09Å
101	T	83.2	Confident	85.7	Confident	34 Å²	34	52.2 Å²	52.2	21%	0.209	30%	0.303	C	S	.	.	S	Bend	trans	-108.9	143.6	177.8	72.3	0	0	0	0	110.9	D99 R103	D99-T101 HydrophobicContact CB-CG2 4.47Å; D99-T101 PolarHBondContact O-N 3.31Å; T101-R103 PolarHBondContact O-N 3.16Å; T101-R103 VanDerWaalsContact O-N 3.11Å
102	L	83.5	Confident	85.7	Confident	11 Å²	11	52.8 Å²	52.8	6%	0.058	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.2	175.4	-70.3	169.2	0	0	0	113.9	L29 L71 A74 A75 A78 L90 E104 V115 L120	L29-L102 HydrophobicContact CD1-CD1 4.11Å; L29-L102 HydrophobicContact CD1-CD2 4.11Å; L29-L102 HydrophobicContact CD1-CG 3.62Å; L71-L102 HydrophobicContact CD2-CD2 4.24Å; A74-L102 HydrophobicContact CB-CD2 4.37Å; A75-L102 HydrophobicContact CB-CD1 4.49Å; A78-L102 HydrophobicContact CB-CD1 4.35Å; L90-L102 HydrophobicContact CD1-CD2 3.93Å; L90-L102 HydrophobicContact CD2-CD2 3.92Å; L90-L102 HydrophobicContact CG-CD2 4.48Å; L102-E104 VanDerWaalsContact C-N 3.26Å; L102-E104 PolarHBondContact O-N 3.31Å; L102-V115 WeakPolarHBondContact O-CB 3.37Å; L102-V115 WeakPolarHBondContact O-CG2 3.33Å; L102-L120 HydrophobicContact CB-CD1 3.76Å; L102-L120 HydrophobicContact CB-CD2 3.55Å; L102-L120 HydrophobicContact CB-CG 4.3Å; L102-L120 HydrophobicContact CD1-CD2 3.82Å; L102-L120 HydrophobicContact CG-CD2 4.33Å
103	R	84.8	Confident	85.6	Confident	124 Å²	124	49.6 Å²	49.6	47%	0.468	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-38.6	-180	177.3	-179.1	-93	-144.6	-4.3	111.2	T101 K114 V115 L120	T101-R103 PolarHBondContact O-N 3.16Å; T101-R103 VanDerWaalsContact O-N 3.11Å; R103-K114 CarbonylContact O-C 3.41Å; R103-K114 WeakPolarHBondContact O-CA 3.17Å; R103-V115 PolarHBondContact O-N 3.14Å; R103-L120 HydrophobicContact CB-CD1 4.44Å
104	E	85.4	Confident	85.5	Confident	46 Å²	46	53.8 Å²	53.8	22%	0.215	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	113.1	179.8	-54.9	-159.6	168.3	0	0	109.2	L102 R112 Y113	L102-E104 VanDerWaalsContact C-N 3.26Å; L102-E104 PolarHBondContact O-N 3.31Å; E104-R112 IonicContact OE1-CZ 3.57Å; E104-R112 IonicContact OE1-NH2 3.42Å; E104-R112 PolarHBondContact OE1-NH2 2.9Å; E104-R112 IonicContact OE2-CZ 2.71Å; E104-R112 VanDerWaalsContact OE2-CZ 3.29Å; E104-R112 IonicContact OE2-NE 2.68Å; E104-R112 PolarHBondContact OE2-NE 3.31Å; E104-R112 IonicContact OE2-NH2 3.46Å; E104-R112 PolarHBondContact OE2-NH2 3.37Å; E104-Y113 WeakPolarHBondContact CA-O 3.45Å
105	S	87.1	Confident	85.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.4	-175.9	-54	0	0	0	0	109.8	L71 L97 R112 Y113	L71-S105 WeakPolarHBondContact CD2-OG 3.46Å; L97-S105 VanDerWaalsContact CD2-OG 3.24Å; L97-S105 WeakPolarHBondContact CD2-OG 3.45Å; S105-R112 CarbonylContact O-C 3.57Å; S105-R112 WeakPolarHBondContact O-CA 3.15Å; S105-Y113 PolarHBondContact N-O 3.25Å; S105-Y113 PolarHBondContact O-N 2.75Å
106	Y	89.3	Confident	85.2	Confident	72 Å²	72	52 Å²	52	28%	0.282	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.3	-178.7	-69.1	-103.7	0	0	0	109.9	I95 S96 P98 N111 R112	I95-Y106 CarbonylContact C-O 3.57Å; I95-Y106 WeakPolarHBondContact CA-O 3.47Å; S96-Y106 PolarHBondContact N-O 2.8Å; S96-Y106 PolarHBondContact O-N 2.99Å; S96-Y106 WeakPolarHBondContact OG-CB 3.3Å; S96-Y106 PolarHBondContact OG-O 3.41Å; P98-Y106 HydrophobicContact CG-CD2 3.78Å; P98-Y106 HydrophobicContact CG-CE2 3.47Å; P98-Y106 VanDerWaalsContact CG-CE2 3.47Å; Y106-N111 WeakPolarHBondContact CA-O 3.39Å; Y106-R112 HydrophobicContact CD1-CB 4.13Å; Y106-R112 HydrophobicContact CD1-CG 4.49Å; Y106-R112 HydrophobicContact CE1-CB 3.86Å; Y106-R112 HydrophobicContact CE1-CG 3.98Å; Y106-R112 HydrophobicContact CE2-CG 4.22Å
107	D	89.8	Confident	85	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.032	26%	0.256	C	S	.	.			trans	-84.4	168.2	174.4	177.3	25.1	0	0	0	111.1	I67 L109 G110 N111 Y113	I67-D107 HydrophobicContact CD1-CB 4.33Å; I67-D107 WeakPolarHBondContact CD1-OD1 3.48Å; I67-D107 HydrophobicContact CG1-CB 4.3Å; D107-L109 PolarHBondContact O-N 2.9Å; D107-L109 VanDerWaalsContact O-N 3.15Å; D107-G110 PolarHBondContact O-N 3.33Å; D107-N111 HydrophobicContact CB-CB 4.33Å; D107-N111 PolarHBondContact N-O 3.42Å; D107-Y113 HydrophobicContact CB-CD2 4.39Å; D107-Y113 HydrophobicContact CB-CE2 3.55Å
108	E	86.4	Confident	84.8	Confident	136 Å²	136	53.8 Å²	53.8	64%	0.636	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.5	178.2	71.3	-177.3	168.3	0	0	112.7	C94 G110	C94-E108 HydrophobicContact CB-CB 4.09Å; E108-G110 VanDerWaalsContact C-N 3.25Å; E108-G110 PolarHBondContact O-N 2.75Å
109	L	84.4	Confident	84.7	Confident	100 Å²	100	51.3 Å²	51.3	52%	0.524	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.6	177	-62.4	174.3	0	0	0	113.4	D107 N111	D107-L109 PolarHBondContact O-N 2.9Å; D107-L109 VanDerWaalsContact O-N 3.15Å; L109-N111 VanDerWaalsContact C-N 3.32Å
110	G	83.7	Confident	84.7	Confident	51 Å²	51	48.2 Å²	48.2	53%	0.526	24%	0.236	S	C	.	.			trans	80.8	8.1	-175.2	0	0	0	0	0	114.4	D107 E108 R112	D107-G110 PolarHBondContact O-N 3.33Å; E108-G110 VanDerWaalsContact C-N 3.25Å; E108-G110 PolarHBondContact O-N 2.75Å; G110-R112 PolarHBondContact O-N 3.02Å
111	N	86.6	Confident	84.4	Confident	69 Å²	69	48.8 Å²	48.8	37%	0.369	24%	0.239	S	C	.	.			trans	-67.1	130.2	173.2	-65.9	-40.3	0	0	0	109.8	Y106 D107 L109 Y113	Y106-N111 WeakPolarHBondContact CA-O 3.39Å; D107-N111 HydrophobicContact CB-CB 4.33Å; D107-N111 PolarHBondContact N-O 3.42Å; L109-N111 VanDerWaalsContact C-N 3.32Å; N111-Y113 HydrophobicContact CB-CE2 3.69Å; N111-Y113 WeakPolarHBondContact O-CD2 3.48Å; N111-Y113 WeakPolarHBondContact O-CE2 3.38Å
112	R	88.6	Confident	83.7	Confident	100 Å²	100	52 Å²	52	38%	0.377	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.9	178.9	-178.4	-179.2	177.6	-167.9	0.9	110.3	E104 S105 Y106 G110 K114	E104-R112 IonicContact OE1-CZ 3.57Å; E104-R112 IonicContact OE1-NH2 3.42Å; E104-R112 PolarHBondContact OE1-NH2 2.9Å; E104-R112 IonicContact OE2-CZ 2.71Å; E104-R112 VanDerWaalsContact OE2-CZ 3.29Å; E104-R112 IonicContact OE2-NE 2.68Å; E104-R112 PolarHBondContact OE2-NE 3.31Å; E104-R112 IonicContact OE2-NH2 3.46Å; E104-R112 PolarHBondContact OE2-NH2 3.37Å; S105-R112 CarbonylContact O-C 3.57Å; S105-R112 WeakPolarHBondContact O-CA 3.15Å; Y106-R112 HydrophobicContact CD1-CB 4.13Å; Y106-R112 HydrophobicContact CD1-CG 4.49Å; Y106-R112 HydrophobicContact CE1-CB 3.86Å; Y106-R112 HydrophobicContact CE1-CG 3.98Å; Y106-R112 HydrophobicContact CE2-CG 4.22Å; G110-R112 PolarHBondContact O-N 3.02Å; R112-K114 HydrophobicContact CG-CG 4.48Å
113	Y	88.7	Confident	83.1	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.6	177	-60.8	-98	0	0	0	109.1	G63 R64 I67 W68 L71 E104 S105 D107 N111	G63-Y113 WeakPolarHBondContact CA-OH 3.49Å; R64-Y113 PolarHBondContact N-OH 2.68Å; I67-Y113 HydrophobicContact CB-CE1 3.95Å; I67-Y113 HydrophobicContact CB-CE2 4.25Å; I67-Y113 HydrophobicContact CG2-CD1 4.03Å; I67-Y113 HydrophobicContact CG2-CD2 3.84Å; I67-Y113 HydrophobicContact CG2-CE1 3.75Å; I67-Y113 HydrophobicContact CG2-CE2 3.59Å; I67-Y113 HydrophobicContact CG2-CG 4.07Å; W68-Y113 AromaticContact CD1-CE1 3.97Å; W68-Y113 HydrophobicContact CD2-CD1 4.1Å; W68-Y113 AromaticContact CE2-CD1 3.57Å; W68-Y113 HydrophobicContact CH2-CD1 4.44Å; W68-Y113 AromaticContact CZ2-CD1 3.76Å; W68-Y113 HydrophobicContact CZ2-CD1 3.76Å; W68-Y113 AromaticContact NE1-CD1 3.67Å; W68-Y113 AromaticContact NE1-CE1 3.67Å; L71-Y113 HydrophobicContact CD1-CD1 4.22Å; L71-Y113 HydrophobicContact CD1-CG 4.02Å; E104-Y113 WeakPolarHBondContact CA-O 3.45Å; S105-Y113 PolarHBondContact N-O 3.25Å; S105-Y113 PolarHBondContact O-N 2.75Å; D107-Y113 HydrophobicContact CB-CD2 4.39Å; D107-Y113 HydrophobicContact CB-CE2 3.55Å; N111-Y113 HydrophobicContact CB-CE2 3.69Å; N111-Y113 WeakPolarHBondContact O-CD2 3.48Å; N111-Y113 WeakPolarHBondContact O-CE2 3.38Å
114	K	88.2	Confident	81.9	Confident	112 Å²	112	52.5 Å²	52.5	49%	0.487	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.6	179.3	-64.4	-178.8	-174.8	174.3	0	110	R103 R112	R103-K114 CarbonylContact O-C 3.41Å; R103-K114 WeakPolarHBondContact O-CA 3.17Å; R112-K114 HydrophobicContact CG-CG 4.48Å
115	V	85.6	Confident	80.7	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.024	27%	0.273	C	S	.	.			trans	-104.8	121.1	177.5	-170.9	0	0	0	0	109.6	F54 W55 W68 L71 L102 R103 C119 L120	F54-V115 HydrophobicContact CE1-CG1 4.31Å; W55-V115 HydrophobicContact CH2-CG1 4.22Å; W55-V115 HydrophobicContact CZ2-CG1 4.22Å; W68-V115 HydrophobicContact CZ3-CG2 4.09Å; L71-V115 HydrophobicContact CD1-CG2 4.37Å; L102-V115 WeakPolarHBondContact O-CB 3.37Å; L102-V115 WeakPolarHBondContact O-CG2 3.33Å; R103-V115 PolarHBondContact O-N 3.14Å; V115-C119 HydrophobicContact CG1-CB 3.79Å; V115-L120 HydrophobicContact CB-CD1 4.36Å; V115-L120 HydrophobicContact CB-CD2 4.42Å; V115-L120 HydrophobicContact CB-CG 4.47Å; V115-L120 HydrophobicContact CG1-CD1 4.32Å; V115-L120 HydrophobicContact CG1-CD2 3.81Å; V115-L120 HydrophobicContact CG1-CG 3.9Å
116	P	84.7	Confident	79.6	Confident	36 Å²	36	57 Å²	57	23%	0.234	29%	0.289	C	S	.	.			trans	-60.8	146	174.1	-25.1	35.3	0	0	0	112.5	F54 Y118 C119	F54-P116 HydrophobicContact CD2-CG 3.92Å; F54-P116 HydrophobicContact CE1-CG 4.46Å; F54-P116 HydrophobicContact CE2-CG 3.56Å; F54-P116 HydrophobicContact CZ-CG 3.87Å; P116-Y118 HydrophobicContact CB-CD1 3.38Å; P116-Y118 HydrophobicContact CB-CD2 4.45Å; P116-Y118 HydrophobicContact CB-CE1 3.06Å; P116-Y118 HydrophobicContact CB-CE2 4.2Å; P116-Y118 HydrophobicContact CB-CG 4.07Å; P116-Y118 HydrophobicContact CG-CD1 4.41Å; P116-Y118 HydrophobicContact CG-CE1 3.65Å; P116-Y118 PolarHBondContact O-N 3.14Å; P116-Y118 VanDerWaalsContact O-N 3.14Å; P116-C119 WeakPolarHBondContact O-CB 3.25Å; P116-C119 PolarHBondContact O-N 3.36Å
117	V	82.8	Confident	78.2	Confident	18 Å²	18	57 Å²	57	11%	0.109	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-23.8	-178.1	-73	0	0	0	0	114.3	I34 W36 C119 L120 S121	I34-V117 HydrophobicContact CD1-CG1 4.48Å; I34-V117 HydrophobicContact CG2-CB 4.5Å; I34-V117 HydrophobicContact CG2-CG1 3.91Å; W36-V117 HydrophobicContact CB-CB 4.46Å; W36-V117 HydrophobicContact CB-CG2 4.12Å; W36-V117 HydrophobicContact CD2-CB 4.5Å; W36-V117 HydrophobicContact CD2-CG2 3.87Å; W36-V117 HydrophobicContact CE3-CG2 4.15Å; W36-V117 HydrophobicContact CG-CB 4.14Å; W36-V117 HydrophobicContact CG-CG2 3.85Å; W36-V117 PolarHBondContact NE1-O 3.05Å; V117-C119 PolarHBondContact O-N 3.15Å; V117-L120 PolarHBondContact O-N 2.86Å; V117-L120 VanDerWaalsContact O-N 3.15Å; V117-S121 PolarHBondContact O-N 3.09Å; V117-S121 VanDerWaalsContact O-N 3.08Å; V117-S121 PolarHBondContact O-OG 3.08Å
118	Y	80.5	Confident	76.7	Confident	70 Å²	70	64.7 Å²	64.7	28%	0.275	33%	0.332	S	S	.	.	H	α-helix	trans	-68.2	-19	176.1	66.4	-107.3	0	0	0	113.1	W36 F54 P116	W36-Y118 VanDerWaalsContact CZ2-CA 3.46Å; W36-Y118 VanDerWaalsContact CZ2-CB 3.46Å; F54-Y118 HydrophobicContact CB-CE2 4.05Å; F54-Y118 VanDerWaalsContact CD2-OH 3.32Å; F54-Y118 WeakPolarHBondContact CD2-OH 3.4Å; F54-Y118 HydrophobicContact CG-CE2 4.39Å; P116-Y118 HydrophobicContact CB-CD1 3.38Å; P116-Y118 HydrophobicContact CB-CD2 4.45Å; P116-Y118 HydrophobicContact CB-CE1 3.06Å; P116-Y118 HydrophobicContact CB-CE2 4.2Å; P116-Y118 HydrophobicContact CB-CG 4.07Å; P116-Y118 HydrophobicContact CG-CD1 4.41Å; P116-Y118 HydrophobicContact CG-CE1 3.65Å; P116-Y118 PolarHBondContact O-N 3.14Å; P116-Y118 VanDerWaalsContact O-N 3.14Å
119	C	79.1	Confident	74.7	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.007	33%	0.326	C	S	.	.	H	α-helix	trans	-87.4	-18.2	173.1	-62.5	0	0	0	0	113.2	R51 F54 W55 V115 P116 V117	R51-C119 HydrophobicContact CG-CB 4.28Å; F54-C119 WeakPolarHBondContact CD1-SG 3.04Å; W55-C119 HydrophobicContact CZ2-CB 4.12Å; V115-C119 HydrophobicContact CG1-CB 3.79Å; P116-C119 WeakPolarHBondContact O-CB 3.25Å; P116-C119 PolarHBondContact O-N 3.36Å; V117-C119 PolarHBondContact O-N 3.15Å
120	L	76.3	Confident	72.9	Confident	22 Å²	22	66 Å²	66	12%	0.115	33%	0.329	C	S	.	.	H	α-helix	trans	-104.3	-19.1	-172.5	-60.5	177.1	0	0	0	113.3	I34 A75 L102 R103 V115 V117	I34-L120 HydrophobicContact CD1-CD1 4Å; A75-L120 HydrophobicContact CB-CD2 3.92Å; L102-L120 HydrophobicContact CB-CD1 3.76Å; L102-L120 HydrophobicContact CB-CD2 3.55Å; L102-L120 HydrophobicContact CB-CG 4.3Å; L102-L120 HydrophobicContact CD1-CD2 3.82Å; L102-L120 HydrophobicContact CG-CD2 4.33Å; R103-L120 HydrophobicContact CB-CD1 4.44Å; V115-L120 HydrophobicContact CB-CD1 4.36Å; V115-L120 HydrophobicContact CB-CD2 4.42Å; V115-L120 HydrophobicContact CB-CG 4.47Å; V115-L120 HydrophobicContact CG1-CD1 4.32Å; V115-L120 HydrophobicContact CG1-CD2 3.81Å; V115-L120 HydrophobicContact CG1-CG 3.9Å; V117-L120 PolarHBondContact O-N 2.86Å; V117-L120 VanDerWaalsContact O-N 3.15Å
121	S	73.4	Confident	70.6	Confident	11 Å²	11	68.3 Å²	68.3	8%	0.077	34%	0.338	C	S	.	.	S	Bend	trans	-160.7	150.6	-173.2	51.2	0	0	0	0	111	I34 W36 V117	I34-S121 WeakPolarHBondContact O-CB 3.43Å; I34-S121 PolarHBondContact O-OG 3.15Å; W36-S121 PolarHBondContact NE1-O 2.76Å; W36-S121 PolarHBondContact NE1-OG 3.33Å; V117-S121 PolarHBondContact O-N 3.09Å; V117-S121 VanDerWaalsContact O-N 3.08Å; V117-S121 PolarHBondContact O-OG 3.08Å
122	L	69.8	Low	68.6	Low	103 Å²	103	73 Å²	73	54%	0.539	36%	0.361	S	S	.	.			trans	-75.7	137.4	173.3	-66.4	175.7	0	0	0	110.5	L44 L47 L126	L44-L122 HydrophobicContact CD1-CD2 4.05Å; L47-L122 HydrophobicContact CD2-CD2 3.73Å; L122-L126 HydrophobicContact CB-CD1 3.88Å; L122-L126 HydrophobicContact CD1-CD1 4.08Å; L122-L126 HydrophobicContact CD2-CD1 4.23Å; L122-L126 HydrophobicContact CG-CD1 4.28Å
123	P	69.1	Low	66.6	Low	4 Å²	4	73.6 Å²	73.6	3%	0.026	38%	0.381	C	S	.	.			trans	-65.7	146.3	175.1	23	-24.7	0	0	0	109.7	W36 L47 N125 L126	W36-P123 HydrophobicContact CD2-CB 4Å; W36-P123 HydrophobicContact CE3-CB 4.21Å; W36-P123 HydrophobicContact CH2-CB 3.7Å; W36-P123 HydrophobicContact CH2-CG 3.85Å; W36-P123 HydrophobicContact CZ2-CB 3.46Å; W36-P123 VanDerWaalsContact CZ2-CB 3.46Å; W36-P123 VanDerWaalsContact CZ2-CD 3.47Å; W36-P123 HydrophobicContact CZ2-CG 3.54Å; W36-P123 HydrophobicContact CZ3-CB 4.08Å; W36-P123 WeakPolarHBondContact O-CA 3.5Å; L47-P123 HydrophobicContact CD2-CG 4.03Å; P123-N125 PolarHBondContact O-N 2.97Å; P123-N125 VanDerWaalsContact O-N 3.09Å; P123-L126 HydrophobicContact CG-CD2 4.11Å; P123-L126 HydrophobicContact CG-CG 4.04Å
124	M	60.1	Low	64.2	Low	141 Å²	141	78.8 Å²	78.8	70%	0.695	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18	174.1	-164	176.6	-66.2	0	0	112.6	K35 W36	K35-M124 HydrophobicContact CB-CE 4.35Å; K35-M124 HydrophobicContact CD-CE 4.42Å; W36-M124 PolarHBondContact O-N 3.2Å
125	N	60.8	Low	62.3	Low	74 Å²	74	83.5 Å²	83.5	40%	0.396	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	42.4	-176.1	-64.1	-24.9	0	0	0	113.1	P123 V127	P123-N125 PolarHBondContact O-N 2.97Å; P123-N125 VanDerWaalsContact O-N 3.09Å; N125-V127 PolarHBondContact O-N 3.42Å
126	L	63	Low	60.2	Low	65 Å²	65	86.7 Å²	86.7	34%	0.34	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	122	172.6	-81.4	163.8	0	0	0	110.5	L44 L47 L122 P123	L44-L126 HydrophobicContact CB-CD2 4.11Å; L44-L126 HydrophobicContact CD1-CD2 3.91Å; L47-L126 HydrophobicContact CD2-CD2 4Å; L122-L126 HydrophobicContact CB-CD1 3.88Å; L122-L126 HydrophobicContact CD1-CD1 4.08Å; L122-L126 HydrophobicContact CD2-CD1 4.23Å; L122-L126 HydrophobicContact CG-CD1 4.28Å; P123-L126 HydrophobicContact CG-CD2 4.11Å; P123-L126 HydrophobicContact CG-CG 4.04Å
127	V	60.6	Low	58.4	Low	73 Å²	73	90.5 Å²	90.5	44%	0.442	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	116.6	166.1	178.1	0	0	0	0	108	P41 V42 S43 N125 E129	P41-V127 HydrophobicContact CB-CG2 3.44Å; P41-V127 VanDerWaalsContact CB-CG2 3.44Å; V42-V127 PolarHBondContact O-N 2.97Å; V42-V127 VanDerWaalsContact O-N 3.16Å; S43-V127 VanDerWaalsContact CA-O 3.29Å; S43-V127 WeakPolarHBondContact CA-O 3.38Å; N125-V127 PolarHBondContact O-N 3.42Å; V127-E129 PolarHBondContact O-N 3.38Å; V127-E129 VanDerWaalsContact O-N 3.15Å
128	E	58	Low	56.5	Low	167 Å²	167	96.3 Å²	96.3	78%	0.78	53%	0.53	S	S	*	.			trans	-64.9	115.8	174.4	-166	165.2	-151.3	0	0	109	R130	E128-R130 PolarHBondContact O-N 3.11Å
129	E	44.9	Very low	55	Low	106 Å²	106	103.1 Å²	103.1	50%	0.495	56%	0.555	S	S	.	*			trans	-69.9	113.3	177.5	-151.6	174.4	161.6	0	0	108.3	S43 T45 V127 S131	S43-E129 PolarHBondContact OG-OE2 3.27Å; T45-E129 WeakPolarHBondContact CB-OE2 3.36Å; T45-E129 PolarHBondContact OG1-OE2 3.38Å; V127-E129 PolarHBondContact O-N 3.38Å; V127-E129 VanDerWaalsContact O-N 3.15Å; E129-S131 VanDerWaalsContact C-N 3.33Å; E129-S131 PolarHBondContact O-N 3.3Å
130	R	46.3	Very low	53.3	Low	157 Å²	157	107.8 Å²	107.8	59%	0.592	59%	0.587	S	S	*	*			trans	-60.7	93.9	174.4	-106	179.1	-88.1	157.9	-6.3	109.6	E128 L132	E128-R130 PolarHBondContact O-N 3.11Å; R130-L132 PolarHBondContact O-N 2.91Å; R130-L132 VanDerWaalsContact O-N 3.17Å
131	S	36.7	Very low	52	Low	101 Å²	101	114.6 Å²	114.6	71%	0.706	62%	0.623	S	S	*	*			trans	31.9	73.5	139.1	-46.5	0	0	0	0	115.5	E129	E129-S131 VanDerWaalsContact C-N 3.33Å; E129-S131 PolarHBondContact O-N 3.3Å
132	L	43.7	Very low	50.7	Low	166 Å²	166	119.9 Å²	119.9	87%	0.869	66%	0.66	S	S	*	*			trans	-121.9	38.2	169.8	-78.4	168.7	0	0	0	112.2	R130	R130-L132 PolarHBondContact O-N 2.91Å; R130-L132 VanDerWaalsContact O-N 3.17Å
133	S	45.4	Very low	49.1	Very low	114 Å²	114	123.2 Å²	123.2	80%	0.797	68%	0.679	S	S	*	*			trans	-121.9	54.6	167.4	54.2	0	0	0	0	111.2	K135	S133-K135 VanDerWaalsContact C-N 3.32Å; S133-K135 PolarHBondContact O-N 3.37Å
134	S	40.3	Very low	47.5	Very low	110 Å²	110	126.6 Å²	126.6	77%	0.769	71%	0.714	S	S	*	*			trans	-73.2	86	162.8	30	0	0	0	0	109.8
135	K	47.9	Very low	46.9	Very low	211 Å²	211	125 Å²	125	92%	0.917	72%	0.717	S	S	*	*			trans	-172.3	111.9	152.7	-105.7	167.4	-173.5	-176.5	0	111	S133	S133-K135 VanDerWaalsContact C-N 3.32Å; S133-K135 PolarHBondContact O-N 3.37Å
136	G	41.3	Very low	46.2	Very low	70 Å²	70	127.4 Å²	127.4	72%	0.722	74%	0.739	S	S	*	*			trans	126.5	118.3	148.8	0	0	0	0	0	116.9
137	S	46.7	Very low	45.7	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	75%	0.747	S	S	*	*			trans	67.2	84.1	155.4	50.1	0	0	0	0	119.5
138	D	43.2	Very low	45.3	Very low	139 Å²	139	128.7 Å²	128.7	74%	0.743	75%	0.749	S	S	*	*				22	102.6	108.6	-159.7	23.7	0	0	0	116.4
139	R	48.8	Very low	45.3	Very low	214 Å²	214	127.7 Å²	127.7	81%	0.808	75%	0.749	S	S	*	*				164.3	114.7	126.3	-87.7	163.9	-173.6	-153.9	1.1	113.1
140	S	43.6	Very low	46.4	Very low	98 Å²	98	126.9 Å²	126.9	69%	0.685	75%	0.748	S	S	*	*			trans	81.4	116	137.2	-41.4	0	0	0	0	119.9
141	L	49.3	Very low	47.8	Very low	165 Å²	165	121.3 Å²	121.3	86%	0.864	73%	0.731	S	S	*	*			trans	78.5	93.7	142	-57.6	147.3	0	0	0	118.2
142	S	45.7	Very low	49.8	Very low	123 Å²	123	118.1 Å²	118.1	86%	0.86	71%	0.706	S	S	*	*				168	137.2	109.5	52.8	0	0	0	0	112.1
143	N	35	Very low	51.7	Low	173 Å²	173	112.1 Å²	112.1	93%	0.925	68%	0.678	S	S	*	*			trans	-53.5	140.7	-177.3	-74.9	-2.7	0	0	0	114.3
144	G	36.3	Very low	53.5	Low	74 Å²	74	106.9 Å²	106.9	76%	0.763	64%	0.641	S	S	*	*			trans	130.4	32.2	138.2	0	0	0	0	0	120.8
145	S	48.4	Very low	55.6	Low	109 Å²	109	104.8 Å²	104.8	76%	0.762	62%	0.618	S	S	*	*			trans	-148.1	63	177.5	-58.2	0	0	0	0	114.9	D147	S145-D147 VanDerWaalsContact C-N 3.26Å; S145-D147 PolarHBondContact O-N 3.36Å
146	S	45.8	Very low	57.4	Low	124 Å²	124	94.8 Å²	94.8	87%	0.867	58%	0.575	S	S	*	*			trans	-87.3	12.6	172.9	-140.2	0	0	0	0	113.8
147	D	52.2	Low	59.5	Low	93 Å²	93	96.9 Å²	96.9	50%	0.497	56%	0.561	S	S	.	*			trans	-104.2	-3.8	-162.7	-118.8	18.1	0	0	0	114.5	S145 K170	S145-D147 VanDerWaalsContact C-N 3.26Å; S145-D147 PolarHBondContact O-N 3.36Å; D147-K170 VanDerWaalsContact CG-NZ 3.33Å; D147-K170 WeakPolarHBondContact O-CE 3.44Å; D147-K170 IonicContact OD2-NZ 2.68Å; D147-K170 PolarHBondContact OD2-NZ 3Å
148	S	52.3	Low	61.3	Low	71 Å²	71	91.5 Å²	91.5	50%	0.497	52%	0.523	S	S	.	.	S	Bend	trans	-91.6	-17.6	-171.5	-47	0	0	0	0	114.4	N150	S148-N150 VanDerWaalsContact C-N 3.27Å; S148-N150 PolarHBondContact O-N 3.34Å
149	L	57.4	Low	63.1	Low	146 Å²	146	87.7 Å²	87.7	76%	0.764	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.1	-178.2	-88.5	163.4	0	0	0	114.2
150	N	68.1	Low	64.3	Low	89 Å²	89	81.2 Å²	81.2	48%	0.476	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	22.3	-172	-70.1	2.7	0	0	0	113.4	S148 K170 S171	S148-N150 VanDerWaalsContact C-N 3.27Å; S148-N150 PolarHBondContact O-N 3.34Å; N150-K170 CarbonylContact O-C 3.6Å; N150-K170 VanDerWaalsContact O-CA 3.25Å; N150-K170 WeakPolarHBondContact O-CA 3.24Å; N150-S171 PolarHBondContact O-N 2.96Å; N150-S171 PolarHBondContact O-OG 2.65Å
151	T	75.5	Confident	65.8	Low	40 Å²	40	81.3 Å²	81.3	25%	0.245	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.8	177.4	58.1	0	0	0	0	112.5	V169 K170	T151-V169 CarbonylContact C-O 3.55Å; T151-V169 WeakPolarHBondContact CA-O 3.36Å; T151-K170 HydrophobicContact CG2-CG 3.81Å
152	I	79.5	Confident	67.2	Low	34 Å²	34	76 Å²	76	17%	0.174	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.3	176.2	-58.3	170.4	0	0	0	109.1	V154 V169 S171 I210 P217	I152-V154 HydrophobicContact CG2-CG2 4.23Å; I152-V169 PolarHBondContact N-O 2.91Å; I152-V169 PolarHBondContact O-N 2.81Å; I152-V169 VanDerWaalsContact O-O 3.13Å; I152-S171 WeakPolarHBondContact CD1-OG 3.21Å; I152-I210 HydrophobicContact CD1-CG2 4.12Å; I152-P217 HydrophobicContact CG2-CB 4.23Å
153	S	82.5	Confident	68.8	Low	40 Å²	40	75.6 Å²	75.6	28%	0.28	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.7	172.6	60.9	0	0	0	0	110.9	M168 G218	S153-M168 VanDerWaalsContact CB-SD 3.54Å; S153-G218 PolarHBondContact O-N 3.11Å
154	V	83.7	Confident	71.1	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.024	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.6	-177.5	-179.2	0	0	0	0	109.2	I152 L156 R166 L167 I221	I152-V154 HydrophobicContact CG2-CG2 4.23Å; V154-L156 HydrophobicContact CG1-CG 4.39Å; V154-R166 WeakPolarHBondContact O-CA 3.39Å; V154-L167 PolarHBondContact N-O 3.39Å; V154-L167 PolarHBondContact O-N 3.11Å; V154-I221 HydrophobicContact CG1-CD1 3.3Å; V154-I221 HydrophobicContact CG1-CG1 3.7Å
155	K	84.7	Confident	73.4	Confident	67 Å²	67	68.5 Å²	68.5	29%	0.291	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.5	170.5	-74	174.8	179.2	172.1	0	108.7	I165 R166 F219 V220 I221	K155-I165 CarbonylContact C-O 3.13Å; K155-I165 WeakPolarHBondContact CA-O 3.48Å; K155-R166 HydrophobicContact CG-CG 3.96Å; K155-F219 WeakPolarHBondContact CB-O 3.39Å; K155-F219 PolarHBondContact N-O 3.23Å; K155-F219 VanDerWaalsContact N-O 3.09Å; K155-V220 HydrophobicContact CB-CG2 4.07Å; K155-V220 HydrophobicContact CD-CG2 4.41Å; K155-V220 CarbonylContact O-C 3.59Å; K155-V220 VanDerWaalsContact O-CA 3.29Å; K155-V220 WeakPolarHBondContact O-CA 3.37Å; K155-I221 PolarHBondContact O-N 3.25Å
156	L	85.7	Confident	75.1	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120.7	179.6	-66	145.4	0	0	0	107.4	V154 D164 I165 L167 L182 W197 I221 V223	V154-L156 HydrophobicContact CG1-CG 4.39Å; L156-D164 CarbonylContact O-C 3.6Å; L156-D164 WeakPolarHBondContact O-CA 3.36Å; L156-I165 PolarHBondContact N-O 3.38Å; L156-I165 PolarHBondContact O-N 3.05Å; L156-L167 HydrophobicContact CD1-CB 3.42Å; L156-L167 VanDerWaalsContact CD1-CB 3.42Å; L156-L167 HydrophobicContact CD1-CD2 3.78Å; L156-L167 HydrophobicContact CD1-CG 4.21Å; L156-L182 HydrophobicContact CD1-CD1 3.99Å; L156-L182 HydrophobicContact CD1-CD2 4.34Å; L156-W197 HydrophobicContact CD1-CH2 4.14Å; L156-W197 HydrophobicContact CD1-CZ2 4.49Å; L156-W197 HydrophobicContact CD2-CD2 4.07Å; L156-W197 HydrophobicContact CD2-CE3 3.9Å; L156-W197 HydrophobicContact CD2-CH2 3.5Å; L156-W197 HydrophobicContact CD2-CZ2 3.69Å; L156-W197 HydrophobicContact CD2-CZ3 3.61Å; L156-W197 HydrophobicContact CG-CH2 4.49Å; L156-I221 CarbonylContact C-O 3.52Å; L156-I221 WeakPolarHBondContact CA-O 3.4Å; L156-I221 HydrophobicContact CD2-CB 3.9Å; L156-I221 HydrophobicContact CD2-CD1 4.27Å; L156-I221 HydrophobicContact CD2-CG2 4.04Å; L156-V223 HydrophobicContact CB-CG2 4.13Å; L156-V223 HydrophobicContact CD2-CG2 3.48Å; L156-V223 VanDerWaalsContact CD2-CG2 3.48Å; L156-V223 HydrophobicContact CG-CG2 4.42Å
157	R	85.4	Confident	77	Confident	115 Å²	115	66.2 Å²	66.2	43%	0.434	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.2	175.3	-178.5	164.7	-64.7	178.2	-0.1	109	S159 D164 V220 I221 V223	R157-S159 PolarHBondContact O-N 2.87Å; R157-D164 WeakPolarHBondContact CB-OD1 3.29Å; R157-D164 VanDerWaalsContact CG-OD1 3.27Å; R157-D164 WeakPolarHBondContact CG-OD1 3.29Å; R157-D164 IonicContact CZ-OD1 2.65Å; R157-D164 IonicContact CZ-OD2 2.75Å; R157-D164 IonicContact NE-OD1 3.88Å; R157-D164 PolarHBondContact NE-OD1 2.85Å; R157-D164 IonicContact NE-OD2 2.8Å; R157-D164 IonicContact NH2-OD1 3.29Å; R157-D164 PolarHBondContact NH2-OD1 3.4Å; R157-D164 IonicContact NH2-OD2 3.94Å; R157-D164 PolarHBondContact NH2-OD2 3.05Å; R157-V220 HydrophobicContact CB-CG1 3.53Å; R157-I221 PolarHBondContact N-O 3.23Å; R157-V223 PolarHBondContact O-N 3.15Å
158	L	83.6	Confident	78.5	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.016	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.8	176.6	-67.5	173.1	0	0	0	109.8	S160 G162 K163 I165 L189 V223	L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.4Å; L158-G162 WeakPolarHBondContact O-CA 3.39Å; L158-G162 PolarHBondContact O-N 3.48Å; L158-K163 HydrophobicContact CD1-CB 4.38Å; L158-K163 PolarHBondContact N-O 3.13Å; L158-I165 HydrophobicContact CD1-CD1 3.42Å; L158-I165 VanDerWaalsContact CD1-CD1 3.42Å; L158-I165 HydrophobicContact CG-CD1 3.74Å; L158-L189 HydrophobicContact CD1-CD2 3.96Å; L158-L189 HydrophobicContact CD2-CD1 3.95Å; L158-L189 HydrophobicContact CD2-CD2 3.49Å; L158-L189 VanDerWaalsContact CD2-CD2 3.49Å; L158-L189 HydrophobicContact CD2-CG 4.37Å; L158-L189 HydrophobicContact CG-CD2 4.38Å; L158-V223 HydrophobicContact CD2-CB 4.03Å; L158-V223 HydrophobicContact CD2-CG1 3.93Å
159	S	81	Confident	80	Confident	60 Å²	60	64.3 Å²	64.3	42%	0.42	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-30.1	177.4	-156.9	0	0	0	0	112.2	R157 Q222 V223	R157-S159 PolarHBondContact O-N 2.87Å; S159-Q222 PolarHBondContact OG-NE2 3.39Å; S159-V223 PolarHBondContact N-O 3.25Å
160	S	74	Confident	81.1	Confident	78 Å²	78	60 Å²	60	55%	0.545	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-40.7	-178.9	53.4	0	0	0	0	113.3	L158	L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.4Å
161	T	75.8	Confident	81.6	Confident	100 Å²	100	56.9 Å²	56.9	61%	0.613	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-13.2	-174.3	-39.9	0	0	0	0	112.8	K163	T161-K163 HydrophobicContact CG2-CB 4.1Å; T161-K163 PolarHBondContact O-N 2.9Å
162	G	78.3	Confident	81.9	Confident	52 Å²	52	57.8 Å²	57.8	54%	0.536	31%	0.309	S	S	.	.			trans	67.5	7.6	-169.2	0	0	0	0	0	114	L158	L158-G162 WeakPolarHBondContact O-CA 3.39Å; L158-G162 PolarHBondContact O-N 3.48Å
163	K	79.5	Confident	82.1	Confident	116 Å²	116	57 Å²	57	50%	0.504	31%	0.305	S	S	.	.			trans	-82.8	132.5	-171.9	-168.7	177.4	-177.1	178.5	0	111.3	L158 T161	L158-K163 HydrophobicContact CD1-CB 4.38Å; L158-K163 PolarHBondContact N-O 3.13Å; T161-K163 HydrophobicContact CG2-CB 4.1Å; T161-K163 PolarHBondContact O-N 2.9Å
164	D	83.9	Confident	82.2	Confident	78 Å²	78	56.5 Å²	56.5	42%	0.417	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.8	176.4	-74	-7.9	0	0	0	111.6	L156 R157	L156-D164 CarbonylContact O-C 3.6Å; L156-D164 WeakPolarHBondContact O-CA 3.36Å; R157-D164 WeakPolarHBondContact CB-OD1 3.29Å; R157-D164 VanDerWaalsContact CG-OD1 3.27Å; R157-D164 WeakPolarHBondContact CG-OD1 3.29Å; R157-D164 IonicContact CZ-OD1 2.65Å; R157-D164 IonicContact CZ-OD2 2.75Å; R157-D164 IonicContact NE-OD1 3.88Å; R157-D164 PolarHBondContact NE-OD1 2.85Å; R157-D164 IonicContact NE-OD2 2.8Å; R157-D164 IonicContact NH2-OD1 3.29Å; R157-D164 PolarHBondContact NH2-OD1 3.4Å; R157-D164 IonicContact NH2-OD2 3.94Å; R157-D164 PolarHBondContact NH2-OD2 3.05Å
165	I	83.5	Confident	82.3	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.097	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.5	-179	-64.4	131.7	0	0	0	109	K155 L156 L158 L182 L186	K155-I165 CarbonylContact C-O 3.13Å; K155-I165 WeakPolarHBondContact CA-O 3.48Å; L156-I165 PolarHBondContact N-O 3.38Å; L156-I165 PolarHBondContact O-N 3.05Å; L158-I165 HydrophobicContact CD1-CD1 3.42Å; L158-I165 VanDerWaalsContact CD1-CD1 3.42Å; L158-I165 HydrophobicContact CG-CD1 3.74Å; I165-L182 HydrophobicContact CB-CD1 4.46Å; I165-L182 HydrophobicContact CD1-CD1 4.44Å; I165-L182 HydrophobicContact CG2-CD1 3.94Å; I165-L186 HydrophobicContact CB-CD1 4.39Å; I165-L186 HydrophobicContact CD1-CD1 3.16Å; I165-L186 HydrophobicContact CD1-CD2 4.4Å; I165-L186 HydrophobicContact CD1-CG 4.38Å; I165-L186 HydrophobicContact CG1-CD1 3.62Å; I165-L186 HydrophobicContact CG2-CD1 4.1Å
166	R	85.6	Confident	82.3	Confident	178 Å²	178	55.6 Å²	55.6	67%	0.672	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.7	174.6	-67.7	179.9	-171.3	-167.2	3.9	109.1	V154 K155	V154-R166 WeakPolarHBondContact O-CA 3.39Å; K155-R166 HydrophobicContact CG-CG 3.96Å
167	L	85.2	Confident	82.3	Confident	8 Å²	8	59.9 Å²	59.9	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130	177.5	-174.4	71.8	0	0	0	109.9	V154 L156 V169 A178 R181 L185 W197	V154-L167 PolarHBondContact N-O 3.39Å; V154-L167 PolarHBondContact O-N 3.11Å; L156-L167 HydrophobicContact CD1-CB 3.42Å; L156-L167 VanDerWaalsContact CD1-CB 3.42Å; L156-L167 HydrophobicContact CD1-CD2 3.78Å; L156-L167 HydrophobicContact CD1-CG 4.21Å; L167-V169 HydrophobicContact CB-CG2 4.31Å; L167-V169 HydrophobicContact CD2-CG2 3.47Å; L167-V169 VanDerWaalsContact CD2-CG2 3.47Å; L167-V169 HydrophobicContact CG-CG2 3.58Å; L167-A178 HydrophobicContact CD2-CB 4.17Å; L167-A178 WeakPolarHBondContact CD2-O 3.35Å; L167-R181 HydrophobicContact CD1-CB 3.81Å; L167-R181 HydrophobicContact CD2-CB 4.31Å; L167-L185 HydrophobicContact CD1-CD1 3.57Å; L167-W197 HydrophobicContact CD2-CH2 4.2Å
168	M	83.1	Confident	82.3	Confident	118 Å²	118	54.4 Å²	54.4	58%	0.581	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	120	172.4	-65.7	-67.7	-76.1	0	0	108.7	S153	S153-M168 VanDerWaalsContact CB-SD 3.54Å
169	V	83.7	Confident	82.4	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	146.1	-178.1	-150.8	0	0	0	0	110.7	T151 I152 L167 D173 A178 I210	T151-V169 CarbonylContact C-O 3.55Å; T151-V169 WeakPolarHBondContact CA-O 3.36Å; I152-V169 PolarHBondContact N-O 2.91Å; I152-V169 PolarHBondContact O-N 2.81Å; I152-V169 VanDerWaalsContact O-O 3.13Å; L167-V169 HydrophobicContact CB-CG2 4.31Å; L167-V169 HydrophobicContact CD2-CG2 3.47Å; L167-V169 VanDerWaalsContact CD2-CG2 3.47Å; L167-V169 HydrophobicContact CG-CG2 3.58Å; V169-D173 HydrophobicContact CG1-CB 3.79Å; V169-A178 HydrophobicContact CG1-CB 4.02Å; V169-A178 HydrophobicContact CG2-CB 4.18Å; V169-I210 HydrophobicContact CB-CD1 3.47Å; V169-I210 VanDerWaalsContact CB-CD1 3.47Å; V169-I210 HydrophobicContact CG1-CD1 3.13Å; V169-I210 HydrophobicContact CG2-CD1 4.24Å
170	K	81.7	Confident	82.6	Confident	56 Å²	56	57 Å²	57	24%	0.243	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	146	177.5	-64.1	172.7	173.6	177.9	0	110.8	D147 N150 T151 S172 D173 I210	D147-K170 VanDerWaalsContact CG-NZ 3.33Å; D147-K170 WeakPolarHBondContact O-CE 3.44Å; D147-K170 IonicContact OD2-NZ 2.68Å; D147-K170 PolarHBondContact OD2-NZ 3Å; N150-K170 CarbonylContact O-C 3.6Å; N150-K170 VanDerWaalsContact O-CA 3.25Å; N150-K170 WeakPolarHBondContact O-CA 3.24Å; T151-K170 HydrophobicContact CG2-CG 3.81Å; K170-S172 PolarHBondContact O-N 3.37Å; K170-S172 VanDerWaalsContact O-N 3.17Å; K170-D173 HydrophobicContact CB-CB 4.36Å; K170-D173 WeakPolarHBondContact CB-OD2 3.46Å; K170-D173 PolarHBondContact N-OD2 3.11Å; K170-D173 WeakPolarHBondContact O-CB 3.36Å; K170-D173 PolarHBondContact O-N 2.85Å; K170-I210 WeakPolarHBondContact O-CD1 3.31Å
171	S	78	Confident	83	Confident	24 Å²	24	59.5 Å²	59.5	17%	0.168	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.4	172.9	-48.3	0	0	0	0	112.1	N150 I152 R211	N150-S171 PolarHBondContact O-N 2.96Å; N150-S171 PolarHBondContact O-OG 2.65Å; I152-S171 WeakPolarHBondContact CD1-OG 3.21Å; S171-R211 WeakPolarHBondContact O-CB 3.46Å; S171-R211 PolarHBondContact O-N 2.71Å
172	S	81.2	Confident	83.4	Confident	58 Å²	58	54.7 Å²	54.7	41%	0.406	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-10.9	175.1	53	0	0	0	0	114.2	K170 L209	K170-S172 PolarHBondContact O-N 3.37Å; K170-S172 VanDerWaalsContact O-N 3.17Å; S172-L209 WeakPolarHBondContact O-CD2 3.12Å
173	D	83.2	Confident	83.5	Confident	17 Å²	17	57.5 Å²	57.5	9%	0.091	27%	0.27	C	S	.	.	S	Bend	trans	-81.9	150.8	179.9	-74.4	-29.3	0	0	0	111.4	V169 K170 K177 I210	V169-D173 HydrophobicContact CG1-CB 3.79Å; K170-D173 HydrophobicContact CB-CB 4.36Å; K170-D173 WeakPolarHBondContact CB-OD2 3.46Å; K170-D173 PolarHBondContact N-OD2 3.11Å; K170-D173 WeakPolarHBondContact O-CB 3.36Å; K170-D173 PolarHBondContact O-N 2.85Å; D173-K177 HydrophobicContact CB-CB 4.47Å; D173-K177 HydrophobicContact CB-CD 4.26Å; D173-K177 VanDerWaalsContact OD1-CD 3.3Å; D173-K177 WeakPolarHBondContact OD1-CD 3.32Å; D173-K177 VanDerWaalsContact OD1-CE 3.27Å; D173-K177 WeakPolarHBondContact OD1-CE 3.41Å; D173-K177 IonicContact OD1-NZ 2.72Å; D173-K177 PolarHBondContact OD1-NZ 2.85Å; D173-I210 HydrophobicContact CB-CD1 4.12Å; D173-I210 PolarHBondContact O-N 3.34Å
174	S	85.4	Confident	83.5	Confident	31 Å²	31	57.7 Å²	57.7	22%	0.217	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-82.5	156.5	173.1	59.3	0	0	0	0	112	S176 K177 A178 A208	S174-S176 WeakPolarHBondContact CB-OG 3.4Å; S174-S176 PolarHBondContact O-N 3.38Å; S174-S176 PolarHBondContact OG-OG 3.36Å; S174-K177 WeakPolarHBondContact O-CB 3.3Å; S174-K177 PolarHBondContact O-N 3.31Å; S174-K177 PolarHBondContact OG-N 3.09Å; S174-A178 PolarHBondContact O-N 2.99Å; S174-A208 WeakPolarHBondContact CA-O 3.47Å
175	V	86	Confident	83.1	Confident	2 Å²	2	59 Å²	59	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-56.3	-35.6	173	172.8	0	0	0	0	111.4	K177 A178 K179 W197 L204 S205 A208	V175-K177 VanDerWaalsContact C-N 3.35Å; V175-K177 PolarHBondContact O-N 3.45Å; V175-A178 WeakPolarHBondContact O-CB 3.44Å; V175-A178 PolarHBondContact O-N 2.85Å; V175-K179 HydrophobicContact CG1-CD 4.27Å; V175-K179 HydrophobicContact CG1-CG 4.4Å; V175-K179 WeakPolarHBondContact O-CG 3.32Å; V175-K179 PolarHBondContact O-N 3.37Å; V175-W197 HydrophobicContact CG1-CD2 4.35Å; V175-W197 HydrophobicContact CG1-CE3 4.02Å; V175-L204 HydrophobicContact CG1-CB 4.21Å; V175-L204 HydrophobicContact CG2-CB 4.19Å; V175-L204 HydrophobicContact CG2-CD1 4.42Å; V175-S205 WeakPolarHBondContact CB-O 3.4Å; V175-A208 HydrophobicContact CG2-CB 4.26Å; V175-A208 WeakPolarHBondContact CG2-O 3.13Å; V175-A208 PolarHBondContact N-O 3.13Å
176	S	84.7	Confident	82.7	Confident	49 Å²	49	59.4 Å²	59.4	34%	0.343	28%	0.282	S	S	.	.	H	α-helix	trans	-58.6	-42.3	173.6	39	0	0	0	0	113.3	S174 K179 Q180 D206	S174-S176 WeakPolarHBondContact CB-OG 3.4Å; S174-S176 PolarHBondContact O-N 3.38Å; S174-S176 PolarHBondContact OG-OG 3.36Å; S176-K179 PolarHBondContact O-N 2.95Å; S176-Q180 PolarHBondContact O-N 2.91Å; S176-D206 WeakPolarHBondContact CB-O 3.35Å; S176-D206 PolarHBondContact N-O 2.83Å; S176-D206 PolarHBondContact OG-O 2.91Å
177	K	86	Confident	82	Confident	90 Å²	90	55.7 Å²	55.7	39%	0.391	28%	0.28	S	S	.	.	H	α-helix	trans	-69.1	-37.7	176.5	-167.3	165.1	172	-165.6	0	111.1	D173 S174 V175 Q180 R181	D173-K177 HydrophobicContact CB-CB 4.47Å; D173-K177 HydrophobicContact CB-CD 4.26Å; D173-K177 VanDerWaalsContact OD1-CD 3.3Å; D173-K177 WeakPolarHBondContact OD1-CD 3.32Å; D173-K177 VanDerWaalsContact OD1-CE 3.27Å; D173-K177 WeakPolarHBondContact OD1-CE 3.41Å; D173-K177 IonicContact OD1-NZ 2.72Å; D173-K177 PolarHBondContact OD1-NZ 2.85Å; S174-K177 WeakPolarHBondContact O-CB 3.3Å; S174-K177 PolarHBondContact O-N 3.31Å; S174-K177 PolarHBondContact OG-N 3.09Å; V175-K177 VanDerWaalsContact C-N 3.35Å; V175-K177 PolarHBondContact O-N 3.45Å; K177-Q180 PolarHBondContact O-N 2.88Å; K177-R181 WeakPolarHBondContact O-CG 3.41Å; K177-R181 PolarHBondContact O-N 3.43Å
178	A	85.9	Confident	81.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-44.2	172.9	0	0	0	0	0	112.1	L167 V169 S174 V175 Q180 R181 L182 W197 I210	L167-A178 HydrophobicContact CD2-CB 4.17Å; L167-A178 WeakPolarHBondContact CD2-O 3.35Å; V169-A178 HydrophobicContact CG1-CB 4.02Å; V169-A178 HydrophobicContact CG2-CB 4.18Å; S174-A178 PolarHBondContact O-N 2.99Å; V175-A178 WeakPolarHBondContact O-CB 3.44Å; V175-A178 PolarHBondContact O-N 2.85Å; A178-Q180 PolarHBondContact O-N 2.86Å; A178-R181 PolarHBondContact O-N 3.22Å; A178-L182 PolarHBondContact O-N 3.37Å; A178-W197 HydrophobicContact CB-CH2 3.49Å; A178-W197 VanDerWaalsContact CB-CH2 3.49Å; A178-W197 HydrophobicContact CB-CZ3 3.61Å; A178-I210 HydrophobicContact CB-CD1 4.4Å
179	K	85.8	Confident	80.4	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.035	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-42.6	174.1	-73.6	174.7	175.1	-170.1	0	112.5	V175 S176 L182 R183 P192 Q195 W197 D206	V175-K179 HydrophobicContact CG1-CD 4.27Å; V175-K179 HydrophobicContact CG1-CG 4.4Å; V175-K179 WeakPolarHBondContact O-CG 3.32Å; V175-K179 PolarHBondContact O-N 3.37Å; S176-K179 PolarHBondContact O-N 2.95Å; K179-L182 PolarHBondContact O-N 3.31Å; K179-R183 PolarHBondContact O-N 3.49Å; K179-P192 HydrophobicContact CB-CB 3.99Å; K179-Q195 WeakPolarHBondContact CE-O 3.5Å; K179-Q195 PolarHBondContact NZ-O 3.03Å; K179-W197 HydrophobicContact CB-CZ2 4.21Å; K179-W197 HydrophobicContact CG-CD2 4.01Å; K179-W197 VanDerWaalsContact CG-CE2 3.41Å; K179-W197 HydrophobicContact CG-CG 4.45Å; K179-W197 HydrophobicContact CG-CH2 4.31Å; K179-W197 HydrophobicContact CG-CZ2 3.58Å; K179-D206 WeakPolarHBondContact CD-OD1 3.26Å; K179-D206 WeakPolarHBondContact CE-OD1 3.43Å; K179-D206 IonicContact NZ-OD1 2.64Å; K179-D206 PolarHBondContact NZ-OD1 3.34Å
180	Q	83.7	Confident	79.6	Confident	111 Å²	111	59.2 Å²	59.2	52%	0.519	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-42.9	176.5	-173.6	176.9	2.7	0	0	111.8	S176 K177 A178 L182 R183 Q184	S176-Q180 PolarHBondContact O-N 2.91Å; K177-Q180 PolarHBondContact O-N 2.88Å; A178-Q180 PolarHBondContact O-N 2.86Å; Q180-L182 VanDerWaalsContact C-N 3.33Å; Q180-R183 PolarHBondContact O-N 3.25Å; Q180-Q184 WeakPolarHBondContact O-CG 3.29Å; Q180-Q184 PolarHBondContact O-N 2.79Å; Q180-Q184 VanDerWaalsContact O-N 3.1Å
181	R	83.5	Confident	79.1	Confident	129 Å²	129	60.6 Å²	60.6	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-62.8	-39.8	174.7	-69.2	-70.7	-167.8	162.8	3.6	112	L167 K177 A178 R183 Q184 L185	L167-R181 HydrophobicContact CD1-CB 3.81Å; L167-R181 HydrophobicContact CD2-CB 4.31Å; K177-R181 WeakPolarHBondContact O-CG 3.41Å; K177-R181 PolarHBondContact O-N 3.43Å; A178-R181 PolarHBondContact O-N 3.22Å; R181-R183 VanDerWaalsContact C-N 3.34Å; R181-R183 PolarHBondContact O-N 2.88Å; R181-Q184 WeakPolarHBondContact O-CB 3.48Å; R181-Q184 PolarHBondContact O-N 3.31Å; R181-L185 PolarHBondContact O-N 3.21Å; R181-L185 VanDerWaalsContact O-N 3.16Å
182	L	83.8	Confident	78.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-43.2	175	-178.8	61.5	0	0	0	111.8	L156 I165 A178 K179 Q180 Q184 L185 L186 L189 W197 V223	L156-L182 HydrophobicContact CD1-CD1 3.99Å; L156-L182 HydrophobicContact CD1-CD2 4.34Å; I165-L182 HydrophobicContact CB-CD1 4.46Å; I165-L182 HydrophobicContact CD1-CD1 4.44Å; I165-L182 HydrophobicContact CG2-CD1 3.94Å; A178-L182 PolarHBondContact O-N 3.37Å; K179-L182 PolarHBondContact O-N 3.31Å; Q180-L182 VanDerWaalsContact C-N 3.33Å; L182-Q184 VanDerWaalsContact C-N 3.3Å; L182-Q184 PolarHBondContact O-N 2.74Å; L182-L185 PolarHBondContact O-N 3.11Å; L182-L185 VanDerWaalsContact O-N 3.16Å; L182-L186 HydrophobicContact CD1-CD1 3.82Å; L182-L186 PolarHBondContact O-N 2.8Å; L182-L189 HydrophobicContact CD1-CD1 4.18Å; L182-L189 HydrophobicContact CD2-CD1 3.8Å; L182-L189 HydrophobicContact CG-CD1 3.61Å; L182-W197 HydrophobicContact CB-CZ2 4.15Å; L182-W197 HydrophobicContact CD2-CZ2 3.7Å; L182-V223 HydrophobicContact CD2-CG1 4.28Å; L182-V223 HydrophobicContact CD2-CG2 4.32Å
183	R	80	Confident	78	Confident	111 Å²	111	68.5 Å²	68.5	42%	0.419	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-33.9	175	-178.5	175.4	178.2	-177.1	3.5	113.1	K179 Q180 R181 L185 L186	K179-R183 PolarHBondContact O-N 3.49Å; Q180-R183 PolarHBondContact O-N 3.25Å; R181-R183 VanDerWaalsContact C-N 3.34Å; R181-R183 PolarHBondContact O-N 2.88Å; R183-L185 VanDerWaalsContact C-N 3.29Å; R183-L186 CarbonylContact O-C 3.5Å; R183-L186 PolarHBondContact O-N 2.71Å; R183-L186 VanDerWaalsContact O-O 3.09Å
184	Q	79.2	Confident	77.7	Confident	120 Å²	120	71.1 Å²	71.1	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-66.7	-33.4	174.9	-71.1	174.4	-11	0	0	112.1	Q180 R181 L182	Q180-Q184 WeakPolarHBondContact O-CG 3.29Å; Q180-Q184 PolarHBondContact O-N 2.79Å; Q180-Q184 VanDerWaalsContact O-N 3.1Å; R181-Q184 WeakPolarHBondContact O-CB 3.48Å; R181-Q184 PolarHBondContact O-N 3.31Å; L182-Q184 VanDerWaalsContact C-N 3.3Å; L182-Q184 PolarHBondContact O-N 2.74Å
185	L	75.9	Confident	77.5	Confident	106 Å²	106	69.7 Å²	69.7	56%	0.555	33%	0.329	S	S	*	.	H	α-helix	trans	-78	-33.6	175.9	-65.6	178.5	0	0	0	112.5	L167 R181 L182 R183	L167-L185 HydrophobicContact CD1-CD1 3.57Å; R181-L185 PolarHBondContact O-N 3.21Å; R181-L185 VanDerWaalsContact O-N 3.16Å; L182-L185 PolarHBondContact O-N 3.11Å; L182-L185 VanDerWaalsContact O-N 3.16Å; R183-L185 VanDerWaalsContact C-N 3.29Å
186	L	74.2	Confident	77.3	Confident	27 Å²	27	76 Å²	76	14%	0.141	35%	0.352	C	S	.	.			trans	-130.5	93	178.6	-68.9	130	0	0	0	109.9	I165 L182 R183 E188 L189	I165-L186 HydrophobicContact CB-CD1 4.39Å; I165-L186 HydrophobicContact CD1-CD1 3.16Å; I165-L186 HydrophobicContact CD1-CD2 4.4Å; I165-L186 HydrophobicContact CD1-CG 4.38Å; I165-L186 HydrophobicContact CG1-CD1 3.62Å; I165-L186 HydrophobicContact CG2-CD1 4.1Å; L182-L186 HydrophobicContact CD1-CD1 3.82Å; L182-L186 PolarHBondContact O-N 2.8Å; R183-L186 CarbonylContact O-C 3.5Å; R183-L186 PolarHBondContact O-N 2.71Å; R183-L186 VanDerWaalsContact O-O 3.09Å; L186-E188 PolarHBondContact O-N 2.94Å; L186-E188 VanDerWaalsContact O-N 3.15Å; L186-L189 HydrophobicContact CB-CD1 3.83Å; L186-L189 HydrophobicContact CB-CG 4.01Å; L186-L189 HydrophobicContact CD1-CD1 4.14Å; L186-L189 PolarHBondContact O-N 2.76Å
187	P	71.1	Confident	77.5	Confident	100 Å²	100	74 Å²	74	65%	0.649	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.9	176.8	23.5	-31.9	0	0	0	113	L189	P187-L189 PolarHBondContact O-N 2.91Å
188	E	68.2	Low	77.5	Confident	170 Å²	170	72.6 Å²	72.6	79%	0.794	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.1	175.6	-58	-57.6	132.9	0	0	114.3	L186	L186-E188 PolarHBondContact O-N 2.94Å; L186-E188 VanDerWaalsContact O-N 3.15Å
189	L	68.3	Low	77.4	Confident	13 Å²	13	74.2 Å²	74.2	7%	0.068	34%	0.338	C	S	.	.	S	Bend	trans	-83.9	139.3	-178.4	-68.7	171	0	0	0	112	L158 L182 L186 P187 A225	L158-L189 HydrophobicContact CD1-CD2 3.96Å; L158-L189 HydrophobicContact CD2-CD1 3.95Å; L158-L189 HydrophobicContact CD2-CD2 3.49Å; L158-L189 VanDerWaalsContact CD2-CD2 3.49Å; L158-L189 HydrophobicContact CD2-CG 4.37Å; L158-L189 HydrophobicContact CG-CD2 4.38Å; L182-L189 HydrophobicContact CD1-CD1 4.18Å; L182-L189 HydrophobicContact CD2-CD1 3.8Å; L182-L189 HydrophobicContact CG-CD1 3.61Å; L186-L189 HydrophobicContact CB-CD1 3.83Å; L186-L189 HydrophobicContact CB-CG 4.01Å; L186-L189 HydrophobicContact CD1-CD1 4.14Å; L186-L189 PolarHBondContact O-N 2.76Å; P187-L189 PolarHBondContact O-N 2.91Å; L189-A225 HydrophobicContact CD2-CB 4.11Å
190	P	65.3	Low	77	Confident	21 Å²	21	77 Å²	77	14%	0.136	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-60.5	165.9	175	25.9	-34.2	0	0	0	111.8	E194 Q195 A225	P190-E194 HydrophobicContact CB-CB 4.18Å; P190-E194 WeakPolarHBondContact CB-OE2 3.32Å; P190-Q195 PolarHBondContact O-NE2 3.16Å; P190-A225 HydrophobicContact CG-CB 3.66Å
191	I	71.5	Confident	76.8	Confident	85 Å²	85	75.4 Å²	75.4	44%	0.436	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-47.2	141.6	-173.7	-58.8	163.5	0	0	0	109.8	R193 E194	I191-R193 HydrophobicContact CG2-CB 4.27Å; I191-R193 HydrophobicContact CG2-CG 4.43Å; I191-R193 PolarHBondContact O-N 3.19Å; I191-E194 PolarHBondContact O-N 3.35Å
192	P	68.4	Low	76.7	Confident	29 Å²	29	77 Å²	77	19%	0.188	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-27.9	-178.9	-32.3	38	0	0	0	115	K179 E194 Q195	K179-P192 HydrophobicContact CB-CB 3.99Å; P192-E194 VanDerWaalsContact C-N 3.34Å; P192-Q195 PolarHBondContact O-N 3.24Å
193	R	68.8	Low	76.8	Confident	220 Å²	220	82.8 Å²	82.8	83%	0.83	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.4	176.5	-65.5	-176.5	178.3	171.7	-0.2	114.1	I191	I191-R193 HydrophobicContact CG2-CB 4.27Å; I191-R193 HydrophobicContact CG2-CG 4.43Å; I191-R193 PolarHBondContact O-N 3.19Å
194	E	76.3	Confident	77	Confident	71 Å²	71	78.2 Å²	78.2	33%	0.332	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-8.5	178.1	-66.5	-179	166.3	0	0	112.4	P190 I191 P192	P190-E194 HydrophobicContact CB-CB 4.18Å; P190-E194 WeakPolarHBondContact CB-OE2 3.32Å; I191-E194 PolarHBondContact O-N 3.35Å; P192-E194 VanDerWaalsContact C-N 3.34Å
195	Q	80.1	Confident	77.3	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.005	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121.4	174.5	-59.2	179.2	16.9	0	0	109.8	K179 P190 P192 V223 D224 A225	K179-Q195 WeakPolarHBondContact CE-O 3.5Å; K179-Q195 PolarHBondContact NZ-O 3.03Å; P190-Q195 PolarHBondContact O-NE2 3.16Å; P192-Q195 PolarHBondContact O-N 3.24Å; Q195-V223 HydrophobicContact CB-CG1 4.44Å; Q195-D224 CarbonylContact C-O 3.54Å; Q195-D224 WeakPolarHBondContact CA-O 3.36Å; Q195-A225 HydrophobicContact CG-CB 4.48Å
196	R	83.4	Confident	77.6	Confident	136 Å²	136	73.7 Å²	73.7	51%	0.513	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.2	172.1	-62.3	-175.9	-179.5	-177.1	-1.7	108.8	F198 D224	R196-F198 HydrophobicContact CB-CE2 3.67Å; R196-F198 HydrophobicContact CB-CZ 3.97Å; R196-D224 HydrophobicContact CB-CB 4.39Å; R196-D224 PolarHBondContact N-O 3.18Å; R196-D224 PolarHBondContact O-N 3.3Å
197	W	87.8	Confident	77.9	Confident	6 Å²	6	83.5 Å²	83.5	2%	0.023	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.2	-179.1	-73.3	23.6	0	0	0	108.7	L156 L167 V175 A178 K179 L182 M203 L204 I221 Q222 V223	L156-W197 HydrophobicContact CD1-CH2 4.14Å; L156-W197 HydrophobicContact CD1-CZ2 4.49Å; L156-W197 HydrophobicContact CD2-CD2 4.07Å; L156-W197 HydrophobicContact CD2-CE3 3.9Å; L156-W197 HydrophobicContact CD2-CH2 3.5Å; L156-W197 HydrophobicContact CD2-CZ2 3.69Å; L156-W197 HydrophobicContact CD2-CZ3 3.61Å; L156-W197 HydrophobicContact CG-CH2 4.49Å; L167-W197 HydrophobicContact CD2-CH2 4.2Å; V175-W197 HydrophobicContact CG1-CD2 4.35Å; V175-W197 HydrophobicContact CG1-CE3 4.02Å; A178-W197 HydrophobicContact CB-CH2 3.49Å; A178-W197 VanDerWaalsContact CB-CH2 3.49Å; A178-W197 HydrophobicContact CB-CZ3 3.61Å; K179-W197 HydrophobicContact CB-CZ2 4.21Å; K179-W197 HydrophobicContact CG-CD2 4.01Å; K179-W197 VanDerWaalsContact CG-CE2 3.41Å; K179-W197 HydrophobicContact CG-CG 4.45Å; K179-W197 HydrophobicContact CG-CH2 4.31Å; K179-W197 HydrophobicContact CG-CZ2 3.58Å; L182-W197 HydrophobicContact CB-CZ2 4.15Å; L182-W197 HydrophobicContact CD2-CZ2 3.7Å; W197-M203 CarbonylContact O-C 3.55Å; W197-M203 WeakPolarHBondContact O-CA 3.35Å; W197-L204 HydrophobicContact CB-CB 4.1Å; W197-L204 HydrophobicContact CB-CD1 4.23Å; W197-L204 HydrophobicContact CB-CG 4.46Å; W197-L204 HydrophobicContact CE3-CD1 4.42Å; W197-L204 PolarHBondContact O-N 3.29Å; W197-I221 HydrophobicContact CB-CG2 3.93Å; W197-I221 HydrophobicContact CD2-CG2 4.27Å; W197-I221 HydrophobicContact CE3-CD1 4.07Å; W197-I221 HydrophobicContact CE3-CG2 4.09Å; W197-I221 HydrophobicContact CG-CG2 4.25Å; W197-I221 HydrophobicContact CZ3-CD1 4.26Å; W197-Q222 CarbonylContact C-O 3.55Å; W197-Q222 WeakPolarHBondContact CA-O 3.4Å; W197-V223 HydrophobicContact CD2-CG2 4.16Å; W197-V223 HydrophobicContact CG-CG2 4.05Å
198	F	85.6	Confident	78.5	Confident	60 Å²	60	79.7 Å²	79.7	26%	0.263	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.9	-179.3	-60.4	-87.7	0	0	0	110	R196 K202 M203 I221 Q222 D224	R196-F198 HydrophobicContact CB-CE2 3.67Å; R196-F198 HydrophobicContact CB-CZ 3.97Å; F198-K202 WeakPolarHBondContact CA-O 3.5Å; F198-M203 HydrophobicContact CD1-CB 4.13Å; F198-M203 HydrophobicContact CE1-CB 4.02Å; F198-M203 HydrophobicContact CE1-CG 4.22Å; F198-I221 WeakPolarHBondContact O-CA 3.44Å; F198-I221 WeakPolarHBondContact O-CG2 3.36Å; F198-Q222 HydrophobicContact CB-CB 4.28Å; F198-Q222 PolarHBondContact N-O 3.38Å; F198-Q222 PolarHBondContact O-N 3.45Å; F198-D224 HydrophobicContact CD2-CB 4.45Å; F198-D224 HydrophobicContact CE2-CB 3.88Å
199	F	84.9	Confident	79.2	Confident	35 Å²	35	73.6 Å²	73.6	15%	0.154	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	121.3	176.7	171.4	-100.8	0	0	0	109	G201 K202 L204 I215 F219 I221	F199-G201 PolarHBondContact O-N 3.01Å; F199-G201 VanDerWaalsContact O-N 3.14Å; F199-K202 PolarHBondContact N-O 3.28Å; F199-K202 PolarHBondContact O-N 3.47Å; F199-L204 HydrophobicContact CB-CD1 4.1Å; F199-L204 HydrophobicContact CB-CD2 4.1Å; F199-L204 HydrophobicContact CB-CG 4.14Å; F199-I215 HydrophobicContact CD1-CG1 4.26Å; F199-I215 HydrophobicContact CD2-CG1 4.12Å; F199-I215 HydrophobicContact CD2-CG2 4.06Å; F199-I215 HydrophobicContact CE1-CG1 4.27Å; F199-I215 HydrophobicContact CE2-CB 4.15Å; F199-I215 HydrophobicContact CE2-CG1 4.1Å; F199-I215 HydrophobicContact CE2-CG2 3.75Å; F199-I215 HydrophobicContact CG-CG1 4.19Å; F199-I215 HydrophobicContact CZ-CB 4.36Å; F199-I215 HydrophobicContact CZ-CG1 4.2Å; F199-I215 HydrophobicContact CZ-CG2 4.41Å; F199-F219 AromaticContact CD2-CD1 3.44Å; F199-F219 HydrophobicContact CD2-CD1 3.44Å; F199-F219 VanDerWaalsContact CD2-CD1 3.44Å; F199-F219 AromaticContact CD2-CE1 3.74Å; F199-F219 HydrophobicContact CD2-CE1 3.74Å; F199-F219 HydrophobicContact CD2-CG 4.28Å; F199-F219 HydrophobicContact CE2-CB 4Å; F199-F219 AromaticContact CE2-CD1 3.11Å; F199-F219 HydrophobicContact CE2-CD1 3.11Å; F199-F219 HydrophobicContact CE2-CD2 4.28Å; F199-F219 AromaticContact CE2-CE1 3.5Å; F199-F219 HydrophobicContact CE2-CE1 3.5Å; F199-F219 VanDerWaalsContact CE2-CE1 3.5Å; F199-F219 AromaticContact CE2-CG 3.54Å; F199-F219 HydrophobicContact CE2-CG 3.54Å; F199-F219 HydrophobicContact CE2-CZ 4.23Å; F199-F219 HydrophobicContact CZ-CD1 4.22Å; F199-F219 HydrophobicContact CZ-CE1 4.36Å; F199-F219 HydrophobicContact CZ-CG 4.45Å; F199-I221 HydrophobicContact CD2-CG1 4.39Å
200	G	77.9	Confident	79.9	Confident	65 Å²	65	73.2 Å²	73.2	67%	0.67	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	33.5	179.1	0	0	0	0	0	114.1	K202	G200-K202 VanDerWaalsContact C-N 3.29Å; G200-K202 PolarHBondContact O-N 2.88Å
201	G	78	Confident	80.6	Confident	79 Å²	79	79.6 Å²	79.6	81%	0.814	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	-3.2	-175.8	0	0	0	0	0	115.5	F199	F199-G201 PolarHBondContact O-N 3.01Å; F199-G201 VanDerWaalsContact O-N 3.14Å
202	K	82.6	Confident	81	Confident	161 Å²	161	80.6 Å²	80.6	70%	0.7	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.8	176.4	-63.4	-179.9	179.7	176.9	0	110.7	F198 F199 G200	F198-K202 WeakPolarHBondContact CA-O 3.5Å; F199-K202 PolarHBondContact N-O 3.28Å; F199-K202 PolarHBondContact O-N 3.47Å; G200-K202 VanDerWaalsContact C-N 3.29Å; G200-K202 PolarHBondContact O-N 2.88Å
203	M	84.6	Confident	81.3	Confident	122 Å²	122	80.1 Å²	80.1	60%	0.601	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.1	172	-173.2	178.7	73.4	0	0	109.8	W197 F198	W197-M203 CarbonylContact O-C 3.55Å; W197-M203 WeakPolarHBondContact O-CA 3.35Å; F198-M203 HydrophobicContact CD1-CB 4.13Å; F198-M203 HydrophobicContact CE1-CB 4.02Å; F198-M203 HydrophobicContact CE1-CG 4.22Å
204	L	85.6	Confident	81.5	Confident	16 Å²	16	76.2 Å²	76.2	8%	0.084	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.9	175.7	-60.6	-176.7	0	0	0	109.9	V175 W197 F199 C213 I215 I221	V175-L204 HydrophobicContact CG1-CB 4.21Å; V175-L204 HydrophobicContact CG2-CB 4.19Å; V175-L204 HydrophobicContact CG2-CD1 4.42Å; W197-L204 HydrophobicContact CB-CB 4.1Å; W197-L204 HydrophobicContact CB-CD1 4.23Å; W197-L204 HydrophobicContact CB-CG 4.46Å; W197-L204 HydrophobicContact CE3-CD1 4.42Å; W197-L204 PolarHBondContact O-N 3.29Å; F199-L204 HydrophobicContact CB-CD1 4.1Å; F199-L204 HydrophobicContact CB-CD2 4.1Å; F199-L204 HydrophobicContact CB-CG 4.14Å; L204-C213 HydrophobicContact CD2-CB 4.03Å; L204-I215 HydrophobicContact CD1-CD1 3.86Å; L204-I221 HydrophobicContact CD1-CD1 4.05Å; L204-I221 HydrophobicContact CD1-CG2 4.37Å
205	S	84.4	Confident	81.4	Confident	65 Å²	65	73.2 Å²	73.2	46%	0.455	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-83.1	148.6	176.3	68	0	0	0	0	111.2	V175 R207 A208	V175-S205 WeakPolarHBondContact CB-O 3.4Å; S205-R207 PolarHBondContact O-N 2.82Å; S205-R207 VanDerWaalsContact O-N 3.08Å; S205-A208 WeakPolarHBondContact O-CB 3.48Å; S205-A208 PolarHBondContact O-N 3.34Å; S205-A208 PolarHBondContact OG-N 3.04Å
206	D	82.3	Confident	81	Confident	65 Å²	65	76 Å²	76	35%	0.348	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.8	-178.9	-71	-18.1	0	0	0	114.3	S176 K179	S176-D206 WeakPolarHBondContact CB-O 3.35Å; S176-D206 PolarHBondContact N-O 2.83Å; S176-D206 PolarHBondContact OG-O 2.91Å; K179-D206 WeakPolarHBondContact CD-OD1 3.26Å; K179-D206 WeakPolarHBondContact CE-OD1 3.43Å; K179-D206 IonicContact NZ-OD1 2.64Å; K179-D206 PolarHBondContact NZ-OD1 3.34Å
207	R	81.1	Confident	80.4	Confident	233 Å²	233	74.1 Å²	74.1	88%	0.879	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-15.8	179.2	-63.8	-175	-179.7	177.7	0.1	113.1	S205	S205-R207 PolarHBondContact O-N 2.82Å; S205-R207 VanDerWaalsContact O-N 3.08Å
208	A	83.1	Confident	79.6	Confident	21 Å²	21	75.4 Å²	75.4	17%	0.174	42%	0.419	C	S	.	.			trans	-68	138.9	178.3	0	0	0	0	0	110.4	S174 V175 S205	S174-A208 WeakPolarHBondContact CA-O 3.47Å; V175-A208 HydrophobicContact CG2-CB 4.26Å; V175-A208 WeakPolarHBondContact CG2-O 3.13Å; V175-A208 PolarHBondContact N-O 3.13Å; S205-A208 WeakPolarHBondContact O-CB 3.48Å; S205-A208 PolarHBondContact O-N 3.34Å; S205-A208 PolarHBondContact OG-N 3.04Å
209	L	83.1	Confident	79.3	Confident	41 Å²	41	77 Å²	77	22%	0.215	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-84.6	149.6	171.7	-64.7	163.5	0	0	0	109.4	S172 R211 D212 C213	S172-L209 WeakPolarHBondContact O-CD2 3.12Å; L209-R211 HydrophobicContact CB-CG 3.92Å; L209-R211 PolarHBondContact O-N 3.39Å; L209-D212 HydrophobicContact CB-CB 4.41Å; L209-D212 PolarHBondContact O-N 3.42Å; L209-C213 PolarHBondContact O-N 3.26Å; L209-C213 VanDerWaalsContact O-N 3.07Å; L209-C213 PolarHBondContact O-SG 2.99Å
210	I	83.2	Confident	79.1	Confident	6 Å²	6	77.7 Å²	77.7	3%	0.031	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.8	-179.9	-70.9	159.4	0	0	0	111.5	I152 V169 K170 D173 A178 D212 C213	I152-I210 HydrophobicContact CD1-CG2 4.12Å; V169-I210 HydrophobicContact CB-CD1 3.47Å; V169-I210 VanDerWaalsContact CB-CD1 3.47Å; V169-I210 HydrophobicContact CG1-CD1 3.13Å; V169-I210 HydrophobicContact CG2-CD1 4.24Å; K170-I210 WeakPolarHBondContact O-CD1 3.31Å; D173-I210 HydrophobicContact CB-CD1 4.12Å; D173-I210 PolarHBondContact O-N 3.34Å; A178-I210 HydrophobicContact CB-CD1 4.4Å; I210-D212 VanDerWaalsContact C-N 3.3Å; I210-D212 PolarHBondContact O-N 3.48Å; I210-C213 PolarHBondContact O-N 3.11Å
211	R	78.9	Confident	79.6	Confident	155 Å²	155	74.7 Å²	74.7	59%	0.585	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-39.4	172.7	70.1	-176.4	-169	-170.8	-3.8	112.9	S171 L209 C213 N214	S171-R211 WeakPolarHBondContact O-CB 3.46Å; S171-R211 PolarHBondContact O-N 2.71Å; L209-R211 HydrophobicContact CB-CG 3.92Å; L209-R211 PolarHBondContact O-N 3.39Å; R211-C213 VanDerWaalsContact C-N 3.31Å; R211-N214 PolarHBondContact O-N 3.47Å
212	D	81.4	Confident	79.9	Confident	106 Å²	106	75.6 Å²	75.6	57%	0.567	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.5	-177	-59.5	-18.6	0	0	0	111.1	L209 I210 N214	L209-D212 HydrophobicContact CB-CB 4.41Å; L209-D212 PolarHBondContact O-N 3.42Å; I210-D212 VanDerWaalsContact C-N 3.3Å; I210-D212 PolarHBondContact O-N 3.48Å; D212-N214 PolarHBondContact O-N 2.79Å
213	C	73.1	Confident	80.1	Confident	19 Å²	19	67.9 Å²	67.9	13%	0.128	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.8	175.1	-59	0	0	0	0	113	L204 L209 I210 R211 I215	L204-C213 HydrophobicContact CD2-CB 4.03Å; L209-C213 PolarHBondContact O-N 3.26Å; L209-C213 VanDerWaalsContact O-N 3.07Å; L209-C213 PolarHBondContact O-SG 2.99Å; I210-C213 PolarHBondContact O-N 3.11Å; R211-C213 VanDerWaalsContact C-N 3.31Å; C213-I215 VanDerWaalsContact C-N 3.25Å; C213-I215 HydrophobicContact CB-CD1 3.62Å; C213-I215 HydrophobicContact CB-CG1 3.54Å; C213-I215 PolarHBondContact O-N 3.15Å
214	N	73.1	Confident	79.9	Confident	137 Å²	137	63.8 Å²	63.8	73%	0.733	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	45.5	-178.9	-163	27.7	0	0	0	113.5	R211 D212 P216	R211-N214 PolarHBondContact O-N 3.47Å; D212-N214 PolarHBondContact O-N 2.79Å; N214-P216 VanDerWaalsContact O-CD 3.27Å; N214-P216 WeakPolarHBondContact O-CD 3.39Å
215	I	75	Confident	79.4	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.046	33%	0.331	C	S	.	.			trans	-84.7	112.1	-176.5	-53.2	177.5	0	0	0	108.1	F199 L204 C213 F219 I221	F199-I215 HydrophobicContact CD1-CG1 4.26Å; F199-I215 HydrophobicContact CD2-CG1 4.12Å; F199-I215 HydrophobicContact CD2-CG2 4.06Å; F199-I215 HydrophobicContact CE1-CG1 4.27Å; F199-I215 HydrophobicContact CE2-CB 4.15Å; F199-I215 HydrophobicContact CE2-CG1 4.1Å; F199-I215 HydrophobicContact CE2-CG2 3.75Å; F199-I215 HydrophobicContact CG-CG1 4.19Å; F199-I215 HydrophobicContact CZ-CB 4.36Å; F199-I215 HydrophobicContact CZ-CG1 4.2Å; F199-I215 HydrophobicContact CZ-CG2 4.41Å; L204-I215 HydrophobicContact CD1-CD1 3.86Å; C213-I215 VanDerWaalsContact C-N 3.25Å; C213-I215 HydrophobicContact CB-CD1 3.62Å; C213-I215 HydrophobicContact CB-CG1 3.54Å; C213-I215 PolarHBondContact O-N 3.15Å; I215-F219 HydrophobicContact CG2-CB 4.2Å; I215-I221 HydrophobicContact CD1-CD1 3.6Å; I215-I221 HydrophobicContact CD1-CG1 4.35Å; I215-I221 HydrophobicContact CG2-CD1 4.42Å; I215-I221 HydrophobicContact CG2-CG1 4.44Å
216	P	72.4	Confident	78.4	Confident	59 Å²	59	65.4 Å²	65.4	38%	0.383	33%	0.332	S	S	.	.			trans	-69	151.4	179.5	23	-25.5	0	0	0	111.1	N214 G218 F219	N214-P216 VanDerWaalsContact O-CD 3.27Å; N214-P216 WeakPolarHBondContact O-CD 3.39Å; P216-G218 PolarHBondContact O-N 3.05Å; P216-F219 HydrophobicContact CG-CB 4Å; P216-F219 HydrophobicContact CG-CD2 3.87Å; P216-F219 HydrophobicContact CG-CG 4.24Å; P216-F219 WeakPolarHBondContact O-CB 3.44Å; P216-F219 PolarHBondContact O-N 2.7Å; P216-F219 VanDerWaalsContact O-N 3.13Å
217	P	69.5	Low	77.2	Confident	96 Å²	96	66.2 Å²	66.2	62%	0.623	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	129.5	178	25.4	-33.4	0	0	0	110	I152	I152-P217 HydrophobicContact CG2-CB 4.23Å
218	G	71.1	Confident	75.7	Confident	33 Å²	33	63.3 Å²	63.3	34%	0.34	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-0.1	-179	0	0	0	0	0	115.8	S153 P216	S153-G218 PolarHBondContact O-N 3.11Å; P216-G218 PolarHBondContact O-N 3.05Å
219	F	78.9	Confident	73.7	Confident	93 Å²	93	67.5 Å²	67.5	41%	0.408	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-70.3	152.6	171.5	-149	-90.5	0	0	0	111.9	K155 F199 I215 P216	K155-F219 WeakPolarHBondContact CB-O 3.39Å; K155-F219 PolarHBondContact N-O 3.23Å; K155-F219 VanDerWaalsContact N-O 3.09Å; F199-F219 AromaticContact CD2-CD1 3.44Å; F199-F219 HydrophobicContact CD2-CD1 3.44Å; F199-F219 VanDerWaalsContact CD2-CD1 3.44Å; F199-F219 AromaticContact CD2-CE1 3.74Å; F199-F219 HydrophobicContact CD2-CE1 3.74Å; F199-F219 HydrophobicContact CD2-CG 4.28Å; F199-F219 HydrophobicContact CE2-CB 4Å; F199-F219 AromaticContact CE2-CD1 3.11Å; F199-F219 HydrophobicContact CE2-CD1 3.11Å; F199-F219 HydrophobicContact CE2-CD2 4.28Å; F199-F219 AromaticContact CE2-CE1 3.5Å; F199-F219 HydrophobicContact CE2-CE1 3.5Å; F199-F219 VanDerWaalsContact CE2-CE1 3.5Å; F199-F219 AromaticContact CE2-CG 3.54Å; F199-F219 HydrophobicContact CE2-CG 3.54Å; F199-F219 HydrophobicContact CE2-CZ 4.23Å; F199-F219 HydrophobicContact CZ-CD1 4.22Å; F199-F219 HydrophobicContact CZ-CE1 4.36Å; F199-F219 HydrophobicContact CZ-CG 4.45Å; I215-F219 HydrophobicContact CG2-CB 4.2Å; P216-F219 HydrophobicContact CG-CB 4Å; P216-F219 HydrophobicContact CG-CD2 3.87Å; P216-F219 HydrophobicContact CG-CG 4.24Å; P216-F219 WeakPolarHBondContact O-CB 3.44Å; P216-F219 PolarHBondContact O-N 2.7Å; P216-F219 VanDerWaalsContact O-N 3.13Å
220	V	82.6	Confident	71.6	Confident	50 Å²	50	72.4 Å²	72.4	30%	0.303	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117	-179.4	-175.3	0	0	0	0	109.9	K155 R157	K155-V220 HydrophobicContact CB-CG2 4.07Å; K155-V220 HydrophobicContact CD-CG2 4.41Å; K155-V220 CarbonylContact O-C 3.59Å; K155-V220 VanDerWaalsContact O-CA 3.29Å; K155-V220 WeakPolarHBondContact O-CA 3.37Å; R157-V220 HydrophobicContact CB-CG1 3.53Å
221	I	86.5	Confident	69.4	Low	2 Å²	2	79.7 Å²	79.7	1%	0.01	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.9	168.4	-59.5	-178.7	0	0	0	107.8	V154 K155 L156 R157 W197 F198 F199 L204 I215 V223	V154-I221 HydrophobicContact CG1-CD1 3.3Å; V154-I221 HydrophobicContact CG1-CG1 3.7Å; K155-I221 PolarHBondContact O-N 3.25Å; L156-I221 CarbonylContact C-O 3.52Å; L156-I221 WeakPolarHBondContact CA-O 3.4Å; L156-I221 HydrophobicContact CD2-CB 3.9Å; L156-I221 HydrophobicContact CD2-CD1 4.27Å; L156-I221 HydrophobicContact CD2-CG2 4.04Å; R157-I221 PolarHBondContact N-O 3.23Å; W197-I221 HydrophobicContact CB-CG2 3.93Å; W197-I221 HydrophobicContact CD2-CG2 4.27Å; W197-I221 HydrophobicContact CE3-CD1 4.07Å; W197-I221 HydrophobicContact CE3-CG2 4.09Å; W197-I221 HydrophobicContact CG-CG2 4.25Å; W197-I221 HydrophobicContact CZ3-CD1 4.26Å; F198-I221 WeakPolarHBondContact O-CA 3.44Å; F198-I221 WeakPolarHBondContact O-CG2 3.36Å; F199-I221 HydrophobicContact CD2-CG1 4.39Å; L204-I221 HydrophobicContact CD1-CD1 4.05Å; L204-I221 HydrophobicContact CD1-CG2 4.37Å; I215-I221 HydrophobicContact CD1-CD1 3.6Å; I215-I221 HydrophobicContact CD1-CG1 4.35Å; I215-I221 HydrophobicContact CG2-CD1 4.42Å; I215-I221 HydrophobicContact CG2-CG1 4.44Å; I221-V223 HydrophobicContact CG2-CG2 4.37Å
222	Q	85.4	Confident	67.3	Low	98 Å²	98	75.5 Å²	75.5	46%	0.458	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124.5	172.8	-177.7	173.7	-9.5	0	0	109.2	S159 W197 F198	S159-Q222 PolarHBondContact OG-NE2 3.39Å; W197-Q222 CarbonylContact C-O 3.55Å; W197-Q222 WeakPolarHBondContact CA-O 3.4Å; F198-Q222 HydrophobicContact CB-CB 4.28Å; F198-Q222 PolarHBondContact N-O 3.38Å; F198-Q222 PolarHBondContact O-N 3.45Å
223	V	85.6	Confident	65.2	Low	0 Å²	0	80.3 Å²	80.3	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.9	179.4	177.8	0	0	0	0	108.2	L156 R157 L158 S159 L182 Q195 W197 I221	L156-V223 HydrophobicContact CB-CG2 4.13Å; L156-V223 HydrophobicContact CD2-CG2 3.48Å; L156-V223 VanDerWaalsContact CD2-CG2 3.48Å; L156-V223 HydrophobicContact CG-CG2 4.42Å; R157-V223 PolarHBondContact O-N 3.15Å; L158-V223 HydrophobicContact CD2-CB 4.03Å; L158-V223 HydrophobicContact CD2-CG1 3.93Å; S159-V223 PolarHBondContact N-O 3.25Å; L182-V223 HydrophobicContact CD2-CG1 4.28Å; L182-V223 HydrophobicContact CD2-CG2 4.32Å; Q195-V223 HydrophobicContact CB-CG1 4.44Å; W197-V223 HydrophobicContact CD2-CG2 4.16Å; W197-V223 HydrophobicContact CG-CG2 4.05Å; I221-V223 HydrophobicContact CG2-CG2 4.37Å
224	D	82.1	Confident	63.5	Low	35 Å²	35	84.4 Å²	84.4	19%	0.187	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.4	171.8	-159.9	-4.7	0	0	0	109.1	Q195 R196 F198 F226	Q195-D224 CarbonylContact C-O 3.54Å; Q195-D224 WeakPolarHBondContact CA-O 3.36Å; R196-D224 HydrophobicContact CB-CB 4.39Å; R196-D224 PolarHBondContact N-O 3.18Å; R196-D224 PolarHBondContact O-N 3.3Å; F198-D224 HydrophobicContact CD2-CB 4.45Å; F198-D224 HydrophobicContact CE2-CB 3.88Å; D224-F226 HydrophobicContact CB-CE2 4.16Å; D224-F226 WeakPolarHBondContact OD2-CE2 3.39Å; D224-F226 WeakPolarHBondContact OD2-CZ 3.07Å
225	A	73.9	Confident	61.7	Low	10 Å²	10	86.8 Å²	86.8	8%	0.083	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	88.5	-172.4	0	0	0	0	0	107.5	L189 P190 Q195 S227	L189-A225 HydrophobicContact CD2-CB 4.11Å; P190-A225 HydrophobicContact CG-CB 3.66Å; Q195-A225 HydrophobicContact CG-CB 4.48Å; A225-S227 PolarHBondContact O-N 3Å
226	F	64.2	Low	60	Low	106 Å²	106	91.5 Å²	91.5	47%	0.465	52%	0.52	S	S	.	.			trans	-75.9	92.9	177.4	-65.2	-80.9	0	0	0	109	D224 K228	D224-F226 HydrophobicContact CB-CE2 4.16Å; D224-F226 WeakPolarHBondContact OD2-CE2 3.39Å; D224-F226 WeakPolarHBondContact OD2-CZ 3.07Å; F226-K228 PolarHBondContact O-N 3.42Å
227	S	56.8	Low	58.7	Low	82 Å²	82	94.7 Å²	94.7	57%	0.573	54%	0.544	S	S	*	.			trans	-75.6	115.9	161.6	-177.7	0	0	0	0	107.5	A225 S229	A225-S227 PolarHBondContact O-N 3Å; S227-S229 PolarHBondContact O-N 3.44Å
228	K	49.9	Very low	57.3	Low	171 Å²	171	96.3 Å²	96.3	74%	0.743	56%	0.557	S	S	*	*			trans	-69.9	81.6	158.4	-71.1	-176.8	-177.1	-178.3	0	107	F226 L230	F226-K228 PolarHBondContact O-N 3.42Å; K228-L230 PolarHBondContact O-N 2.88Å
229	S	41.4	Very low	56	Low	110 Å²	110	99.4 Å²	99.4	77%	0.769	58%	0.579	S	S	*	*			trans	-71.3	75.6	154.5	-167.4	0	0	0	0	106.9	S227 N231	S227-S229 PolarHBondContact O-N 3.44Å; S229-N231 PolarHBondContact O-N 3.47Å
230	L	39.6	Very low	54.1	Low	143 Å²	143	106.2 Å²	106.2	75%	0.749	60%	0.602	S	S	*	*			trans	-80.8	103.2	159.4	-126.1	107.7	0	0	0	104.7	K228	K228-L230 PolarHBondContact O-N 2.88Å
231	N	36.9	Very low	52.5	Low	159 Å²	159	110.6 Å²	110.6	85%	0.85	63%	0.629	S	S	*	*			trans	-170.4	107.3	145.5	-90.1	-16.3	0	0	0	108.9	S229	S229-N231 PolarHBondContact O-N 3.47Å
232	G	33.6	Very low	50.5	Low	68 Å²	68	115.8 Å²	115.8	70%	0.701	67%	0.665	S	S	*	*			trans	117.5	66.4	160.8	0	0	0	0	0	115.4
233	F	37.7	Very low	48.6	Very low	207 Å²	207	118.5 Å²	118.5	91%	0.908	68%	0.683	S	S	*	*	S	Bend	trans	-156.9	105.9	139.4	-103.8	-74.6	0	0	0	110.8
234	S	38.2	Very low	46.3	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	72%	0.723	S	S	*	*			trans	42.1	116	152.2	60.9	0	0	0	0	121.2
235	E	34.6	Very low	44.4	Very low	187 Å²	187	126.6 Å²	126.6	87%	0.874	75%	0.753	S	S	*	*			trans	-30.8	127.3	146.8	-75.6	158.3	88.4	0	0	114.3
236	S	39.9	Very low	42.5	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	79%	0.785	S	S	*	*				154.9	104.1	121.8	-74.5	0	0	0	0	109.7
237	S	44.3	Very low	41.4	Very low	126 Å²	126	139 Å²	139	88%	0.881	81%	0.807	S	S	*	*				166	97	129.6	-75.2	0	0	0	0	109.4
238	S	40.4	Very low	40.7	Very low	129 Å²	129	140 Å²	140	90%	0.902	81%	0.81	S	S	*	*			trans	-62.7	129.9	162.1	-115.2	0	0	0	0	109.8
239	A	44.6	Very low	40.6	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	82%	0.816	S	S	*	*			trans	-163.7	112.3	134.1	0	0	0	0	0	109.5
240	R	39.2	Very low	40.7	Very low	237 Å²	237	143.1 Å²	143.1	89%	0.894	82%	0.817	S	S	*	*			trans	-53.7	152.2	158.5	-69.4	171.4	171	161.8	-3.5	109.2
241	V	47.2	Very low	41.3	Very low	141 Å²	141	143.2 Å²	143.2	86%	0.855	82%	0.823	S	S	*	*				-175.8	120.7	117.9	154.9	0	0	0	0	107.9
242	S	46.4	Very low	41.5	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	82%	0.818	S	S	*	*			trans	-71.4	139.3	161.6	-50.1	0	0	0	0	109.2
243	N	43.6	Very low	41.9	Very low	155 Å²	155	145.8 Å²	145.8	83%	0.829	83%	0.828	S	S	*	*				173.6	154.5	113.1	-146.9	24.7	0	0	0	111.2
244	C	38.9	Very low	42.5	Very low	125 Å²	125	144.9 Å²	144.9	85%	0.845	82%	0.824	S	S	*	*			trans	-50	151.8	-177.7	-60.3	0	0	0	0	116.3
245	G	41.2	Very low	43	Very low	79 Å²	79	146 Å²	146	81%	0.814	83%	0.832	S	S	*	*			trans	-172.7	92	166.7	0	0	0	0	0	110.7
246	D	34.9	Very low	43.6	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	82%	0.818	S	S	*	*			trans	-59	137.8	167.7	-142.6	-65.9	0	0	0	110.4
247	Y	40.8	Very low	44.1	Very low	235 Å²	235	144.1 Å²	144.1	92%	0.922	83%	0.826	S	S	*	*			trans	-167.4	110.6	150.6	-112	-77.3	0	0	0	110.5
248	T	41.2	Very low	44.2	Very low	103 Å²	103	142.8 Å²	142.8	63%	0.632	82%	0.817	S	S	*	*			trans	-64.2	141.9	167	-37.3	0	0	0	0	111.3
249	K	48.3	Very low	44.5	Very low	203 Å²	203	144.3 Å²	144.3	88%	0.883	81%	0.814	S	S	*	*				-179.8	127.2	129.8	-101.5	170	-176.3	178.7	0	113.1
250	D	44.4	Very low	44.4	Very low	145 Å²	145	146.1 Å²	146.1	78%	0.775	82%	0.815	S	S	*	*			trans	-40.9	142.8	161	-63.9	-101.8	0	0	0	115.2
251	T	51.5	Low	44.9	Very low	144 Å²	144	139 Å²	139	88%	0.883	81%	0.807	S	S	*	*				-162.3	126.5	125.7	44.6	0	0	0	0	108.9
252	G	40.1	Very low	44.9	Very low	73 Å²	73	138 Å²	138	75%	0.753	81%	0.805	S	S	*	*			trans	-78.8	166.4	-179.7	0	0	0	0	0	114.7
253	F	42.6	Very low	45	Very low	208 Å²	208	140.1 Å²	140.1	91%	0.912	81%	0.806	S	S	*	*			trans	-150.4	127.7	151.7	-142	-99.4	0	0	0	109.7
254	K	51.3	Low	45.7	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	80%	0.804	S	S	*	*			trans	-81.5	153.4	177.2	-80.6	176.4	167.8	-177	0	110.5
255	S	48.2	Very low	46	Very low	126 Å²	126	140.7 Å²	140.7	88%	0.881	80%	0.802	S	S	*	*				137.5	142.5	124.6	78	0	0	0	0	113.8
256	G	46.9	Very low	46.5	Very low	57 Å²	57	146.1 Å²	146.1	59%	0.588	80%	0.804	S	S	*	*			trans	122	87.7	173.4	0	0	0	0	0	109.7
257	E	49.3	Very low	47.3	Very low	200 Å²	200	147.9 Å²	147.9	94%	0.935	81%	0.812	S	S	*	*				60	136.7	93.1	-66.7	177.8	106.3	0	0	111.3
258	S	46.6	Very low	47.5	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	81%	0.809	S	S	*	*			cis	172.2	126.3	5	156.3	0	0	0	0	102.4
259	L	46.6	Very low	47.8	Very low	162 Å²	162	141.3 Å²	141.3	85%	0.848	82%	0.817	S	S	*	*			trans	171.2	109.6	136.3	-96.8	156.7	0	0	0	111
260	V	43.9	Very low	47.8	Very low	135 Å²	135	135.2 Å²	135.2	82%	0.818	81%	0.811	S	S	*	*			trans	-101.6	128.5	166.6	-156.9	0	0	0	0	105.2
261	A	50	Low	48.2	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	82%	0.819	S	S	*	*			trans	-155.3	97.1	161	0	0	0	0	0	106.6
262	C	47.2	Very low	48.3	Very low	120 Å²	120	138.4 Å²	138.4	81%	0.811	81%	0.814	S	S	*	*				70.2	106.5	87.1	-74.9	0	0	0	0	113.7
263	L	47.8	Very low	48.6	Very low	155 Å²	155	143.8 Å²	143.8	81%	0.812	82%	0.82	S	S	*	*			trans	-45.6	164.8	158.4	-87.7	145.6	0	0	0	113
264	P	57.6	Low	49.6	Very low	121 Å²	121	142.9 Å²	142.9	79%	0.786	82%	0.815	S	S	*	*				-138.1	143.3	105.7	34.1	-20.8	0	0	0	115.2
265	E	45.7	Very low	49.4	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.804	82%	0.818	S	S	*	*			trans	-70.3	146.5	153.3	-65	-169.9	105	0	0	110.7
266	K	51.8	Low	49.2	Very low	193 Å²	193	140.7 Å²	140.7	84%	0.839	81%	0.808	S	S	*	*			trans	145.4	122.4	139.7	-84.1	-163.5	178	-170.4	0	110.5
267	L	51.1	Low	49.5	Very low	177 Å²	177	147 Å²	147	93%	0.927	82%	0.823	S	S	*	*				-168	105.1	111.5	-95.5	161.8	0	0	0	108.9
268	S	45.7	Very low	49.4	Very low	124 Å²	124	146 Å²	146	87%	0.867	82%	0.818	S	S	*	*			trans	-92.7	136.9	164.1	170.7	0	0	0	0	107.8
269	G	47.8	Very low	50.2	Low	77 Å²	77	148.7 Å²	148.7	79%	0.794	82%	0.824	S	S	*	*			trans	176.8	126.7	169.1	0	0	0	0	0	106.6
270	G	48.4	Very low	50.7	Low	74 Å²	74	146 Å²	146	76%	0.763	82%	0.816	S	S	*	*			cis	144.3	111	14.1	0	0	0	0	0	105.8
271	M	52.7	Low	51.5	Low	189 Å²	189	146 Å²	146	93%	0.931	82%	0.816	S	S	*	*			trans	26.9	124.1	154.8	-72.9	167.1	162.9	0	0	119.8
272	E	53.1	Low	52	Low	167 Å²	167	147 Å²	147	78%	0.78	82%	0.815	S	S	*	*				-163	108.6	115.1	-112.1	179.3	93.4	0	0	110.9
273	E	47.4	Very low	52.6	Low	187 Å²	187	147.8 Å²	147.8	87%	0.874	82%	0.817	S	S	*	*			trans	-67.2	127.5	155.8	-88	172.8	79.9	0	0	108.7
274	K	61.8	Low	53.2	Low	188 Å²	188	143.6 Å²	143.6	82%	0.817	81%	0.811	S	S	*	*			trans	-125.7	112.2	154	-89.3	-172.6	178.7	167.7	0	110.6
275	K	48.1	Very low	53	Low	203 Å²	203	148.4 Å²	148.4	88%	0.883	84%	0.838	S	S	*	*			trans	-93.3	140.7	172.7	-176.5	-176.1	-173.6	-179.5	0	107.4
276	G	44.8	Very low	53.4	Low	66 Å²	66	147.3 Å²	147.3	68%	0.68	84%	0.84	S	S	*	*			trans	122	142.4	153	0	0	0	0	0	116.8
277	E	52.3	Low	53.4	Low	191 Å²	191	144.8 Å²	144.8	89%	0.893	84%	0.84	S	S	*	*			trans	82.2	90.9	165.7	-65.2	170.2	82.5	0	0	114.6
278	E	46.7	Very low	53.6	Low	178 Å²	178	143.1 Å²	143.1	83%	0.832	84%	0.835	S	S	*	*				54.1	115.7	65.5	-156.7	-171.1	123.1	0	0	112.3
279	L	64.4	Low	54	Low	155 Å²	155	144.2 Å²	144.2	81%	0.812	83%	0.833	S	S	*	*			trans	173.2	159.6	141.8	-92.9	171.9	0	0	0	110.4
280	P	57.3	Low	54.4	Low	106 Å²	106	148.4 Å²	148.4	69%	0.688	84%	0.836	S	S	*	*				-120.7	168.1	-115.7	40.2	-27.6	0	0	0	114.4
281	T	59.6	Low	54.8	Low	133 Å²	133	153.3 Å²	153.3	82%	0.816	84%	0.841	S	S	*	*			trans	-59.2	147.6	158.8	50.3	0	0	0	0	110.5
282	P	60.7	Low	55	Low	110 Å²	110	150.8 Å²	150.8	71%	0.714	83%	0.834	S	S	*	*				-155.4	167.7	111.7	40.9	-22.9	0	0	0	117.1
283	V	59.8	Low	55.1	Low	138 Å²	138	149.5 Å²	149.5	84%	0.836	84%	0.838	S	S	*	*			trans	78.5	103.9	153.7	-160.9	0	0	0	0	120.7
284	G	60.3	Low	55.8	Low	67 Å²	67	146.4 Å²	146.4	69%	0.691	84%	0.835	S	S	*	*				76.1	110.2	108	0	0	0	0	0	120.4
285	T	53.7	Low	55.2	Low	222 Å²	222	142.6 Å²	142.6	100%	1.362	84%	0.837	S	S	*	*				-152.1	0	129.3	-62.6	0	0	0	0	107.4

Retrieved 285 of 285 residues in 162.9 ms (Link to these results)

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