A0A087WZQ3_HUMAN Loading...

Zn regulated GTPase metalloprotein activator 1A

AlphaFold DB , UniProt , Accession A0A087WZQ3, Species HUMAN (Homo sapiens, Human), Gene ZNG1A, Length 180 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	38.2	Very low	39.2	Very low	238 Å²	238	141.4 Å²	141.4	100%	1.172	83%	0.83	S	S	*	*				0	153.5	0	-84.3	63.3	166.8	0	0	109.4
2	L	39.4	Very low	39.4	Very low	163 Å²	163	144.3 Å²	144.3	85%	0.853	83%	0.83	S	S	*	*			trans	-118.9	170.5	153.8	-75.8	169.6	0	0	0	106.6
3	P	49	Very low	39.7	Very low	123 Å²	123	146.7 Å²	146.7	80%	0.799	84%	0.838	S	S	*	*			cis	-105.5	-130.5	-6.2	22.9	1.2	0	0	0	108.9
4	A	32.6	Very low	39.7	Very low	77 Å²	77	144.4 Å²	144.4	64%	0.636	83%	0.831	S	S	*	*			cis	-166.9	162	2.3	0	0	0	0	0	113.6
5	V	35.1	Very low	40.2	Very low	155 Å²	155	140.3 Å²	140.3	94%	0.939	82%	0.821	S	S	*	*			trans	70.8	136.2	154	174.2	0	0	0	0	118.6
6	G	35.1	Very low	40.9	Very low	60 Å²	60	143.9 Å²	143.9	62%	0.619	83%	0.828	S	S	*	*			trans	123.5	55.5	-177.7	0	0	0	0	0	111.8
7	S	36.8	Very low	41.2	Very low	119 Å²	119	145.9 Å²	145.9	83%	0.832	83%	0.828	S	S	*	*				53.8	126.4	90.7	72.4	0	0	0	0	113.5
8	A	39.9	Very low	41.7	Very low	78 Å²	78	146.2 Å²	146.2	65%	0.645	83%	0.827	S	S	*	*			cis	-154.7	148.2	-3.4	0	0	0	0	0	108.3
9	D	35.6	Very low	41.9	Very low	149 Å²	149	144.4 Å²	144.4	80%	0.797	82%	0.823	S	S	*	*			trans	39.6	135	133.1	-49.7	-46.7	0	0	0	120.4	E11	D9-E11 PolarHBondContact O-N 2.76Å; D9-E11 VanDerWaalsContact O-N 3.15Å
10	E	45.7	Very low	42.9	Very low	197 Å²	197	143 Å²	143	92%	0.921	82%	0.82	S	S	*	*			trans	-74	100.6	176.8	-63.1	172.7	142.8	0	0	109.3	E12	E10-E12 PolarHBondContact O-N 2.77Å; E10-E12 VanDerWaalsContact O-N 3.11Å
11	E	43.3	Very low	43.8	Very low	196 Å²	196	145 Å²	145	92%	0.916	82%	0.822	S	S	*	*			trans	-69.8	104.7	176	-70.3	-171.3	145.3	0	0	110.3	D9	D9-E11 PolarHBondContact O-N 2.76Å; D9-E11 VanDerWaalsContact O-N 3.15Å
12	E	41.6	Very low	44.6	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	81%	0.806	S	S	*	*			trans	-63.8	137.3	170.5	-58.8	179.1	126.5	0	0	110.7	E10 P14	E10-E12 PolarHBondContact O-N 2.77Å; E10-E12 VanDerWaalsContact O-N 3.11Å; E12-P14 WeakPolarHBondContact O-CD 3.35Å
13	D	43.8	Very low	45.6	Very low	175 Å²	175	139.8 Å²	139.8	94%	0.936	80%	0.803	S	S	*	*			trans	-59.4	124.4	174.2	-87.7	-56.6	0	0	0	112.4
14	P	40.1	Very low	45.8	Very low	115 Å²	115	139 Å²	139	75%	0.747	80%	0.798	S	S	*	*			trans	-125.8	116.1	169.9	27.3	-5.2	0	0	0	111.8	E12	E12-P14 WeakPolarHBondContact O-CD 3.35Å
15	A	46.2	Very low	46.9	Very low	82 Å²	82	142.8 Å²	142.8	68%	0.678	81%	0.806	S	S	*	*			trans	66.1	83.2	174.3	0	0	0	0	0	116.4	E17	A15-E17 HydrophobicContact CB-CG 4.32Å; A15-E17 PolarHBondContact O-N 3.11Å
16	E	51.6	Low	47.3	Very low	198 Å²	198	143.1 Å²	143.1	93%	0.925	80%	0.797	S	S	*	*				-57	112.2	118.6	-68.6	-165.4	142.6	0	0	106.5	D18	E16-D18 PolarHBondContact O-N 2.95Å
17	E	47	Very low	47.5	Very low	178 Å²	178	145.8 Å²	145.8	83%	0.832	80%	0.802	S	S	*	*			trans	-67.7	103.8	173.8	-76.6	-168.6	128.3	0	0	108.3	A15 C19	A15-E17 HydrophobicContact CB-CG 4.32Å; A15-E17 PolarHBondContact O-N 3.11Å; E17-C19 PolarHBondContact O-N 2.81Å
18	D	49.4	Very low	47.6	Very low	152 Å²	152	145 Å²	145	81%	0.813	79%	0.792	S	S	*	*			trans	-51.2	106.4	-177.3	-141.3	-12	0	0	0	110.2	E16 P20	E16-D18 PolarHBondContact O-N 2.95Å; D18-P20 VanDerWaalsContact O-CD 3.23Å; D18-P20 WeakPolarHBondContact O-CD 3.43Å; D18-P20 VanDerWaalsContact O-N 3.07Å
19	C	46	Very low	48.1	Very low	112 Å²	112	149.6 Å²	149.6	76%	0.757	80%	0.8	S	S	*	*			trans	-62	111.2	173.4	-78	0	0	0	0	107	E17 E21	E17-C19 PolarHBondContact O-N 2.81Å; C19-E21 PolarHBondContact O-N 2.82Å
20	P	61.2	Low	48.2	Very low	116 Å²	116	146.4 Å²	146.4	75%	0.753	79%	0.79	S	S	*	*			trans	-60.3	114.6	-169.6	23	-33.5	0	0	0	109.5	D18 L22	D18-P20 VanDerWaalsContact O-CD 3.23Å; D18-P20 WeakPolarHBondContact O-CD 3.43Å; D18-P20 VanDerWaalsContact O-N 3.07Å; P20-L22 PolarHBondContact O-N 2.77Å
21	E	62.1	Low	48	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.864	79%	0.786	S	S	*	*			trans	-56.8	127.7	-176.3	-170.9	172.1	-147.3	0	0	108.8	C19 V23	C19-E21 PolarHBondContact O-N 2.82Å; E21-V23 PolarHBondContact O-N 2.61Å
22	L	54.3	Low	47.8	Very low	162 Å²	162	145 Å²	145	85%	0.848	78%	0.783	S	S	*	*			trans	-66.4	97.8	-175.3	-69.1	178.7	0	0	0	108.9	P20 P24	P20-L22 PolarHBondContact O-N 2.77Å; L22-P24 WeakPolarHBondContact O-CD 3.41Å
23	V	61.9	Low	47.7	Very low	130 Å²	130	142.8 Å²	142.8	79%	0.788	77%	0.773	S	S	*	*			trans	-47.4	118	175.2	-175.6	0	0	0	0	107.8	E21 I25	E21-V23 PolarHBondContact O-N 2.61Å; V23-I25 PolarHBondContact O-N 2.9Å
24	P	51.8	Low	47.6	Very low	106 Å²	106	143.8 Å²	143.8	69%	0.688	77%	0.772	S	S	*	*			trans	-56	128.4	174.2	-23.3	33.3	0	0	0	107.8	L22 E26	L22-P24 WeakPolarHBondContact O-CD 3.41Å; P24-E26 PolarHBondContact O-N 2.7Å
25	I	56.9	Low	47.7	Very low	157 Å²	157	145.3 Å²	145.3	81%	0.805	77%	0.767	S	S	*	*			trans	-64.6	98.9	164.6	-62.8	169.8	0	0	0	104.8	V23 T27	V23-I25 PolarHBondContact O-N 2.9Å; I25-T27 PolarHBondContact O-N 2.96Å
26	E	42.2	Very low	47.7	Very low	162 Å²	162	146.9 Å²	146.9	76%	0.757	77%	0.773	S	S	*	*			trans	-56.6	107.8	167.2	-70.8	-166.2	154	0	0	106	P24 T28	P24-E26 PolarHBondContact O-N 2.7Å; E26-T28 PolarHBondContact O-N 2.82Å
27	T	39.5	Very low	47.2	Very low	116 Å²	116	139.5 Å²	139.5	71%	0.712	75%	0.75	S	S	*	*			trans	-70.7	72.7	165	50.4	0	0	0	0	107.3	I25 Q29	I25-T27 PolarHBondContact O-N 2.96Å; T27-Q29 VanDerWaalsContact C-N 3.31Å; T27-Q29 PolarHBondContact O-N 3.23Å
28	T	39.6	Very low	47.1	Very low	103 Å²	103	140.2 Å²	140.2	63%	0.632	76%	0.758	S	S	*	*			trans	-50.2	108	149.9	45.5	0	0	0	0	105.4	E26 S30	E26-T28 PolarHBondContact O-N 2.82Å; T28-S30 PolarHBondContact O-N 2.83Å
29	Q	49.6	Very low	47.4	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	75%	0.749	S	S	*	*			trans	-72.9	67.8	172.8	-70.4	171.6	-29.7	0	0	107.5	T27 E31	T27-Q29 VanDerWaalsContact C-N 3.31Å; T27-Q29 PolarHBondContact O-N 3.23Å; Q29-E31 VanDerWaalsContact C-N 3.35Å; Q29-E31 PolarHBondContact O-N 3.18Å; Q29-E31 VanDerWaalsContact O-N 3.11Å
30	S	37.9	Very low	48.8	Very low	83 Å²	83	133.5 Å²	133.5	58%	0.58	74%	0.738	S	S	*	*			trans	-64.4	103.4	156.5	48.2	0	0	0	0	105.8	T28 E32	T28-S30 PolarHBondContact O-N 2.83Å; S30-E32 PolarHBondContact O-N 3.11Å
31	E	41.3	Very low	50.1	Low	181 Å²	181	132.7 Å²	132.7	85%	0.846	72%	0.723	S	S	*	*			trans	-70.1	62.4	179.8	-61.9	171.1	131.8	0	0	110.1	Q29 E33	Q29-E31 VanDerWaalsContact C-N 3.35Å; Q29-E31 PolarHBondContact O-N 3.18Å; Q29-E31 VanDerWaalsContact O-N 3.11Å; E31-E33 PolarHBondContact O-N 3.15Å
32	E	39.8	Very low	51.5	Low	183 Å²	183	124.6 Å²	124.6	86%	0.855	69%	0.685	S	S	*	*			trans	-74.8	68.7	169.1	-65.9	-156.4	158.4	0	0	109.5	S30	S30-E32 PolarHBondContact O-N 3.11Å
33	E	40.1	Very low	53.4	Low	129 Å²	129	117.7 Å²	117.7	60%	0.603	65%	0.65	S	S	*	*			trans	24.7	132	160.4	-61	-177.6	138.2	0	0	118.8	E31 K35	E31-E33 PolarHBondContact O-N 3.15Å; E33-K35 HydrophobicContact CB-CB 4.36Å; E33-K35 PolarHBondContact O-N 3.31Å; E33-K35 IonicContact OE1-NZ 3.49Å; E33-K35 WeakPolarHBondContact OE2-CD 3.11Å; E33-K35 WeakPolarHBondContact OE2-CE 3.23Å; E33-K35 IonicContact OE2-NZ 3.8Å; E33-K35 PolarHBondContact OE2-NZ 2.98Å
34	E	41.3	Very low	54.9	Low	197 Å²	197	111.5 Å²	111.5	92%	0.921	61%	0.612	S	S	*	*			trans	-58.3	80.5	151.8	-68.3	-172.2	114.7	0	0	110.7
35	K	41.8	Very low	56.9	Low	146 Å²	146	106.6 Å²	106.6	64%	0.635	58%	0.58	S	S	*	*			trans	-104.2	46.4	176.6	-131	168.2	-161	141.5	0	112	E33 G37	E33-K35 HydrophobicContact CB-CB 4.36Å; E33-K35 PolarHBondContact O-N 3.31Å; E33-K35 IonicContact OE1-NZ 3.49Å; E33-K35 WeakPolarHBondContact OE2-CD 3.11Å; E33-K35 WeakPolarHBondContact OE2-CE 3.23Å; E33-K35 IonicContact OE2-NZ 3.8Å; E33-K35 PolarHBondContact OE2-NZ 2.98Å; K35-G37 PolarHBondContact O-N 3.01Å
36	S	46.2	Very low	58.6	Low	115 Å²	115	99.1 Å²	99.1	80%	0.804	54%	0.542	S	S	*	.			trans	-66.9	35.2	161.4	52.1	0	0	0	0	112.7
37	G	40.4	Very low	61	Low	43 Å²	43	91.5 Å²	91.5	44%	0.443	51%	0.507	S	S	.	.	S	Bend	trans	-82.4	156.3	172.1	0	0	0	0	0	111.7	K35 G39 A40	K35-G37 PolarHBondContact O-N 3.01Å; G37-G39 PolarHBondContact O-N 3.47Å; G37-A40 PolarHBondContact O-N 3.47Å
38	L	46.7	Very low	63.5	Low	193 Å²	193	86.3 Å²	86.3	100%	1.01	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	94.3	171.6	-81.7	58.5	0	0	0	109.2
39	G	54.6	Low	65.8	Low	60 Å²	60	81.4 Å²	81.4	62%	0.619	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	158.1	-12.9	-175.5	0	0	0	0	0	115.7	G37 K41	G37-G39 PolarHBondContact O-N 3.47Å; G39-K41 PolarHBondContact O-N 2.86Å
40	A	76.3	Confident	67.6	Low	64 Å²	64	78.1 Å²	78.1	53%	0.529	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-65.9	129.7	168.6	0	0	0	0	0	110.8	G37	G37-A40 PolarHBondContact O-N 3.47Å
41	K	87.6	Confident	69.7	Low	99 Å²	99	81.4 Å²	81.4	43%	0.43	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-76.6	148.3	175.1	-61.6	-167.3	-172.8	-172.2	0	110.8	G39 G157 S158 D159 Y161	G39-K41 PolarHBondContact O-N 2.86Å; K41-G157 PolarHBondContact NZ-O 3.29Å; K41-S158 VanDerWaalsContact CE-O 3.24Å; K41-S158 WeakPolarHBondContact CE-O 3.49Å; K41-D159 CarbonylContact C-O 3.59Å; K41-D159 VanDerWaalsContact CA-O 3.3Å; K41-D159 WeakPolarHBondContact CA-O 3.3Å; K41-Y161 HydrophobicContact CB-CD1 3.76Å; K41-Y161 HydrophobicContact CB-CE1 4.33Å
42	I	92.3	Very high	71.7	Confident	14 Å²	14	76 Å²	76	7%	0.072	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.6	178.8	-50	-174.9	0	0	0	110.1	M124 K127 F130 I133 D159 I160 Y161	I42-M124 HydrophobicContact CD1-CE 4.27Å; I42-M124 HydrophobicContact CD1-SD 4.24Å; I42-K127 HydrophobicContact CD1-CG 4.12Å; I42-F130 HydrophobicContact CD1-CD2 4.04Å; I42-F130 HydrophobicContact CD1-CE2 3.36Å; I42-F130 HydrophobicContact CD1-CZ 3.79Å; I42-F130 HydrophobicContact CG2-CD2 4.23Å; I42-F130 HydrophobicContact CG2-CE2 4.04Å; I42-I133 HydrophobicContact CG2-CD1 4.39Å; I42-I133 HydrophobicContact CG2-CG1 3.92Å; I42-D159 PolarHBondContact N-O 3.06Å; I42-I160 HydrophobicContact CB-CG2 4.27Å; I42-I160 VanDerWaalsContact O-CA 3.24Å; I42-I160 WeakPolarHBondContact O-CA 3.46Å; I42-I160 WeakPolarHBondContact O-CB 3.27Å; I42-Y161 PolarHBondContact O-N 3.5Å; I42-Y161 VanDerWaalsContact O-N 3.07Å
43	P	94.1	Very high	74.1	Confident	17 Å²	17	67.9 Å²	67.9	11%	0.11	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	140.7	172.4	23.9	-33.6	0	0	0	112	Y132 I133 Y161 D163	P43-Y132 HydrophobicContact CB-CD2 3.95Å; P43-Y132 HydrophobicContact CB-CE2 3.68Å; P43-Y132 HydrophobicContact CG-CD2 3.25Å; P43-Y132 HydrophobicContact CG-CE2 3.49Å; P43-Y132 VanDerWaalsContact CG-CE2 3.49Å; P43-Y132 HydrophobicContact CG-CG 4Å; P43-I133 PolarHBondContact O-N 2.83Å; P43-Y161 HydrophobicContact CB-CE1 3.89Å; P43-Y161 HydrophobicContact CB-CE2 4.33Å; P43-D163 HydrophobicContact CB-CB 3.67Å
44	V	92.8	Very high	76.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.3	171.2	-168.2	0	0	0	0	109.4	I120 I133 F150 I160 Y161 D163	V44-I120 HydrophobicContact CG1-CD1 4.3Å; V44-I133 WeakPolarHBondContact CA-O 3.39Å; V44-I133 HydrophobicContact CB-CB 4.29Å; V44-I133 HydrophobicContact CG1-CB 4.02Å; V44-I133 HydrophobicContact CG1-CG2 3.94Å; V44-I133 HydrophobicContact CG2-CB 3.98Å; V44-I133 HydrophobicContact CG2-CD1 3.97Å; V44-I133 HydrophobicContact CG2-CG1 4.34Å; V44-F150 HydrophobicContact CB-CE1 3.98Å; V44-F150 HydrophobicContact CB-CZ 4.31Å; V44-F150 HydrophobicContact CG1-CE1 3.88Å; V44-F150 HydrophobicContact CG1-CZ 3.77Å; V44-F150 HydrophobicContact CG2-CE1 3.92Å; V44-I160 HydrophobicContact CG2-CB 4.05Å; V44-I160 HydrophobicContact CG2-CD1 4.11Å; V44-I160 HydrophobicContact CG2-CG1 4.39Å; V44-Y161 PolarHBondContact N-O 3.15Å; V44-D163 PolarHBondContact O-N 3.21Å
45	T	94.3	Very high	78.8	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.018	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	133.3	170.5	-81.7	0	0	0	0	110.9	I47 Y132 I133 L134 L135 D163 G164 I166	T45-I47 HydrophobicContact CG2-CG1 4.43Å; T45-Y132 WeakPolarHBondContact CB-OH 3.26Å; T45-Y132 PolarHBondContact OG1-OH 2.91Å; T45-I133 PolarHBondContact N-O 2.68Å; T45-L134 HydrophobicContact CG2-CD1 3.88Å; T45-L135 PolarHBondContact O-N 3.15Å; T45-D163 PolarHBondContact OG1-OD2 2.84Å; T45-G164 WeakPolarHBondContact CA-O 3.27Å; T45-I166 HydrophobicContact CG2-CB 4.44Å; T45-I166 HydrophobicContact CG2-CD1 3.73Å; T45-I166 HydrophobicContact CG2-CG1 3.82Å
46	I	92.5	Very high	80.9	Confident	0 Å²	0	50 Å²	50	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.6	170.7	-63.9	170.1	0	0	0	108.2	L135 T137 P143 V146 A147 F150 L162 G164 I165 I166	I46-L135 CarbonylContact C-O 3.59Å; I46-L135 WeakPolarHBondContact CA-O 3.24Å; I46-L135 HydrophobicContact CG1-CD2 4.49Å; I46-T137 HydrophobicContact CG2-CG2 3.71Å; I46-P143 HydrophobicContact CG2-CB 4.25Å; I46-V146 HydrophobicContact CD1-CB 4.11Å; I46-V146 HydrophobicContact CD1-CG1 3.75Å; I46-V146 HydrophobicContact CG1-CG1 4.35Å; I46-A147 HydrophobicContact CD1-CB 4.13Å; I46-F150 HydrophobicContact CD1-CE2 4.32Å; I46-L162 HydrophobicContact CD1-CD1 3.79Å; I46-L162 HydrophobicContact CG1-CD1 3.99Å; I46-G164 PolarHBondContact N-O 3.3Å; I46-I165 HydrophobicContact CB-CG1 4.35Å; I46-I165 HydrophobicContact CB-CG2 4.35Å; I46-I165 HydrophobicContact CD1-CG1 4.37Å; I46-I165 HydrophobicContact CG2-CG2 4.28Å; I46-I165 CarbonylContact O-C 3.51Å; I46-I165 WeakPolarHBondContact O-CA 3.24Å; I46-I166 PolarHBondContact O-N 2.84Å
47	I	93.1	Very high	82.9	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.3	165	-65.8	-174.6	0	0	0	108.7	T45 K55 L58 L59 L134 L135 T137 I166 I168	T45-I47 HydrophobicContact CG2-CG1 4.43Å; I47-K55 HydrophobicContact CG2-CD 4.02Å; I47-K55 HydrophobicContact CG2-CG 4.22Å; I47-L58 HydrophobicContact CD1-CD2 3.99Å; I47-L59 HydrophobicContact CD1-CD2 4.04Å; I47-L134 HydrophobicContact CD1-CD1 3.74Å; I47-L134 HydrophobicContact CD1-CD2 3.75Å; I47-L134 HydrophobicContact CD1-CG 3.86Å; I47-L134 HydrophobicContact CG1-CD1 3.82Å; I47-L134 HydrophobicContact CG1-CG 4.2Å; I47-L135 PolarHBondContact N-O 3.41Å; I47-T137 PolarHBondContact O-N 2.77Å; I47-T137 PolarHBondContact O-OG1 3.47Å; I47-I166 WeakPolarHBondContact CA-O 3.34Å; I47-I166 HydrophobicContact CG1-CB 4.43Å; I47-I168 HydrophobicContact CG2-CD1 3.99Å; I47-I168 HydrophobicContact CG2-CG1 4.19Å
48	T	90.4	Very high	85.4	Confident	8 Å²	8	51 Å²	51	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-178.6	175	-162.7	0	0	0	0	110.9	T137 P143 I165 I166 T167 I168	T48-T137 WeakPolarHBondContact CB-OG1 3.45Å; T48-T137 PolarHBondContact OG1-OG1 3.11Å; T48-P143 HydrophobicContact CG2-CB 4.34Å; T48-P143 HydrophobicContact CG2-CG 4.27Å; T48-I165 HydrophobicContact CG2-CG2 4.2Å; T48-I166 PolarHBondContact N-O 3.19Å; T48-T167 HydrophobicContact CG2-CG2 4.11Å; T48-T167 VanDerWaalsContact CG2-OG1 3.24Å; T48-T167 WeakPolarHBondContact CG2-OG1 3.49Å; T48-I168 PolarHBondContact O-N 3.26Å
49	G	88.7	Confident	87.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	27%	0.265	C	S	.	.			trans	129.3	154	-175.4	0	0	0	0	0	112.5	K55 G139 I168	G49-K55 PolarHBondContact O-NZ 3.16Å; G49-G139 WeakPolarHBondContact O-CA 3.24Å; G49-I168 WeakPolarHBondContact CA-O 3.29Å
50	Y	86.4	Confident	89.2	Confident	104 Å²	104	41.7 Å²	41.7	41%	0.408	25%	0.25	S	C	.	.			trans	-64	167.3	-169	-159.7	-108.3	0	0	0	113.8	G52 A53 L140 V177	Y50-G52 PolarHBondContact O-N 3.47Å; Y50-A53 VanDerWaalsContact O-CB 3.26Å; Y50-A53 WeakPolarHBondContact O-CB 3.45Å; Y50-A53 PolarHBondContact O-N 3.1Å; Y50-L140 HydrophobicContact CE2-CD2 4.04Å; Y50-V177 HydrophobicContact CD1-CG2 3.81Å; Y50-V177 HydrophobicContact CD2-CG1 3.54Å; Y50-V177 HydrophobicContact CD2-CG2 4.22Å; Y50-V177 HydrophobicContact CE1-CG2 4.35Å; Y50-V177 HydrophobicContact CE2-CG1 4Å; Y50-V177 HydrophobicContact CG-CG1 3.87Å; Y50-V177 HydrophobicContact CG-CG2 3.73Å
51	L	83.4	Confident	90	Very high	152 Å²	152	45.1 Å²	45.1	80%	0.796	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	134.3	173.4	-176	62.5	0	0	0	110.2	A53	L51-A53 VanDerWaalsContact C-N 3.32Å; L51-A53 PolarHBondContact O-N 2.7Å
52	G	83.7	Confident	90.3	Very high	66 Å²	66	41.8 Å²	41.8	68%	0.68	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.1	-9.5	-176.4	0	0	0	0	0	115.5	Y50 G54	Y50-G52 PolarHBondContact O-N 3.47Å; G52-G54 PolarHBondContact O-N 2.69Å
53	A	88.8	Confident	90.2	Very high	13 Å²	13	41.4 Å²	41.4	11%	0.107	24%	0.235	C	C	.	.	S	Bend	trans	-69.8	9.4	-176.2	0	0	0	0	0	115.9	Y50 L51 I168	Y50-A53 VanDerWaalsContact O-CB 3.26Å; Y50-A53 WeakPolarHBondContact O-CB 3.45Å; Y50-A53 PolarHBondContact O-N 3.1Å; L51-A53 VanDerWaalsContact C-N 3.32Å; L51-A53 PolarHBondContact O-N 2.7Å; A53-I168 WeakPolarHBondContact CB-O 3.37Å; A53-I168 WeakPolarHBondContact O-CG2 3.3Å
54	G	89.4	Confident	89.9	Confident	31 Å²	31	44 Å²	44	32%	0.32	25%	0.251	S	S	.	.	S	Bend	trans	88.8	2.3	175.7	0	0	0	0	0	116.8	G52 T56 T57 L58	G52-G54 PolarHBondContact O-N 2.69Å; G54-T56 VanDerWaalsContact C-N 3.31Å; G54-T56 PolarHBondContact O-N 3.33Å; G54-T57 WeakPolarHBondContact O-CB 3.35Å; G54-T57 PolarHBondContact O-N 2.93Å; G54-L58 PolarHBondContact O-N 3.38Å
55	K	90.5	Very high	89.9	Confident	15 Å²	15	48.3 Å²	48.3	7%	0.065	27%	0.271	C	S	.	.	H	α-helix	trans	-46	-52.2	177.1	-58.7	-161.9	-53.7	-76.1	0	112.9	I47 G49 T57 L58 L59 E136 T137 I168	I47-K55 HydrophobicContact CG2-CD 4.02Å; I47-K55 HydrophobicContact CG2-CG 4.22Å; G49-K55 PolarHBondContact O-NZ 3.16Å; K55-T57 PolarHBondContact O-N 2.61Å; K55-L58 PolarHBondContact O-N 3.32Å; K55-L58 VanDerWaalsContact O-N 3.15Å; K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 3.07Å; K55-E136 HydrophobicContact CD-CG 4.5Å; K55-E136 WeakPolarHBondContact CE-OE1 3.32Å; K55-E136 IonicContact NZ-OE1 2.83Å; K55-T137 WeakPolarHBondContact CE-O 3.18Å; K55-I168 HydrophobicContact CB-CD1 4.38Å; K55-I168 HydrophobicContact CG-CD1 4.05Å; K55-I168 HydrophobicContact CG-CG1 4.4Å
56	T	86	Confident	89.9	Confident	52 Å²	52	56.7 Å²	56.7	32%	0.319	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-31.6	-179.4	-40.1	0	0	0	0	113	G54 N60 A83 L84	G54-T56 VanDerWaalsContact C-N 3.31Å; G54-T56 PolarHBondContact O-N 3.33Å; T56-N60 VanDerWaalsContact O-CB 3.3Å; T56-N60 WeakPolarHBondContact O-CB 3.38Å; T56-N60 PolarHBondContact O-N 2.92Å; T56-A83 HydrophobicContact CG2-CB 4.43Å; T56-L84 HydrophobicContact CG2-CB 3.7Å
57	T	89.3	Confident	89.9	Confident	108 Å²	108	59.1 Å²	59.1	66%	0.663	32%	0.321	S	S	*	.	H	α-helix	trans	-70.9	-43.9	176.6	-48.4	0	0	0	0	111.6	G54 K55 N60 Y61	G54-T57 WeakPolarHBondContact O-CB 3.35Å; G54-T57 PolarHBondContact O-N 2.93Å; K55-T57 PolarHBondContact O-N 2.61Å; T57-N60 PolarHBondContact O-N 2.69Å; T57-Y61 PolarHBondContact O-N 2.97Å
58	L	92.1	Very high	89.8	Confident	69 Å²	69	65.2 Å²	65.2	36%	0.361	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-43.8	175.3	178	59.9	0	0	0	111.4	I47 G54 K55 Y61 I62 I168	I47-L58 HydrophobicContact CD1-CD2 3.99Å; G54-L58 PolarHBondContact O-N 3.38Å; K55-L58 PolarHBondContact O-N 3.32Å; K55-L58 VanDerWaalsContact O-N 3.15Å; L58-Y61 WeakPolarHBondContact O-CB 3.31Å; L58-Y61 PolarHBondContact O-N 2.77Å; L58-I62 HydrophobicContact CD1-CD1 4.15Å; L58-I62 HydrophobicContact CG-CD1 4.11Å; L58-I62 WeakPolarHBondContact O-CG1 3.47Å; L58-I62 PolarHBondContact O-N 3.45Å; L58-I62 VanDerWaalsContact O-N 3.08Å; L58-I168 HydrophobicContact CB-CD1 4.33Å; L58-I168 HydrophobicContact CD2-CD1 3.7Å
59	L	91.9	Very high	89.8	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-63.6	-41	176.6	-65.8	173.1	0	0	0	111.6	I47 K55 I62 L63 V73 L75 L84 L134 E136	I47-L59 HydrophobicContact CD1-CD2 4.04Å; K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 3.07Å; L59-I62 PolarHBondContact O-N 2.83Å; L59-L63 WeakPolarHBondContact O-CG 3.35Å; L59-L63 PolarHBondContact O-N 1.85Å; L59-V73 HydrophobicContact CD2-CG1 3.9Å; L59-L75 HydrophobicContact CD1-CD2 3.84Å; L59-L84 HydrophobicContact CB-CD2 3.66Å; L59-L134 HydrophobicContact CD2-CD2 3.68Å; L59-L134 HydrophobicContact CD2-CG 4.36Å; L59-E136 HydrophobicContact CD1-CB 4.13Å; L59-E136 HydrophobicContact CD1-CG 3.95Å
60	N	89.4	Confident	90.1	Very high	56 Å²	56	75 Å²	75	30%	0.299	40%	0.403	S	S	.	.	H	α-helix	trans	-59.7	-47.6	173.4	-171.5	103.4	0	0	0	111.4	T56 T57 I62 L63 T64 L84	T56-N60 VanDerWaalsContact O-CB 3.3Å; T56-N60 WeakPolarHBondContact O-CB 3.38Å; T56-N60 PolarHBondContact O-N 2.92Å; T57-N60 PolarHBondContact O-N 2.69Å; N60-I62 VanDerWaalsContact C-N 3.28Å; N60-I62 PolarHBondContact O-N 3.06Å; N60-L63 CarbonylContact O-C 3.59Å; N60-L63 PolarHBondContact O-N 3.17Å; N60-T64 WeakPolarHBondContact ND2-CG2 3.49Å; N60-T64 PolarHBondContact ND2-OG1 2.89Å; N60-T64 PolarHBondContact O-N 2.63Å; N60-T64 PolarHBondContact O-OG1 3.19Å; N60-T64 VanDerWaalsContact O-OG1 3.12Å; N60-L84 HydrophobicContact CB-CD1 4.1Å
61	Y	92.5	Very high	90.6	Very high	137 Å²	137	70.5 Å²	70.5	54%	0.537	39%	0.386	S	S	.	.	H	α-helix	trans	-55.4	-43.3	177.5	176.6	-89.3	0	0	0	112	T57 L58 L63 T64 E65	T57-Y61 PolarHBondContact O-N 2.97Å; L58-Y61 WeakPolarHBondContact O-CB 3.31Å; L58-Y61 PolarHBondContact O-N 2.77Å; Y61-L63 VanDerWaalsContact C-N 3.32Å; Y61-L63 PolarHBondContact O-N 2.88Å; Y61-T64 PolarHBondContact O-N 2.85Å; Y61-E65 HydrophobicContact CD2-CB 4.27Å; Y61-E65 HydrophobicContact CD2-CG 3.49Å; Y61-E65 VanDerWaalsContact CD2-CG 3.49Å; Y61-E65 HydrophobicContact CE2-CB 4.09Å; Y61-E65 HydrophobicContact CE2-CG 3.6Å; Y61-E65 HydrophobicContact CG-CG 4.09Å; Y61-E65 WeakPolarHBondContact O-CB 3.47Å; Y61-E65 WeakPolarHBondContact O-CG 3.32Å; Y61-E65 PolarHBondContact O-N 3.45Å
62	I	93.9	Very high	91.1	Very high	28 Å²	28	63.3 Å²	63.3	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-66.8	-32.8	177.3	-66	168	0	0	0	111.8	L58 L59 N60 H67 V71 V73 N105 C107 L134	L58-I62 HydrophobicContact CD1-CD1 4.15Å; L58-I62 HydrophobicContact CG-CD1 4.11Å; L58-I62 WeakPolarHBondContact O-CG1 3.47Å; L58-I62 PolarHBondContact O-N 3.45Å; L58-I62 VanDerWaalsContact O-N 3.08Å; L59-I62 PolarHBondContact O-N 2.83Å; N60-I62 VanDerWaalsContact C-N 3.28Å; N60-I62 PolarHBondContact O-N 3.06Å; I62-H67 WeakPolarHBondContact CA-NE2 3.4Å; I62-H67 WeakPolarHBondContact CG2-NE2 3.43Å; I62-H67 PolarHBondContact O-NE2 3.04Å; I62-V71 HydrophobicContact CG2-CB 3.99Å; I62-V71 HydrophobicContact CG2-CG1 4.04Å; I62-V71 HydrophobicContact CG2-CG2 4.13Å; I62-V73 HydrophobicContact CG2-CG2 4.21Å; I62-N105 PolarHBondContact O-ND2 3.43Å; I62-C107 PolarHBondContact O-SG 2.83Å; I62-C107 VanDerWaalsContact O-SG 3.38Å; I62-L134 HydrophobicContact CD1-CD2 3.53Å; I62-L134 HydrophobicContact CG2-CD2 4.44Å
63	L	91.3	Very high	91.6	Very high	7 Å²	7	60.1 Å²	60.1	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-86.3	-19	179.2	-67.6	-171.3	0	0	0	114.7	L59 N60 Y61 V73 L84 L88 L103 C107 C109	L59-L63 WeakPolarHBondContact O-CG 3.35Å; L59-L63 PolarHBondContact O-N 1.85Å; N60-L63 CarbonylContact O-C 3.59Å; N60-L63 PolarHBondContact O-N 3.17Å; Y61-L63 VanDerWaalsContact C-N 3.32Å; Y61-L63 PolarHBondContact O-N 2.88Å; L63-V73 HydrophobicContact CD2-CB 3.96Å; L63-V73 HydrophobicContact CD2-CG2 3.51Å; L63-V73 HydrophobicContact CG-CG2 4.2Å; L63-L84 HydrophobicContact CD1-CD1 4.29Å; L63-L84 HydrophobicContact CD1-CD2 4.03Å; L63-L84 HydrophobicContact CD1-CG 4.38Å; L63-L88 HydrophobicContact CD1-CD1 4.19Å; L63-L103 HydrophobicContact CB-CD1 3.61Å; L63-L103 HydrophobicContact CD1-CD1 4.23Å; L63-L103 HydrophobicContact CD2-CD1 3.72Å; L63-L103 HydrophobicContact CG-CD1 4.04Å; L63-L103 WeakPolarHBondContact O-CD1 3.16Å; L63-C107 HydrophobicContact CD2-CB 3.96Å; L63-C109 HydrophobicContact CD1-CB 3.76Å; L63-C109 HydrophobicContact CD2-CB 4.01Å
64	T	87.6	Confident	91.7	Very high	72 Å²	72	59.5 Å²	59.5	44%	0.442	31%	0.311	S	S	.	.	H	α-helix	trans	-105.9	-37.4	-180	62.2	0	0	0	0	114.7	N60 Y61	N60-T64 WeakPolarHBondContact ND2-CG2 3.49Å; N60-T64 PolarHBondContact ND2-OG1 2.89Å; N60-T64 PolarHBondContact O-N 2.63Å; N60-T64 PolarHBondContact O-OG1 3.19Å; N60-T64 VanDerWaalsContact O-OG1 3.12Å; Y61-T64 PolarHBondContact O-N 2.85Å
65	E	93.3	Very high	91.5	Very high	89 Å²	89	58.2 Å²	58.2	42%	0.416	30%	0.297	S	S	.	.	S	Bend	trans	-87.9	159.5	-168.5	-56.8	-45.1	118.7	0	0	113.9	Y61 H67 N105	Y61-E65 HydrophobicContact CD2-CB 4.27Å; Y61-E65 HydrophobicContact CD2-CG 3.49Å; Y61-E65 VanDerWaalsContact CD2-CG 3.49Å; Y61-E65 HydrophobicContact CE2-CB 4.09Å; Y61-E65 HydrophobicContact CE2-CG 3.6Å; Y61-E65 HydrophobicContact CG-CG 4.09Å; Y61-E65 WeakPolarHBondContact O-CB 3.47Å; Y61-E65 WeakPolarHBondContact O-CG 3.32Å; Y61-E65 PolarHBondContact O-N 3.45Å; E65-H67 PolarHBondContact O-CD2 3.48Å; E65-H67 PolarHBondContact O-N 2.4Å; E65-N105 WeakPolarHBondContact O-CB 3.09Å; E65-N105 PolarHBondContact O-ND2 3.05Å
66	Q	93.3	Very high	90.9	Very high	179 Å²	179	58.6 Å²	58.6	84%	0.836	30%	0.3	S	S	*	.			trans	-90.3	95.3	176.7	-65.9	-171	2.8	0	0	110.9
67	H	92.8	Very high	89.8	Confident	52 Å²	52	58.4 Å²	58.4	24%	0.241	30%	0.295	C	S	.	.			trans	-112.3	14.4	177.2	55.3	64.7	0	0	0	113.5	I62 E65 K69 V71 N105 C107	I62-H67 WeakPolarHBondContact CA-NE2 3.4Å; I62-H67 WeakPolarHBondContact CG2-NE2 3.43Å; I62-H67 PolarHBondContact O-NE2 3.04Å; E65-H67 PolarHBondContact O-CD2 3.48Å; E65-H67 PolarHBondContact O-N 2.4Å; H67-K69 PolarHBondContact CE1-O 3.4Å; H67-K69 PolarHBondContact ND1-N 2.84Å; H67-K69 PolarHBondContact ND1-O 3.41Å; H67-K69 PolarHBondContact O-N 3.13Å; H67-K69 VanDerWaalsContact O-N 3.11Å; H67-V71 WeakPolarHBondContact CE1-CG2 3.36Å; H67-N105 PolarHBondContact NE2-ND2 2.87Å; H67-N105 VanDerWaalsContact NE2-ND2 3.17Å; H67-C107 PolarHBondContact CE1-SG 3.38Å; H67-C107 PolarHBondContact NE2-SG 2.92Å
68	S	90.8	Very high	87.9	Confident	129 Å²	129	60.6 Å²	60.6	90%	0.902	30%	0.295	S	S	*	.	S	Bend	trans	54.9	26.2	174.5	-58.1	0	0	0	0	116.1
69	K	91.4	Very high	85.5	Confident	122 Å²	122	60 Å²	60	53%	0.53	31%	0.306	S	S	.	.			trans	-126.8	146.5	169.6	-64.9	-174.7	176.7	-173.7	0	110.5	H67 V71	H67-K69 PolarHBondContact CE1-O 3.4Å; H67-K69 PolarHBondContact ND1-N 2.84Å; H67-K69 PolarHBondContact ND1-O 3.41Å; H67-K69 PolarHBondContact O-N 3.13Å; H67-K69 VanDerWaalsContact O-N 3.11Å; K69-V71 HydrophobicContact CB-CG2 4.19Å; K69-V71 PolarHBondContact O-N 2.82Å
70	R	94.6	Very high	83.2	Confident	91 Å²	91	69 Å²	69	34%	0.343	35%	0.348	S	S	.	.			trans	-96.7	89.3	175.1	-55.8	173.8	-62.8	157.2	1.7	108.9	G106 G128 K129 F130 D131	R70-G106 WeakPolarHBondContact CB-O 3.47Å; R70-G128 PolarHBondContact NH1-O 3.15Å; R70-G128 PolarHBondContact NH2-O 2.94Å; R70-G128 VanDerWaalsContact NH2-O 3.15Å; R70-K129 WeakPolarHBondContact CD-O 3.34Å; R70-K129 PolarHBondContact NH1-O 3.49Å; R70-K129 VanDerWaalsContact NH1-O 3.1Å; R70-F130 CarbonylContact O-C 3.55Å; R70-F130 VanDerWaalsContact O-CA 3.31Å; R70-F130 WeakPolarHBondContact O-CA 3.4Å; R70-F130 WeakPolarHBondContact O-CB 3.43Å; R70-D131 VanDerWaalsContact CB-OD2 3.27Å; R70-D131 WeakPolarHBondContact CB-OD2 3.43Å; R70-D131 WeakPolarHBondContact CG-OD2 3.32Å; R70-D131 IonicContact CZ-OD1 2.66Å; R70-D131 IonicContact CZ-OD2 3.54Å; R70-D131 PolarHBondContact N-OD2 3.22Å; R70-D131 IonicContact NE-OD1 3.8Å; R70-D131 IonicContact NE-OD2 2.69Å; R70-D131 PolarHBondContact NE-OD2 3.45Å; R70-D131 IonicContact NH2-OD1 2.84Å; R70-D131 PolarHBondContact NH2-OD1 3.1Å; R70-D131 IonicContact NH2-OD2 2.63Å; R70-D131 PolarHBondContact O-N 2.66Å
71	V	96.2	Very high	81.4	Confident	11 Å²	11	67.5 Å²	67.5	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.9	-177.4	-174.9	0	0	0	0	109.8	I62 H67 K69 V73 C107 L108 Y132 L134	I62-V71 HydrophobicContact CG2-CB 3.99Å; I62-V71 HydrophobicContact CG2-CG1 4.04Å; I62-V71 HydrophobicContact CG2-CG2 4.13Å; H67-V71 WeakPolarHBondContact CE1-CG2 3.36Å; K69-V71 HydrophobicContact CB-CG2 4.19Å; K69-V71 PolarHBondContact O-N 2.82Å; V71-V73 HydrophobicContact CG1-CG2 3.94Å; V71-C107 PolarHBondContact N-SG 3.48Å; V71-C107 CarbonylContact O-C 3.53Å; V71-C107 WeakPolarHBondContact O-CA 3.32Å; V71-C107 WeakPolarHBondContact O-CB 3.45Å; V71-L108 PolarHBondContact O-N 3.17Å; V71-Y132 HydrophobicContact CG1-CD1 4.29Å; V71-L134 HydrophobicContact CG1-CB 3.86Å; V71-L134 HydrophobicContact CG1-CD2 4.43Å
72	A	94.9	Very high	79.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	112.3	169.5	0	0	0	0	0	110	W100 L108 L123 F130 Y132 I133 L134	A72-W100 HydrophobicContact CB-CZ3 4.22Å; A72-L108 CarbonylContact C-O 3.55Å; A72-L108 WeakPolarHBondContact CA-O 3.48Å; A72-L108 HydrophobicContact CB-CB 4.15Å; A72-L123 HydrophobicContact CB-CD1 3.83Å; A72-L123 HydrophobicContact CB-CD2 3.49Å; A72-L123 VanDerWaalsContact CB-CD2 3.49Å; A72-L123 HydrophobicContact CB-CG 4.27Å; A72-F130 HydrophobicContact CB-CB 3.91Å; A72-F130 HydrophobicContact CB-CD1 4.46Å; A72-F130 HydrophobicContact CB-CD2 3.92Å; A72-F130 HydrophobicContact CB-CG 3.83Å; A72-Y132 PolarHBondContact N-O 2.92Å; A72-I133 WeakPolarHBondContact O-CA 2.87Å; A72-L134 PolarHBondContact O-N 2.71Å
73	V	93.4	Very high	78	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.2	-176.3	-177	0	0	0	0	110.7	L59 I62 L63 V71 L75 L108 C109 C110 L134	L59-V73 HydrophobicContact CD2-CG1 3.9Å; I62-V73 HydrophobicContact CG2-CG2 4.21Å; L63-V73 HydrophobicContact CD2-CB 3.96Å; L63-V73 HydrophobicContact CD2-CG2 3.51Å; L63-V73 HydrophobicContact CG-CG2 4.2Å; V71-V73 HydrophobicContact CG1-CG2 3.94Å; V73-L75 HydrophobicContact CG1-CD2 3.75Å; V73-L75 HydrophobicContact CG1-CG 4.39Å; V73-L108 PolarHBondContact N-O 2.99Å; V73-C109 HydrophobicContact CB-CB 4.43Å; V73-C109 VanDerWaalsContact O-CA 3.29Å; V73-C109 WeakPolarHBondContact O-CA 3.37Å; V73-C110 PolarHBondContact O-N 2.81Å; V73-C110 VanDerWaalsContact O-N 3.1Å; V73-L134 CarbonylContact C-O 3.56Å; V73-L134 WeakPolarHBondContact CA-O 3.49Å; V73-L134 HydrophobicContact CG2-CB 4.23Å; V73-L134 HydrophobicContact CG2-CD2 4.25Å
74	I	90.6	Very high	76.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.9	174.3	-60.1	159.9	0	0	0	107.8	W100 V112 A119 I120 I133 L134 L135 E136	I74-W100 HydrophobicContact CD1-CH2 4.44Å; I74-W100 HydrophobicContact CG1-CH2 3.67Å; I74-W100 HydrophobicContact CG1-CZ2 4.3Å; I74-V112 HydrophobicContact CG2-CG2 3.68Å; I74-A119 HydrophobicContact CD1-CB 3.9Å; I74-A119 HydrophobicContact CG1-CB 4.1Å; I74-A119 HydrophobicContact CG2-CB 3.74Å; I74-I120 HydrophobicContact CD1-CD1 4.3Å; I74-I120 HydrophobicContact CD1-CG1 3.48Å; I74-I120 VanDerWaalsContact CD1-CG1 3.48Å; I74-I133 HydrophobicContact CD1-CG2 3.94Å; I74-L134 PolarHBondContact N-O 2.81Å; I74-L135 HydrophobicContact CB-CD1 3.77Å; I74-L135 HydrophobicContact CD1-CD1 4.33Å; I74-L135 HydrophobicContact CG2-CD1 3.58Å; I74-E136 PolarHBondContact O-N 2.84Å
75	L	86.8	Confident	75.5	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	146.9	173.6	-52.5	178.1	0	0	0	109.8	L59 V73 L84 E85 L88 C110 V112	L59-L75 HydrophobicContact CD1-CD2 3.84Å; V73-L75 HydrophobicContact CG1-CD2 3.75Å; V73-L75 HydrophobicContact CG1-CG 4.39Å; L75-L84 HydrophobicContact CD1-CD2 4.01Å; L75-L84 HydrophobicContact CD1-CG 4.12Å; L75-L84 HydrophobicContact CD2-CD2 4Å; L75-E85 HydrophobicContact CD1-CG 4.24Å; L75-L88 HydrophobicContact CD1-CD1 4.38Å; L75-C110 WeakPolarHBondContact CB-O 3.37Å; L75-C110 PolarHBondContact N-O 3.39Å; L75-V112 WeakPolarHBondContact O-CG2 3.41Å; L75-V112 PolarHBondContact O-N 2.96Å
76	N	76.2	Confident	73.8	Confident	24 Å²	24	63.2 Å²	63.2	13%	0.128	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	111.2	-164.4	-172.6	-3.1	0	0	0	112.3	F78 E136 T138	N76-F78 VanDerWaalsContact C-N 3.26Å; N76-F78 PolarHBondContact O-N 3.32Å; N76-F78 VanDerWaalsContact OD1-CD2 3.26Å; N76-F78 WeakPolarHBondContact OD1-CD2 3.49Å; N76-E136 VanDerWaalsContact CB-O 3.32Å; N76-E136 WeakPolarHBondContact CB-O 3.12Å; N76-E136 PolarHBondContact ND2-O 3.36Å; N76-T138 HydrophobicContact CB-CG2 4.34Å; N76-T138 VanDerWaalsContact O-CG2 3.3Å; N76-T138 WeakPolarHBondContact O-CG2 3.32Å
77	E	64.3	Low	72.2	Confident	47 Å²	47	57.5 Å²	57.5	22%	0.22	32%	0.319	C	S	.	.			trans	-76.9	27	-162.1	-66.8	-168.5	-163.8	0	0	116.8	G79 S111 V112 K113	E77-G79 PolarHBondContact O-N 2.82Å; E77-S111 VanDerWaalsContact CD-OG 3.3Å; E77-S111 WeakPolarHBondContact CG-OG 3.4Å; E77-S111 VanDerWaalsContact OE1-CB 3.32Å; E77-S111 WeakPolarHBondContact OE1-CB 3.36Å; E77-S111 PolarHBondContact OE1-OG 3.48Å; E77-V112 PolarHBondContact N-O 2.87Å; E77-K113 HydrophobicContact CB-CG 4.14Å; E77-K113 HydrophobicContact CG-CG 4.3Å; E77-K113 WeakPolarHBondContact OE2-CE 3.39Å; E77-K113 WeakPolarHBondContact OE2-CG 3.37Å
78	F	47.9	Very low	70.6	Confident	154 Å²	154	56.2 Å²	56.2	68%	0.675	31%	0.313	S	S	*	.	S	Bend	trans	-79.8	61.3	170.9	-67.6	-87.7	0	0	0	112.2	N76 T138	N76-F78 VanDerWaalsContact C-N 3.26Å; N76-F78 PolarHBondContact O-N 3.32Å; N76-F78 VanDerWaalsContact OD1-CD2 3.26Å; N76-F78 WeakPolarHBondContact OD1-CD2 3.49Å; F78-T138 HydrophobicContact CB-CG2 3.73Å
79	G	42.4	Very low	68.9	Low	56 Å²	56	50.7 Å²	50.7	58%	0.577	28%	0.276	S	S	*	.	S	Bend	trans	175.9	168	175.3	0	0	0	0	0	112.7	E77 G81	E77-G79 PolarHBondContact O-N 2.82Å; G79-G81 PolarHBondContact O-N 2.81Å; G79-G81 VanDerWaalsContact O-N 3.14Å
80	E	44.1	Very low	67.1	Low	192 Å²	192	50.9 Å²	50.9	90%	0.897	29%	0.287	S	S	*	.	S	Bend	trans	-60.4	118.1	170.3	-70.3	-174.1	110.9	0	0	109.7	S82	E80-S82 PolarHBondContact O-N 3Å
81	G	51.1	Low	65.1	Low	24 Å²	24	50.9 Å²	50.9	25%	0.247	30%	0.301	C	S	.	.			trans	-40.6	130.5	-161.6	0	0	0	0	0	115.2	G79 E85 K86	G79-G81 PolarHBondContact O-N 2.81Å; G79-G81 VanDerWaalsContact O-N 3.14Å; G81-E85 VanDerWaalsContact C-OE2 3.26Å; G81-E85 WeakPolarHBondContact CA-OE2 3.34Å; G81-K86 WeakPolarHBondContact O-CD 3.49Å; G81-K86 WeakPolarHBondContact O-CE 3.49Å; G81-K86 PolarHBondContact O-NZ 2.9Å
82	S	55.4	Low	63.1	Low	26 Å²	26	55 Å²	55	18%	0.182	32%	0.32	C	S	.	.			trans	-60.9	159.7	-163.3	72.5	0	0	0	0	113.1	E80 L84 E85 K86	E80-S82 PolarHBondContact O-N 3Å; S82-L84 PolarHBondContact O-N 2.86Å; S82-L84 VanDerWaalsContact O-N 3.12Å; S82-L84 PolarHBondContact OG-N 3.46Å; S82-E85 WeakPolarHBondContact CA-OE1 3.21Å; S82-E85 WeakPolarHBondContact CB-OE1 3.2Å; S82-E85 PolarHBondContact N-OE1 3.19Å; S82-E85 PolarHBondContact N-OE2 2.85Å; S82-E85 PolarHBondContact O-N 3.34Å; S82-E85 PolarHBondContact OG-N 3.04Å; S82-E85 PolarHBondContact OG-OE1 3.08Å; S82-K86 PolarHBondContact O-N 3.1Å
83	A	59.8	Low	61.1	Low	78 Å²	78	58.2 Å²	58.2	65%	0.645	35%	0.352	S	S	*	.	H	α-helix	trans	-58.6	-24.8	173.5	0	0	0	0	0	112.4	T56 S87	T56-A83 HydrophobicContact CG2-CB 4.43Å; A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 3.08Å
84	L	65.5	Low	59	Low	3 Å²	3	60.6 Å²	60.6	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-75.5	-48.2	176.8	-175.5	55.8	0	0	0	111.6	T56 L59 N60 L63 L75 S82 K86 S87 L88	T56-L84 HydrophobicContact CG2-CB 3.7Å; L59-L84 HydrophobicContact CB-CD2 3.66Å; N60-L84 HydrophobicContact CB-CD1 4.1Å; L63-L84 HydrophobicContact CD1-CD1 4.29Å; L63-L84 HydrophobicContact CD1-CD2 4.03Å; L63-L84 HydrophobicContact CD1-CG 4.38Å; L75-L84 HydrophobicContact CD1-CD2 4.01Å; L75-L84 HydrophobicContact CD1-CG 4.12Å; L75-L84 HydrophobicContact CD2-CD2 4Å; S82-L84 PolarHBondContact O-N 2.86Å; S82-L84 VanDerWaalsContact O-N 3.12Å; S82-L84 PolarHBondContact OG-N 3.46Å; L84-K86 VanDerWaalsContact C-N 3.3Å; L84-K86 PolarHBondContact O-N 2.83Å; L84-S87 WeakPolarHBondContact O-CB 3.41Å; L84-S87 PolarHBondContact O-N 3.33Å; L84-S87 VanDerWaalsContact O-N 3.15Å; L84-L88 HydrophobicContact CD1-CD1 4.17Å; L84-L88 HydrophobicContact CD1-CG 4.33Å; L84-L88 HydrophobicContact CG-CD1 4.01Å; L84-L88 WeakPolarHBondContact O-CB 3.26Å; L84-L88 VanDerWaalsContact O-CG 3.28Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.48Å
85	E	59.8	Low	57	Low	16 Å²	16	67.1 Å²	67.1	8%	0.075	41%	0.408	C	S	.	.	H	α-helix	trans	-54.4	-46.9	171.2	-71.1	144.1	-114.3	0	0	111.4	L75 G81 S82 S87 L88 A89	L75-E85 HydrophobicContact CD1-CG 4.24Å; G81-E85 VanDerWaalsContact C-OE2 3.26Å; G81-E85 WeakPolarHBondContact CA-OE2 3.34Å; S82-E85 WeakPolarHBondContact CA-OE1 3.21Å; S82-E85 WeakPolarHBondContact CB-OE1 3.2Å; S82-E85 PolarHBondContact N-OE1 3.19Å; S82-E85 PolarHBondContact N-OE2 2.85Å; S82-E85 PolarHBondContact O-N 3.34Å; S82-E85 PolarHBondContact OG-N 3.04Å; S82-E85 PolarHBondContact OG-OE1 3.08Å; E85-S87 VanDerWaalsContact C-N 3.33Å; E85-S87 PolarHBondContact O-N 3.31Å; E85-L88 PolarHBondContact O-N 3.45Å; E85-A89 VanDerWaalsContact O-CB 3.27Å; E85-A89 WeakPolarHBondContact O-CB 3.15Å; E85-A89 PolarHBondContact O-N 3.29Å
86	K	58.9	Low	55.1	Low	121 Å²	121	71.8 Å²	71.8	53%	0.526	43%	0.432	S	S	.	.	H	α-helix	trans	-61.9	-39.7	178.5	-73.7	163.8	177.4	150.3	0	111.8	G81 S82 L84 V90	G81-K86 WeakPolarHBondContact O-CD 3.49Å; G81-K86 WeakPolarHBondContact O-CE 3.49Å; G81-K86 PolarHBondContact O-NZ 2.9Å; S82-K86 PolarHBondContact O-N 3.1Å; L84-K86 VanDerWaalsContact C-N 3.3Å; L84-K86 PolarHBondContact O-N 2.83Å; K86-V90 VanDerWaalsContact O-CB 3.28Å; K86-V90 WeakPolarHBondContact O-CB 3.3Å; K86-V90 WeakPolarHBondContact O-CG2 3.5Å; K86-V90 PolarHBondContact O-N 2.8Å
87	S	58.7	Low	53.9	Low	58 Å²	58	73.6 Å²	73.6	41%	0.406	44%	0.438	S	S	.	.	H	α-helix	trans	-65.9	-43.2	175.1	-167.5	0	0	0	0	112.3	A83 L84 E85 S91	A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 3.08Å; L84-S87 WeakPolarHBondContact O-CB 3.41Å; L84-S87 PolarHBondContact O-N 3.33Å; L84-S87 VanDerWaalsContact O-N 3.15Å; E85-S87 VanDerWaalsContact C-N 3.33Å; E85-S87 PolarHBondContact O-N 3.31Å; S87-S91 VanDerWaalsContact O-CB 3.32Å; S87-S91 WeakPolarHBondContact O-CB 3.38Å; S87-S91 PolarHBondContact O-N 2.98Å; S87-S91 PolarHBondContact O-OG 2.86Å
88	L	59.4	Low	53.5	Low	25 Å²	25	78.6 Å²	78.6	13%	0.131	46%	0.461	C	S	.	.	H	α-helix	trans	-68.4	-46.6	179.3	-69.8	166.6	0	0	0	111.9	L63 L75 L84 E85 S91 Q92 L103	L63-L88 HydrophobicContact CD1-CD1 4.19Å; L75-L88 HydrophobicContact CD1-CD1 4.38Å; L84-L88 HydrophobicContact CD1-CD1 4.17Å; L84-L88 HydrophobicContact CD1-CG 4.33Å; L84-L88 HydrophobicContact CG-CD1 4.01Å; L84-L88 WeakPolarHBondContact O-CB 3.26Å; L84-L88 VanDerWaalsContact O-CG 3.28Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.48Å; E85-L88 PolarHBondContact O-N 3.45Å; L88-S91 WeakPolarHBondContact O-CA 3.41Å; L88-S91 WeakPolarHBondContact O-CB 3.24Å; L88-S91 PolarHBondContact O-N 3.04Å; L88-S91 VanDerWaalsContact O-N 3.1Å; L88-Q92 PolarHBondContact O-N 2.87Å; L88-L103 HydrophobicContact CD2-CD1 4.43Å; L88-L103 HydrophobicContact CD2-CD2 4.15Å
89	A	55.4	Low	54.5	Low	14 Å²	14	78.3 Å²	78.3	12%	0.116	46%	0.462	C	S	.	.	H	α-helix	trans	-62.9	-45.3	177.4	0	0	0	0	0	111.6	E85 S91 Q92 G93 G94	E85-A89 VanDerWaalsContact O-CB 3.27Å; E85-A89 WeakPolarHBondContact O-CB 3.15Å; E85-A89 PolarHBondContact O-N 3.29Å; A89-S91 PolarHBondContact O-N 3Å; A89-Q92 PolarHBondContact O-N 2.94Å; A89-Q92 VanDerWaalsContact O-N 3.15Å; A89-G93 PolarHBondContact O-N 3.05Å; A89-G94 PolarHBondContact O-N 3.01Å
90	V	52.7	Low	56.4	Low	125 Å²	125	77.1 Å²	77.1	76%	0.758	44%	0.44	S	S	*	.	H	α-helix	trans	-62.2	-30.3	173.6	168.8	0	0	0	0	111.8	K86 Q92	K86-V90 VanDerWaalsContact O-CB 3.28Å; K86-V90 WeakPolarHBondContact O-CB 3.3Å; K86-V90 WeakPolarHBondContact O-CG2 3.5Å; K86-V90 PolarHBondContact O-N 2.8Å; V90-Q92 VanDerWaalsContact C-N 3.34Å; V90-Q92 PolarHBondContact O-N 3.12Å
91	S	52.9	Low	58.4	Low	92 Å²	92	68.9 Å²	68.9	64%	0.643	40%	0.402	S	S	*	.	H	α-helix	trans	-75	-16	177	-62.7	0	0	0	0	114.5	S87 L88 A89	S87-S91 VanDerWaalsContact O-CB 3.32Å; S87-S91 WeakPolarHBondContact O-CB 3.38Å; S87-S91 PolarHBondContact O-N 2.98Å; S87-S91 PolarHBondContact O-OG 2.86Å; L88-S91 WeakPolarHBondContact O-CA 3.41Å; L88-S91 WeakPolarHBondContact O-CB 3.24Å; L88-S91 PolarHBondContact O-N 3.04Å; L88-S91 VanDerWaalsContact O-N 3.1Å; A89-S91 PolarHBondContact O-N 3Å
92	Q	54.9	Low	60.2	Low	97 Å²	97	73 Å²	73	45%	0.453	42%	0.415	S	S	.	.	H	α-helix	trans	-126.2	-14.2	-177.1	-62.1	-153.9	19.7	0	0	116.4	L88 A89 V90 Y97	L88-Q92 PolarHBondContact O-N 2.87Å; A89-Q92 PolarHBondContact O-N 2.94Å; A89-Q92 VanDerWaalsContact O-N 3.15Å; V90-Q92 VanDerWaalsContact C-N 3.34Å; V90-Q92 PolarHBondContact O-N 3.12Å; Q92-Y97 HydrophobicContact CB-CE2 4.32Å
93	G	52.6	Low	61.8	Low	67 Å²	67	73 Å²	73	69%	0.691	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	144.9	-3.9	170.2	0	0	0	0	0	117.3	A89	A89-G93 PolarHBondContact O-N 3.05Å
94	G	49.7	Very low	63.2	Low	51 Å²	51	81.9 Å²	81.9	53%	0.526	43%	0.43	S	S	.	.	S	Bend	trans	101.7	-3.6	173.9	0	0	0	0	0	116.3	A89	A89-G94 PolarHBondContact O-N 3.01Å
95	E	47.8	Very low	64.4	Low	136 Å²	136	83.2 Å²	83.2	64%	0.636	44%	0.436	S	S	*	.			trans	-75.7	151.1	172.8	-67.8	-63.6	140	0	0	111.8	Y97	E95-Y97 HydrophobicContact CB-CE1 4.14Å; E95-Y97 HydrophobicContact CB-CE2 4.21Å; E95-Y97 WeakPolarHBondContact O-CD2 3.41Å; E95-Y97 VanDerWaalsContact O-CE2 3.24Å; E95-Y97 WeakPolarHBondContact O-CE2 3.35Å
96	L	48.6	Very low	65.9	Low	101 Å²	101	83.5 Å²	83.5	53%	0.529	44%	0.444	S	S	.	.			trans	-99	99.7	172.5	-82.7	164.1	0	0	0	109.1	E98	L96-E98 PolarHBondContact O-N 3.42Å
97	Y	50.1	Low	67.6	Low	63 Å²	63	77.7 Å²	77.7	25%	0.247	42%	0.419	C	S	.	.			trans	-79.7	119.1	-170.5	-54.6	-92	0	0	0	112.8	Q92 E95 L101	Q92-Y97 HydrophobicContact CB-CE2 4.32Å; E95-Y97 HydrophobicContact CB-CE1 4.14Å; E95-Y97 HydrophobicContact CB-CE2 4.21Å; E95-Y97 WeakPolarHBondContact O-CD2 3.41Å; E95-Y97 VanDerWaalsContact O-CE2 3.24Å; E95-Y97 WeakPolarHBondContact O-CE2 3.35Å; Y97-L101 HydrophobicContact CD1-CD2 4.06Å; Y97-L101 HydrophobicContact CD2-CD1 3.89Å; Y97-L101 HydrophobicContact CD2-CD2 3.94Å; Y97-L101 HydrophobicContact CD2-CG 4.33Å; Y97-L101 HydrophobicContact CE1-CD2 4.4Å; Y97-L101 HydrophobicContact CE2-CD1 4.33Å; Y97-L101 HydrophobicContact CE2-CD2 4.29Å; Y97-L101 HydrophobicContact CG-CD1 4.45Å; Y97-L101 HydrophobicContact CG-CD2 3.82Å; Y97-L101 HydrophobicContact CG-CG 4.42Å
98	E	55.9	Low	69.2	Low	152 Å²	152	75.3 Å²	75.3	71%	0.71	40%	0.401	S	S	*	.	S	Bend	trans	-76.1	-6.4	156	-63.8	-179.8	175.4	0	0	111.4	L96 K113	L96-E98 PolarHBondContact O-N 3.42Å; E98-K113 IonicContact OE1-NZ 3.73Å
99	E	69.2	Low	70.6	Confident	147 Å²	147	74.2 Å²	74.2	69%	0.687	40%	0.395	S	S	*	.	S	Bend	trans	-88.5	152.3	174	-173.2	163	-148.3	0	0	112.2
100	W	82.5	Confident	72.1	Confident	31 Å²	31	73.9 Å²	73.9	12%	0.117	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-79.5	118	-178.2	-77.6	84.4	0	0	0	112.1	A72 I74 L108 C110 L123 K126	A72-W100 HydrophobicContact CB-CZ3 4.22Å; I74-W100 HydrophobicContact CD1-CH2 4.44Å; I74-W100 HydrophobicContact CG1-CH2 3.67Å; I74-W100 HydrophobicContact CG1-CZ2 4.3Å; W100-L108 HydrophobicContact CE3-CB 3.87Å; W100-L108 HydrophobicContact CZ3-CB 4.16Å; W100-C110 HydrophobicContact CD2-CB 3.93Å; W100-C110 HydrophobicContact CE3-CB 3.94Å; W100-C110 HydrophobicContact CG-CB 4.48Å; W100-C110 HydrophobicContact CH2-CB 4.18Å; W100-C110 WeakPolarHBondContact CH2-SG 3.32Å; W100-C110 HydrophobicContact CZ2-CB 4.12Å; W100-C110 WeakPolarHBondContact CZ2-SG 3.32Å; W100-C110 HydrophobicContact CZ3-CB 4.08Å; W100-L123 HydrophobicContact CD2-CD1 4.14Å; W100-L123 HydrophobicContact CE3-CD1 4.06Å; W100-L123 HydrophobicContact CH2-CB 4.03Å; W100-L123 HydrophobicContact CH2-CD1 3.76Å; W100-L123 HydrophobicContact CH2-CD2 3.74Å; W100-L123 HydrophobicContact CH2-CG 4.03Å; W100-L123 HydrophobicContact CZ2-CB 3.55Å; W100-L123 HydrophobicContact CZ2-CD1 3.88Å; W100-L123 HydrophobicContact CZ2-CD2 4.15Å; W100-L123 HydrophobicContact CZ2-CG 4.04Å; W100-L123 HydrophobicContact CZ3-CD1 3.86Å; W100-L123 HydrophobicContact CZ3-CD2 4.39Å; W100-K126 HydrophobicContact CB-CD 4.36Å; W100-K126 VanDerWaalsContact CD1-NZ 3.26Å; W100-K126 HydrophobicContact CG-CD 4.35Å
101	L	85.6	Confident	73.4	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.6	176.7	-55.6	-178.1	0	0	0	110.8	Y97 L108 C109	Y97-L101 HydrophobicContact CD1-CD2 4.06Å; Y97-L101 HydrophobicContact CD2-CD1 3.89Å; Y97-L101 HydrophobicContact CD2-CD2 3.94Å; Y97-L101 HydrophobicContact CD2-CG 4.33Å; Y97-L101 HydrophobicContact CE1-CD2 4.4Å; Y97-L101 HydrophobicContact CE2-CD1 4.33Å; Y97-L101 HydrophobicContact CE2-CD2 4.29Å; Y97-L101 HydrophobicContact CG-CD1 4.45Å; Y97-L101 HydrophobicContact CG-CD2 3.82Å; Y97-L101 HydrophobicContact CG-CG 4.42Å; L101-L108 CarbonylContact O-C 3.58Å; L101-L108 VanDerWaalsContact O-CA 3.3Å; L101-L108 WeakPolarHBondContact O-CA 3.26Å; L101-C109 PolarHBondContact N-O 3.26Å; L101-C109 PolarHBondContact O-N 2.86Å
102	E	89.8	Confident	74.5	Confident	112 Å²	112	65.1 Å²	65.1	52%	0.523	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.7	172.5	-171.6	164	163.8	0	0	110	L108 K129	E102-L108 HydrophobicContact CB-CD2 3.76Å; E102-L108 HydrophobicContact CG-CD2 3.81Å; E102-K129 IonicContact OE1-NZ 2.67Å; E102-K129 PolarHBondContact OE1-NZ 3.13Å; E102-K129 IonicContact OE2-NZ 2.61Å; E102-K129 PolarHBondContact OE2-NZ 2.87Å
103	L	88.8	Confident	75	Confident	26 Å²	26	65.6 Å²	65.6	14%	0.136	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-102.7	163.3	-172.8	-57	-173.1	0	0	0	112.6	L63 L88 N105 G106 C107	L63-L103 HydrophobicContact CB-CD1 3.61Å; L63-L103 HydrophobicContact CD1-CD1 4.23Å; L63-L103 HydrophobicContact CD2-CD1 3.72Å; L63-L103 HydrophobicContact CG-CD1 4.04Å; L63-L103 WeakPolarHBondContact O-CD1 3.16Å; L88-L103 HydrophobicContact CD2-CD1 4.43Å; L88-L103 HydrophobicContact CD2-CD2 4.15Å; L103-N105 PolarHBondContact O-N 3.25Å; L103-N105 VanDerWaalsContact O-N 3.13Å; L103-G106 PolarHBondContact O-N 3.41Å; L103-C107 WeakPolarHBondContact CB-O 3.35Å; L103-C107 PolarHBondContact N-O 3.5Å
104	R	88.3	Confident	75.6	Confident	264 Å²	264	66.6 Å²	66.6	100%	0.996	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21	-174	-64.7	-176.3	-177.1	171	2.7	114.8
105	N	90.1	Very high	76.8	Confident	30 Å²	30	67 Å²	67	16%	0.16	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2.4	175	69.3	-11.9	0	0	0	113.1	I62 E65 H67 L103 C107	I62-N105 PolarHBondContact O-ND2 3.43Å; E65-N105 WeakPolarHBondContact O-CB 3.09Å; E65-N105 PolarHBondContact O-ND2 3.05Å; H67-N105 PolarHBondContact NE2-ND2 2.87Å; H67-N105 VanDerWaalsContact NE2-ND2 3.17Å; L103-N105 PolarHBondContact O-N 3.25Å; L103-N105 VanDerWaalsContact O-N 3.13Å; N105-C107 VanDerWaalsContact C-N 3.35Å; N105-C107 VanDerWaalsContact OD1-CB 3.26Å; N105-C107 WeakPolarHBondContact OD1-CB 3.42Å; N105-C107 PolarHBondContact OD1-N 3.31Å
106	G	91.9	Very high	78.2	Confident	22 Å²	22	61.2 Å²	61.2	23%	0.227	30%	0.297	C	S	.	.	S	Bend	trans	83.4	3.9	-177	0	0	0	0	0	114.7	R70 L103	R70-G106 WeakPolarHBondContact CB-O 3.47Å; L103-G106 PolarHBondContact O-N 3.41Å
107	C	94.4	Very high	79.8	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.			trans	-74.1	154.8	168.6	-67	0	0	0	0	111.3	I62 L63 H67 V71 L103 N105	I62-C107 PolarHBondContact O-SG 2.83Å; I62-C107 VanDerWaalsContact O-SG 3.38Å; L63-C107 HydrophobicContact CD2-CB 3.96Å; H67-C107 PolarHBondContact CE1-SG 3.38Å; H67-C107 PolarHBondContact NE2-SG 2.92Å; V71-C107 PolarHBondContact N-SG 3.48Å; V71-C107 CarbonylContact O-C 3.53Å; V71-C107 WeakPolarHBondContact O-CA 3.32Å; V71-C107 WeakPolarHBondContact O-CB 3.45Å; L103-C107 WeakPolarHBondContact CB-O 3.35Å; L103-C107 PolarHBondContact N-O 3.5Å; N105-C107 VanDerWaalsContact C-N 3.35Å; N105-C107 VanDerWaalsContact OD1-CB 3.26Å; N105-C107 WeakPolarHBondContact OD1-CB 3.42Å; N105-C107 PolarHBondContact OD1-N 3.31Å
108	L	92.2	Very high	81.3	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	147.5	170.1	-57.2	-179.9	0	0	0	109.2	V71 A72 V73 W100 L101 E102 L123 K129 F130	V71-L108 PolarHBondContact O-N 3.17Å; A72-L108 CarbonylContact C-O 3.55Å; A72-L108 WeakPolarHBondContact CA-O 3.48Å; A72-L108 HydrophobicContact CB-CB 4.15Å; V73-L108 PolarHBondContact N-O 2.99Å; W100-L108 HydrophobicContact CE3-CB 3.87Å; W100-L108 HydrophobicContact CZ3-CB 4.16Å; L101-L108 CarbonylContact O-C 3.58Å; L101-L108 VanDerWaalsContact O-CA 3.3Å; L101-L108 WeakPolarHBondContact O-CA 3.26Å; E102-L108 HydrophobicContact CB-CD2 3.76Å; E102-L108 HydrophobicContact CG-CD2 3.81Å; L108-L123 HydrophobicContact CD1-CD1 4Å; L108-K129 HydrophobicContact CD1-CB 4.2Å; L108-F130 HydrophobicContact CD1-CB 4.3Å; L108-F130 HydrophobicContact CD1-CD1 3.94Å; L108-F130 HydrophobicContact CD1-CG 4.47Å
109	C	90.2	Very high	82.7	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	148.4	167.5	62.3	0	0	0	0	113.1	L63 V73 L101	L63-C109 HydrophobicContact CD1-CB 3.76Å; L63-C109 HydrophobicContact CD2-CB 4.01Å; V73-C109 HydrophobicContact CB-CB 4.43Å; V73-C109 VanDerWaalsContact O-CA 3.29Å; V73-C109 WeakPolarHBondContact O-CA 3.37Å; L101-C109 PolarHBondContact N-O 3.26Å; L101-C109 PolarHBondContact O-N 2.86Å
110	C	85.6	Confident	83.5	Confident	7 Å²	7	47.3 Å²	47.3	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	163	166.2	71.6	0	0	0	0	110.7	V73 L75 W100	V73-C110 PolarHBondContact O-N 2.81Å; V73-C110 VanDerWaalsContact O-N 3.1Å; L75-C110 WeakPolarHBondContact CB-O 3.37Å; L75-C110 PolarHBondContact N-O 3.39Å; W100-C110 HydrophobicContact CD2-CB 3.93Å; W100-C110 HydrophobicContact CE3-CB 3.94Å; W100-C110 HydrophobicContact CG-CB 4.48Å; W100-C110 HydrophobicContact CH2-CB 4.18Å; W100-C110 WeakPolarHBondContact CH2-SG 3.32Å; W100-C110 HydrophobicContact CZ2-CB 4.12Å; W100-C110 WeakPolarHBondContact CZ2-SG 3.32Å; W100-C110 HydrophobicContact CZ3-CB 4.08Å
111	S	81.3	Confident	83.7	Confident	11 Å²	11	49.6 Å²	49.6	8%	0.077	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.5	168.3	-164.3	0	0	0	0	108.2	E77	E77-S111 VanDerWaalsContact CD-OG 3.3Å; E77-S111 WeakPolarHBondContact CG-OG 3.4Å; E77-S111 VanDerWaalsContact OE1-CB 3.32Å; E77-S111 WeakPolarHBondContact OE1-CB 3.36Å; E77-S111 PolarHBondContact OE1-OG 3.48Å
112	V	74.8	Confident	83.7	Confident	23 Å²	23	52.3 Å²	52.3	14%	0.139	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.6	-179.8	-61.5	0	0	0	0	113.6	I74 L75 E77 A119	I74-V112 HydrophobicContact CG2-CG2 3.68Å; L75-V112 WeakPolarHBondContact O-CG2 3.41Å; L75-V112 PolarHBondContact O-N 2.96Å; E77-V112 PolarHBondContact N-O 2.87Å; V112-A119 HydrophobicContact CG1-CB 3.78Å; V112-A119 HydrophobicContact CG2-CB 4.17Å
113	K	65.8	Low	83.7	Confident	107 Å²	107	47 Å²	47	47%	0.465	23%	0.23	S	C	.	.	S	Bend	trans	-91.2	-23.7	170.7	-62.7	157.3	-165.8	154.7	0	112.1	E77 E98	E77-K113 HydrophobicContact CB-CG 4.14Å; E77-K113 HydrophobicContact CG-CG 4.3Å; E77-K113 WeakPolarHBondContact OE2-CE 3.39Å; E77-K113 WeakPolarHBondContact OE2-CG 3.37Å; E98-K113 IonicContact OE1-NZ 3.73Å
114	D	65.3	Low	83.6	Confident	88 Å²	88	47.2 Å²	47.2	47%	0.471	23%	0.231	S	C	.	.	S	Bend	trans	-89.4	178.7	179.5	-109.9	27.6	0	0	0	111.3	R118	D114-R118 WeakPolarHBondContact OD2-CD 3.33Å; D114-R118 IonicContact OD2-CZ 3.56Å; D114-R118 IonicContact OD2-NE 3.59Å; D114-R118 IonicContact OD2-NH1 2.68Å; D114-R118 PolarHBondContact OD2-NH1 2.86Å
115	S	74.8	Confident	83.6	Confident	58 Å²	58	41.7 Å²	41.7	41%	0.406	22%	0.216	S	C	.	.			trans	-62.8	141.3	-179.5	62.9	0	0	0	0	112.9	L117 R118 A119	S115-L117 PolarHBondContact O-N 3.06Å; S115-L117 VanDerWaalsContact O-N 3.08Å; S115-R118 PolarHBondContact O-N 3.23Å; S115-A119 PolarHBondContact O-N 3.27Å
116	G	78.2	Confident	83.5	Confident	15 Å²	15	44 Å²	44	16%	0.155	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-24.6	176.3	0	0	0	0	0	114.1	A119 I120	G116-A119 WeakPolarHBondContact O-CB 3.35Å; G116-A119 PolarHBondContact O-N 3.21Å; G116-I120 VanDerWaalsContact O-CG1 3.32Å; G116-I120 WeakPolarHBondContact O-CG1 3.28Å; G116-I120 PolarHBondContact O-N 2.85Å
117	L	80.2	Confident	83.4	Confident	34 Å²	34	47.2 Å²	47.2	18%	0.178	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-50.9	170.1	-73	176.8	0	0	0	112.4	S115 A119 I120 E121 M149 L156	S115-L117 PolarHBondContact O-N 3.06Å; S115-L117 VanDerWaalsContact O-N 3.08Å; L117-A119 PolarHBondContact O-N 3.48Å; L117-I120 CarbonylContact O-C 3.59Å; L117-I120 WeakPolarHBondContact O-CA 3.39Å; L117-I120 WeakPolarHBondContact O-CB 3.28Å; L117-I120 PolarHBondContact O-N 2.83Å; L117-E121 WeakPolarHBondContact O-CG 3.46Å; L117-E121 PolarHBondContact O-N 3.33Å; L117-M149 HydrophobicContact CD1-CB 3.9Å; L117-M149 HydrophobicContact CD1-CG 4.01Å; L117-M149 HydrophobicContact CD1-SD 3.68Å; L117-M149 HydrophobicContact CD2-CB 3.82Å; L117-M149 HydrophobicContact CD2-SD 4.39Å; L117-M149 HydrophobicContact CG-CB 4.1Å; L117-M149 HydrophobicContact CG-CG 4.41Å; L117-M149 HydrophobicContact CG-SD 3.73Å; L117-L156 HydrophobicContact CD2-CD1 3.83Å
118	R	81.9	Confident	83.1	Confident	132 Å²	132	49.6 Å²	49.6	50%	0.498	26%	0.257	S	S	.	.	H	α-helix	trans	-60.6	-33.3	177.5	-72	177.7	169.8	-172.9	-3.2	111.9	D114 S115 N122	D114-R118 WeakPolarHBondContact OD2-CD 3.33Å; D114-R118 IonicContact OD2-CZ 3.56Å; D114-R118 IonicContact OD2-NE 3.59Å; D114-R118 IonicContact OD2-NH1 2.68Å; D114-R118 PolarHBondContact OD2-NH1 2.86Å; S115-R118 PolarHBondContact O-N 3.23Å; R118-N122 WeakPolarHBondContact O-CB 3.29Å; R118-N122 PolarHBondContact O-N 3.1Å; R118-N122 VanDerWaalsContact O-N 3.1Å; R118-N122 PolarHBondContact O-ND2 2.9Å
119	A	85.3	Confident	83.1	Confident	6 Å²	6	53.8 Å²	53.8	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-45.5	172.7	0	0	0	0	0	111.2	I74 V112 S115 G116 L117 L123	I74-A119 HydrophobicContact CD1-CB 3.9Å; I74-A119 HydrophobicContact CG1-CB 4.1Å; I74-A119 HydrophobicContact CG2-CB 3.74Å; V112-A119 HydrophobicContact CG1-CB 3.78Å; V112-A119 HydrophobicContact CG2-CB 4.17Å; S115-A119 PolarHBondContact O-N 3.27Å; G116-A119 WeakPolarHBondContact O-CB 3.35Å; G116-A119 PolarHBondContact O-N 3.21Å; L117-A119 PolarHBondContact O-N 3.48Å; A119-L123 VanDerWaalsContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 2.9Å
120	I	87.6	Confident	83.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67.1	-46	177.6	-66.4	169.7	0	0	0	111.5	V44 I74 G116 L117 N122 L123 M124 I133 F150 L156 I160	V44-I120 HydrophobicContact CG1-CD1 4.3Å; I74-I120 HydrophobicContact CD1-CD1 4.3Å; I74-I120 HydrophobicContact CD1-CG1 3.48Å; I74-I120 VanDerWaalsContact CD1-CG1 3.48Å; G116-I120 VanDerWaalsContact O-CG1 3.32Å; G116-I120 WeakPolarHBondContact O-CG1 3.28Å; G116-I120 PolarHBondContact O-N 2.85Å; L117-I120 CarbonylContact O-C 3.59Å; L117-I120 WeakPolarHBondContact O-CA 3.39Å; L117-I120 WeakPolarHBondContact O-CB 3.28Å; L117-I120 PolarHBondContact O-N 2.83Å; I120-N122 VanDerWaalsContact C-N 3.31Å; I120-N122 PolarHBondContact O-N 3.04Å; I120-L123 CarbonylContact O-C 3.56Å; I120-L123 WeakPolarHBondContact O-CA 3.38Å; I120-L123 WeakPolarHBondContact O-CB 3.32Å; I120-L123 PolarHBondContact O-N 2.96Å; I120-M124 HydrophobicContact CG2-CG 4.29Å; I120-M124 WeakPolarHBondContact O-CG 3.37Å; I120-M124 PolarHBondContact O-N 2.8Å; I120-I133 HydrophobicContact CG1-CG2 4.4Å; I120-I133 HydrophobicContact CG2-CD1 4.22Å; I120-F150 HydrophobicContact CD1-CE1 3.77Å; I120-F150 HydrophobicContact CD1-CZ 3.64Å; I120-L156 HydrophobicContact CG2-CD2 4.14Å; I120-I160 HydrophobicContact CG2-CD1 3.57Å
121	E	86	Confident	83.7	Confident	79 Å²	79	57.2 Å²	57.2	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-53.4	-47	174.7	-68.7	157.7	-149.1	0	0	111.6	L117 L123 M124 L156	L117-E121 WeakPolarHBondContact O-CG 3.46Å; L117-E121 PolarHBondContact O-N 3.33Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-M124 PolarHBondContact O-N 2.94Å; E121-L156 HydrophobicContact CG-CD2 4.41Å
122	N	86.1	Confident	84.4	Confident	76 Å²	76	59 Å²	59	41%	0.406	30%	0.298	S	S	.	.	H	α-helix	trans	-74.5	-21.2	177.6	-72.9	-53.2	0	0	0	114	R118 I120 Q125 K126	R118-N122 WeakPolarHBondContact O-CB 3.29Å; R118-N122 PolarHBondContact O-N 3.1Å; R118-N122 VanDerWaalsContact O-N 3.1Å; R118-N122 PolarHBondContact O-ND2 2.9Å; I120-N122 VanDerWaalsContact C-N 3.31Å; I120-N122 PolarHBondContact O-N 3.04Å; N122-Q125 PolarHBondContact OD1-NE2 3.24Å; N122-Q125 VanDerWaalsContact OD1-NE2 3.11Å; N122-K126 PolarHBondContact O-NZ 2.95Å
123	L	88.3	Confident	85.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-76.6	-39.6	172	178.1	58.5	0	0	0	111.6	A72 W100 L108 A119 I120 E121 Q125 K126 F130 I133	A72-L123 HydrophobicContact CB-CD1 3.83Å; A72-L123 HydrophobicContact CB-CD2 3.49Å; A72-L123 VanDerWaalsContact CB-CD2 3.49Å; A72-L123 HydrophobicContact CB-CG 4.27Å; W100-L123 HydrophobicContact CD2-CD1 4.14Å; W100-L123 HydrophobicContact CE3-CD1 4.06Å; W100-L123 HydrophobicContact CH2-CB 4.03Å; W100-L123 HydrophobicContact CH2-CD1 3.76Å; W100-L123 HydrophobicContact CH2-CD2 3.74Å; W100-L123 HydrophobicContact CH2-CG 4.03Å; W100-L123 HydrophobicContact CZ2-CB 3.55Å; W100-L123 HydrophobicContact CZ2-CD1 3.88Å; W100-L123 HydrophobicContact CZ2-CD2 4.15Å; W100-L123 HydrophobicContact CZ2-CG 4.04Å; W100-L123 HydrophobicContact CZ3-CD1 3.86Å; W100-L123 HydrophobicContact CZ3-CD2 4.39Å; L108-L123 HydrophobicContact CD1-CD1 4Å; A119-L123 VanDerWaalsContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CB 3.3Å; A119-L123 PolarHBondContact O-N 2.9Å; I120-L123 CarbonylContact O-C 3.56Å; I120-L123 WeakPolarHBondContact O-CA 3.38Å; I120-L123 WeakPolarHBondContact O-CB 3.32Å; I120-L123 PolarHBondContact O-N 2.96Å; E121-L123 VanDerWaalsContact C-N 3.34Å; L123-Q125 PolarHBondContact O-N 3.11Å; L123-K126 WeakPolarHBondContact O-CA 3.49Å; L123-K126 WeakPolarHBondContact O-CB 3.26Å; L123-K126 PolarHBondContact O-N 3.21Å; L123-F130 HydrophobicContact CD1-CD1 3.69Å; L123-F130 HydrophobicContact CD1-CE1 3.46Å; L123-F130 VanDerWaalsContact CD1-CE1 3.46Å; L123-F130 HydrophobicContact CD1-CE2 4.43Å; L123-F130 HydrophobicContact CD1-CG 4.31Å; L123-F130 HydrophobicContact CD1-CZ 3.89Å; L123-F130 HydrophobicContact CD2-CD2 4.4Å; L123-F130 HydrophobicContact CD2-CE1 4.44Å; L123-F130 HydrophobicContact CD2-CE2 3.98Å; L123-F130 HydrophobicContact CD2-CZ 4.04Å; L123-F130 HydrophobicContact CG-CD1 4.25Å; L123-F130 HydrophobicContact CG-CE1 3.64Å; L123-F130 HydrophobicContact CG-CE2 3.99Å; L123-F130 HydrophobicContact CG-CZ 3.51Å; L123-F130 WeakPolarHBondContact O-CE1 3.29Å; L123-I133 HydrophobicContact CD2-CD1 3.8Å; L123-I133 HydrophobicContact CD2-CG1 3.86Å; L123-I133 HydrophobicContact CD2-CG2 4.11Å
124	M	88.1	Confident	86.7	Confident	31 Å²	31	53.2 Å²	53.2	15%	0.153	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-22.3	-179.2	-69.8	-55	-65.1	0	0	112.9	I42 I120 E121 K126 K127 F130 I133 D159 I160	I42-M124 HydrophobicContact CD1-CE 4.27Å; I42-M124 HydrophobicContact CD1-SD 4.24Å; I120-M124 HydrophobicContact CG2-CG 4.29Å; I120-M124 WeakPolarHBondContact O-CG 3.37Å; I120-M124 PolarHBondContact O-N 2.8Å; E121-M124 PolarHBondContact O-N 2.94Å; M124-K126 PolarHBondContact O-N 2.82Å; M124-K126 VanDerWaalsContact O-N 3.1Å; M124-K127 HydrophobicContact CE-CB 4.48Å; M124-K127 HydrophobicContact CE-CD 4.02Å; M124-K127 HydrophobicContact CE-CG 4.16Å; M124-K127 WeakPolarHBondContact O-CB 3.3Å; M124-K127 PolarHBondContact O-N 3.24Å; M124-K127 VanDerWaalsContact O-N 3.08Å; M124-F130 HydrophobicContact SD-CE2 4.37Å; M124-F130 HydrophobicContact SD-CZ 3.95Å; M124-I133 HydrophobicContact SD-CD1 4.38Å; M124-D159 HydrophobicContact CE-CB 3.87Å; M124-I160 HydrophobicContact CE-CG2 3.82Å; M124-I160 HydrophobicContact CG-CG2 4.34Å; M124-I160 HydrophobicContact SD-CG2 3.51Å; M124-I160 VanDerWaalsContact SD-CG2 3.51Å
125	Q	88.1	Confident	87.9	Confident	148 Å²	148	49.2 Å²	49.2	69%	0.692	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.7	166.8	-60.7	173.2	28	0	0	113.5	N122 L123	N122-Q125 PolarHBondContact OD1-NE2 3.24Å; N122-Q125 VanDerWaalsContact OD1-NE2 3.11Å; L123-Q125 PolarHBondContact O-N 3.11Å
126	K	88.4	Confident	88.7	Confident	78 Å²	78	47.2 Å²	47.2	34%	0.339	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	18	177.9	-52.8	-179.8	-175.8	69.1	0	112.5	W100 N122 L123 M124 G128 K129 F130	W100-K126 HydrophobicContact CB-CD 4.36Å; W100-K126 VanDerWaalsContact CD1-NZ 3.26Å; W100-K126 HydrophobicContact CG-CD 4.35Å; N122-K126 PolarHBondContact O-NZ 2.95Å; L123-K126 WeakPolarHBondContact O-CA 3.49Å; L123-K126 WeakPolarHBondContact O-CB 3.26Å; L123-K126 PolarHBondContact O-N 3.21Å; M124-K126 PolarHBondContact O-N 2.82Å; M124-K126 VanDerWaalsContact O-N 3.1Å; K126-G128 PolarHBondContact O-N 2.92Å; K126-K129 WeakPolarHBondContact O-CB 3.14Å; K126-K129 PolarHBondContact O-N 3.23Å; K126-F130 HydrophobicContact CB-CE1 4.39Å; K126-F130 WeakPolarHBondContact O-CE1 3.31Å
127	K	88.4	Confident	89	Confident	90 Å²	90	46.6 Å²	46.6	39%	0.391	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	135	-179.2	-169.3	-176.4	-173.1	-174.3	0	111.7	I42 M124 D159	I42-K127 HydrophobicContact CD1-CG 4.12Å; M124-K127 HydrophobicContact CE-CB 4.48Å; M124-K127 HydrophobicContact CE-CD 4.02Å; M124-K127 HydrophobicContact CE-CG 4.16Å; M124-K127 WeakPolarHBondContact O-CB 3.3Å; M124-K127 PolarHBondContact O-N 3.24Å; M124-K127 VanDerWaalsContact O-N 3.08Å; K127-D159 WeakPolarHBondContact CE-OD2 3.28Å; K127-D159 IonicContact NZ-OD1 3.61Å; K127-D159 PolarHBondContact NZ-OD1 3.38Å; K127-D159 IonicContact NZ-OD2 3.73Å; K127-D159 PolarHBondContact NZ-OD2 2.8Å
128	G	89.3	Confident	88.7	Confident	50 Å²	50	46 Å²	46	52%	0.515	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-9.4	-176.2	0	0	0	0	0	115	R70 K126	R70-G128 PolarHBondContact NH1-O 3.15Å; R70-G128 PolarHBondContact NH2-O 2.94Å; R70-G128 VanDerWaalsContact NH2-O 3.15Å; K126-G128 PolarHBondContact O-N 2.92Å
129	K	91.8	Very high	88.2	Confident	95 Å²	95	40.5 Å²	40.5	41%	0.413	21%	0.209	S	C	.	.	S	Bend	trans	-76.5	-27.4	163.1	-83.3	-71.9	-161.7	143.1	0	113.3	R70 E102 L108 K126	R70-K129 WeakPolarHBondContact CD-O 3.34Å; R70-K129 PolarHBondContact NH1-O 3.49Å; R70-K129 VanDerWaalsContact NH1-O 3.1Å; E102-K129 IonicContact OE1-NZ 2.67Å; E102-K129 PolarHBondContact OE1-NZ 3.13Å; E102-K129 IonicContact OE2-NZ 2.61Å; E102-K129 PolarHBondContact OE2-NZ 2.87Å; L108-K129 HydrophobicContact CD1-CB 4.2Å; K126-K129 WeakPolarHBondContact O-CB 3.14Å; K126-K129 PolarHBondContact O-N 3.23Å
130	F	93.9	Very high	87.4	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.013	25%	0.245	C	C	.	.			trans	-130.9	157	-177	60.6	-80.7	0	0	0	110.3	I42 R70 A72 L108 L123 M124 K126 I133	I42-F130 HydrophobicContact CD1-CD2 4.04Å; I42-F130 HydrophobicContact CD1-CE2 3.36Å; I42-F130 HydrophobicContact CD1-CZ 3.79Å; I42-F130 HydrophobicContact CG2-CD2 4.23Å; I42-F130 HydrophobicContact CG2-CE2 4.04Å; R70-F130 CarbonylContact O-C 3.55Å; R70-F130 VanDerWaalsContact O-CA 3.31Å; R70-F130 WeakPolarHBondContact O-CA 3.4Å; R70-F130 WeakPolarHBondContact O-CB 3.43Å; A72-F130 HydrophobicContact CB-CB 3.91Å; A72-F130 HydrophobicContact CB-CD1 4.46Å; A72-F130 HydrophobicContact CB-CD2 3.92Å; A72-F130 HydrophobicContact CB-CG 3.83Å; L108-F130 HydrophobicContact CD1-CB 4.3Å; L108-F130 HydrophobicContact CD1-CD1 3.94Å; L108-F130 HydrophobicContact CD1-CG 4.47Å; L123-F130 HydrophobicContact CD1-CD1 3.69Å; L123-F130 HydrophobicContact CD1-CE1 3.46Å; L123-F130 VanDerWaalsContact CD1-CE1 3.46Å; L123-F130 HydrophobicContact CD1-CE2 4.43Å; L123-F130 HydrophobicContact CD1-CG 4.31Å; L123-F130 HydrophobicContact CD1-CZ 3.89Å; L123-F130 HydrophobicContact CD2-CD2 4.4Å; L123-F130 HydrophobicContact CD2-CE1 4.44Å; L123-F130 HydrophobicContact CD2-CE2 3.98Å; L123-F130 HydrophobicContact CD2-CZ 4.04Å; L123-F130 HydrophobicContact CG-CD1 4.25Å; L123-F130 HydrophobicContact CG-CE1 3.64Å; L123-F130 HydrophobicContact CG-CE2 3.99Å; L123-F130 HydrophobicContact CG-CZ 3.51Å; L123-F130 WeakPolarHBondContact O-CE1 3.29Å; M124-F130 HydrophobicContact SD-CE2 4.37Å; M124-F130 HydrophobicContact SD-CZ 3.95Å; K126-F130 HydrophobicContact CB-CE1 4.39Å; K126-F130 WeakPolarHBondContact O-CE1 3.31Å; F130-I133 HydrophobicContact CD2-CG1 4.03Å; F130-I133 HydrophobicContact CE2-CD1 3.9Å; F130-I133 HydrophobicContact CE2-CG1 3.7Å
131	D	93.9	Very high	86.9	Confident	78 Å²	78	49.2 Å²	49.2	42%	0.417	26%	0.259	S	S	.	.	S	Bend	trans	-115.8	-10.9	-174.8	-51.8	-60.1	0	0	0	112.8	R70	R70-D131 VanDerWaalsContact CB-OD2 3.27Å; R70-D131 WeakPolarHBondContact CB-OD2 3.43Å; R70-D131 WeakPolarHBondContact CG-OD2 3.32Å; R70-D131 IonicContact CZ-OD1 2.66Å; R70-D131 IonicContact CZ-OD2 3.54Å; R70-D131 PolarHBondContact N-OD2 3.22Å; R70-D131 IonicContact NE-OD1 3.8Å; R70-D131 IonicContact NE-OD2 2.69Å; R70-D131 PolarHBondContact NE-OD2 3.45Å; R70-D131 IonicContact NH2-OD1 2.84Å; R70-D131 PolarHBondContact NH2-OD1 3.1Å; R70-D131 IonicContact NH2-OD2 2.63Å; R70-D131 PolarHBondContact O-N 2.66Å
132	Y	95.3	Very high	86.7	Confident	47 Å²	47	50.1 Å²	50.1	18%	0.184	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	142.6	-171.8	-159.6	-82.4	0	0	0	109.6	P43 T45 V71 A72 L134 D163	P43-Y132 HydrophobicContact CB-CD2 3.95Å; P43-Y132 HydrophobicContact CB-CE2 3.68Å; P43-Y132 HydrophobicContact CG-CD2 3.25Å; P43-Y132 HydrophobicContact CG-CE2 3.49Å; P43-Y132 VanDerWaalsContact CG-CE2 3.49Å; P43-Y132 HydrophobicContact CG-CG 4Å; T45-Y132 WeakPolarHBondContact CB-OH 3.26Å; T45-Y132 PolarHBondContact OG1-OH 2.91Å; V71-Y132 HydrophobicContact CG1-CD1 4.29Å; A72-Y132 PolarHBondContact N-O 2.92Å; Y132-L134 HydrophobicContact CE1-CD1 4.25Å; Y132-D163 PolarHBondContact OH-OD2 2.87Å
133	I	94.4	Very high	86.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.1	174.3	-52.1	179.1	0	0	0	109.8	I42 P43 V44 T45 A72 I74 I120 L123 M124 F130 I160	I42-I133 HydrophobicContact CG2-CD1 4.39Å; I42-I133 HydrophobicContact CG2-CG1 3.92Å; P43-I133 PolarHBondContact O-N 2.83Å; V44-I133 WeakPolarHBondContact CA-O 3.39Å; V44-I133 HydrophobicContact CB-CB 4.29Å; V44-I133 HydrophobicContact CG1-CB 4.02Å; V44-I133 HydrophobicContact CG1-CG2 3.94Å; V44-I133 HydrophobicContact CG2-CB 3.98Å; V44-I133 HydrophobicContact CG2-CD1 3.97Å; V44-I133 HydrophobicContact CG2-CG1 4.34Å; T45-I133 PolarHBondContact N-O 2.68Å; A72-I133 WeakPolarHBondContact O-CA 2.87Å; I74-I133 HydrophobicContact CD1-CG2 3.94Å; I120-I133 HydrophobicContact CG1-CG2 4.4Å; I120-I133 HydrophobicContact CG2-CD1 4.22Å; L123-I133 HydrophobicContact CD2-CD1 3.8Å; L123-I133 HydrophobicContact CD2-CG1 3.86Å; L123-I133 HydrophobicContact CD2-CG2 4.11Å; M124-I133 HydrophobicContact SD-CD1 4.38Å; F130-I133 HydrophobicContact CD2-CG1 4.03Å; F130-I133 HydrophobicContact CE2-CD1 3.9Å; F130-I133 HydrophobicContact CE2-CG1 3.7Å; I133-I160 HydrophobicContact CD1-CG2 4.33Å
134	L	94.8	Very high	86.5	Confident	9 Å²	9	49.7 Å²	49.7	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	110.2	178.1	-161.9	67.6	0	0	0	109.8	T45 I47 L59 I62 V71 A72 V73 I74 Y132	T45-L134 HydrophobicContact CG2-CD1 3.88Å; I47-L134 HydrophobicContact CD1-CD1 3.74Å; I47-L134 HydrophobicContact CD1-CD2 3.75Å; I47-L134 HydrophobicContact CD1-CG 3.86Å; I47-L134 HydrophobicContact CG1-CD1 3.82Å; I47-L134 HydrophobicContact CG1-CG 4.2Å; L59-L134 HydrophobicContact CD2-CD2 3.68Å; L59-L134 HydrophobicContact CD2-CG 4.36Å; I62-L134 HydrophobicContact CD1-CD2 3.53Å; I62-L134 HydrophobicContact CG2-CD2 4.44Å; V71-L134 HydrophobicContact CG1-CB 3.86Å; V71-L134 HydrophobicContact CG1-CD2 4.43Å; A72-L134 PolarHBondContact O-N 2.71Å; V73-L134 CarbonylContact C-O 3.56Å; V73-L134 WeakPolarHBondContact CA-O 3.49Å; V73-L134 HydrophobicContact CG2-CB 4.23Å; V73-L134 HydrophobicContact CG2-CD2 4.25Å; I74-L134 PolarHBondContact N-O 2.81Å; Y132-L134 HydrophobicContact CE1-CD1 4.25Å
135	L	92	Very high	86.3	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.5	-178	176	58.1	0	0	0	110	T45 I46 I47 I74 V146	T45-L135 PolarHBondContact O-N 3.15Å; I46-L135 CarbonylContact C-O 3.59Å; I46-L135 WeakPolarHBondContact CA-O 3.24Å; I46-L135 HydrophobicContact CG1-CD2 4.49Å; I47-L135 PolarHBondContact N-O 3.41Å; I74-L135 HydrophobicContact CB-CD1 3.77Å; I74-L135 HydrophobicContact CD1-CD1 4.33Å; I74-L135 HydrophobicContact CG2-CD1 3.58Å; L135-V146 HydrophobicContact CD2-CG1 3.65Å
136	E	90.2	Very high	86	Confident	17 Å²	17	44.6 Å²	44.6	8%	0.079	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.3	166.6	-161.9	-152.5	-173.6	0	0	110.1	K55 L59 I74 N76	K55-E136 HydrophobicContact CD-CG 4.5Å; K55-E136 WeakPolarHBondContact CE-OE1 3.32Å; K55-E136 IonicContact NZ-OE1 2.83Å; L59-E136 HydrophobicContact CD1-CB 4.13Å; L59-E136 HydrophobicContact CD1-CG 3.95Å; I74-E136 PolarHBondContact O-N 2.84Å; N76-E136 VanDerWaalsContact CB-O 3.32Å; N76-E136 WeakPolarHBondContact CB-O 3.12Å; N76-E136 PolarHBondContact ND2-O 3.36Å
137	T	84.3	Confident	85.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	25%	0.25	C	C	.	.			trans	-112.9	140.3	162.1	54.6	0	0	0	0	109.2	I46 I47 T48 K55 V146	I46-T137 HydrophobicContact CG2-CG2 3.71Å; I47-T137 PolarHBondContact O-N 2.77Å; I47-T137 PolarHBondContact O-OG1 3.47Å; T48-T137 WeakPolarHBondContact CB-OG1 3.45Å; T48-T137 PolarHBondContact OG1-OG1 3.11Å; K55-T137 WeakPolarHBondContact CE-O 3.18Å; T137-V146 HydrophobicContact CG2-CB 4.41Å; T137-V146 HydrophobicContact CG2-CG1 4.28Å; T137-V146 HydrophobicContact CG2-CG2 3.98Å
138	T	74.7	Confident	85.6	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.141	25%	0.251	C	S	.	.			trans	-68.8	158.6	-178.2	64.8	0	0	0	0	110.7	N76 F78 L140 A141	N76-T138 HydrophobicContact CB-CG2 4.34Å; N76-T138 VanDerWaalsContact O-CG2 3.3Å; N76-T138 WeakPolarHBondContact O-CG2 3.32Å; F78-T138 HydrophobicContact CB-CG2 3.73Å; T138-L140 PolarHBondContact O-N 2.7Å; T138-A141 PolarHBondContact O-N 3.29Å
139	G	70.3	Confident	85	Confident	15 Å²	15	41 Å²	41	16%	0.155	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	8.9	-170.1	0	0	0	0	0	116.7	G49	G49-G139 WeakPolarHBondContact O-CA 3.24Å
140	L	70.1	Confident	84.4	Confident	155 Å²	155	37.9 Å²	37.9	81%	0.812	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.1	-3.5	175.4	-61	176.3	0	0	0	112.5	Y50 T138	Y50-L140 HydrophobicContact CE2-CD2 4.04Å; T138-L140 PolarHBondContact O-N 2.7Å
141	A	77.3	Confident	83.2	Confident	34 Å²	34	49 Å²	49	28%	0.281	27%	0.271	S	S	.	.	S	Bend	trans	-79.1	137.3	176.9	0	0	0	0	0	110.1	T138 P143	T138-A141 PolarHBondContact O-N 3.29Å; A141-P143 VanDerWaalsContact O-CD 3.28Å; A141-P143 WeakPolarHBondContact O-CD 3.4Å
142	D	82	Confident	81.7	Confident	99 Å²	99	51.1 Å²	51.1	53%	0.529	29%	0.286	S	S	.	.			trans	-71.7	115.2	171.3	172	30.2	0	0	0	110	G144 A145 V146	D142-G144 PolarHBondContact O-N 2.96Å; D142-G144 WeakPolarHBondContact OD1-CA 3.48Å; D142-G144 PolarHBondContact OD1-N 3.08Å; D142-A145 HydrophobicContact CB-CB 4.18Å; D142-A145 WeakPolarHBondContact OD2-CB 3.19Å; D142-A145 PolarHBondContact OD2-N 2.77Å; D142-V146 PolarHBondContact O-N 3.05Å
143	P	83.5	Confident	80.2	Confident	31 Å²	31	51.3 Å²	51.3	20%	0.201	29%	0.29	C	S	.	.	H	α-helix	trans	-69.8	-19.5	175.9	33	-37.7	0	0	0	111.9	I46 T48 A141 V146 A147 I165	I46-P143 HydrophobicContact CG2-CB 4.25Å; T48-P143 HydrophobicContact CG2-CB 4.34Å; T48-P143 HydrophobicContact CG2-CG 4.27Å; A141-P143 VanDerWaalsContact O-CD 3.28Å; A141-P143 WeakPolarHBondContact O-CD 3.4Å; P143-V146 PolarHBondContact O-N 3.07Å; P143-A147 WeakPolarHBondContact O-CB 3.32Å; P143-A147 PolarHBondContact O-N 3.17Å; P143-I165 HydrophobicContact CB-CD1 4.38Å; P143-I165 HydrophobicContact CB-CG2 3.78Å; P143-I165 HydrophobicContact CG-CG2 4.29Å
144	G	85.8	Confident	78.3	Confident	36 Å²	36	55.4 Å²	55.4	37%	0.371	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-48.1	175	0	0	0	0	0	112.3	D142 V146 A147 S148	D142-G144 PolarHBondContact O-N 2.96Å; D142-G144 WeakPolarHBondContact OD1-CA 3.48Å; D142-G144 PolarHBondContact OD1-N 3.08Å; G144-V146 VanDerWaalsContact C-N 3.32Å; G144-V146 PolarHBondContact O-N 2.8Å; G144-A147 PolarHBondContact O-N 3.37Å; G144-S148 WeakPolarHBondContact O-CB 3.46Å; G144-S148 PolarHBondContact O-N 3.42Å
145	A	83.1	Confident	76.4	Confident	44 Å²	44	63 Å²	63	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-54.6	-46.4	171.6	0	0	0	0	0	111.9	D142 S148	D142-A145 HydrophobicContact CB-CB 4.18Å; D142-A145 WeakPolarHBondContact OD2-CB 3.19Å; D142-A145 PolarHBondContact OD2-N 2.77Å; A145-S148 PolarHBondContact O-N 3.19Å; A145-S148 PolarHBondContact O-OG 2.99Å
146	V	81.9	Confident	74.9	Confident	27 Å²	27	63.9 Å²	63.9	16%	0.164	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-44.4	177.4	-178.6	0	0	0	0	111.6	I46 L135 T137 D142 P143 G144 S148 M149 F150	I46-V146 HydrophobicContact CD1-CB 4.11Å; I46-V146 HydrophobicContact CD1-CG1 3.75Å; I46-V146 HydrophobicContact CG1-CG1 4.35Å; L135-V146 HydrophobicContact CD2-CG1 3.65Å; T137-V146 HydrophobicContact CG2-CB 4.41Å; T137-V146 HydrophobicContact CG2-CG1 4.28Å; T137-V146 HydrophobicContact CG2-CG2 3.98Å; D142-V146 PolarHBondContact O-N 3.05Å; P143-V146 PolarHBondContact O-N 3.07Å; G144-V146 VanDerWaalsContact C-N 3.32Å; G144-V146 PolarHBondContact O-N 2.8Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 2.76Å; V146-M149 WeakPolarHBondContact O-CB 3.46Å; V146-M149 PolarHBondContact O-N 2.92Å; V146-F150 HydrophobicContact CG1-CE2 4.39Å; V146-F150 WeakPolarHBondContact O-CD2 3.05Å
147	A	85.9	Confident	73.2	Confident	17 Å²	17	64.2 Å²	64.2	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-61	-37.4	177.2	0	0	0	0	0	112.9	I46 P143 G144 M149 F150 L162 I165	I46-A147 HydrophobicContact CD1-CB 4.13Å; P143-A147 WeakPolarHBondContact O-CB 3.32Å; P143-A147 PolarHBondContact O-N 3.17Å; G144-A147 PolarHBondContact O-N 3.37Å; A147-M149 PolarHBondContact O-N 3.48Å; A147-F150 PolarHBondContact O-N 2.74Å; A147-L162 HydrophobicContact CB-CD2 3.63Å; A147-I165 HydrophobicContact CB-CD1 3.9Å
148	S	82.7	Confident	72.3	Confident	61 Å²	61	67.7 Å²	67.7	43%	0.427	40%	0.396	S	S	.	.	H	α-helix	trans	-59.6	-28	179.5	77.7	0	0	0	0	113.3	G144 A145 V146 F150 W151 V152	G144-S148 WeakPolarHBondContact O-CB 3.46Å; G144-S148 PolarHBondContact O-N 3.42Å; A145-S148 PolarHBondContact O-N 3.19Å; A145-S148 PolarHBondContact O-OG 2.99Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 2.76Å; S148-F150 VanDerWaalsContact C-N 3.32Å; S148-F150 PolarHBondContact O-N 3.39Å; S148-W151 WeakPolarHBondContact O-CB 3.34Å; S148-W151 PolarHBondContact O-N 3.36Å; S148-V152 PolarHBondContact O-N 3.17Å; S148-V152 VanDerWaalsContact O-N 3.13Å
149	M	77.6	Confident	72.7	Confident	66 Å²	66	69 Å²	69	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-64.4	-38.2	-178.7	-58.8	172.3	-177.1	0	0	111.7	L117 V146 A147 W151 V152 D153	L117-M149 HydrophobicContact CD1-CB 3.9Å; L117-M149 HydrophobicContact CD1-CG 4.01Å; L117-M149 HydrophobicContact CD1-SD 3.68Å; L117-M149 HydrophobicContact CD2-CB 3.82Å; L117-M149 HydrophobicContact CD2-SD 4.39Å; L117-M149 HydrophobicContact CG-CB 4.1Å; L117-M149 HydrophobicContact CG-CG 4.41Å; L117-M149 HydrophobicContact CG-SD 3.73Å; V146-M149 WeakPolarHBondContact O-CB 3.46Å; V146-M149 PolarHBondContact O-N 2.92Å; A147-M149 PolarHBondContact O-N 3.48Å; M149-W151 PolarHBondContact O-N 2.94Å; M149-V152 PolarHBondContact O-N 3.25Å; M149-D153 PolarHBondContact O-N 2.97Å
150	F	77.8	Confident	73.6	Confident	28 Å²	28	68.5 Å²	68.5	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-68.1	-11.8	175.5	-60.2	-89.6	0	0	0	113.6	V44 I46 I120 V146 A147 S148 I160 L162	V44-F150 HydrophobicContact CB-CE1 3.98Å; V44-F150 HydrophobicContact CB-CZ 4.31Å; V44-F150 HydrophobicContact CG1-CE1 3.88Å; V44-F150 HydrophobicContact CG1-CZ 3.77Å; V44-F150 HydrophobicContact CG2-CE1 3.92Å; I46-F150 HydrophobicContact CD1-CE2 4.32Å; I120-F150 HydrophobicContact CD1-CE1 3.77Å; I120-F150 HydrophobicContact CD1-CZ 3.64Å; V146-F150 HydrophobicContact CG1-CE2 4.39Å; V146-F150 WeakPolarHBondContact O-CD2 3.05Å; A147-F150 PolarHBondContact O-N 2.74Å; S148-F150 VanDerWaalsContact C-N 3.32Å; S148-F150 PolarHBondContact O-N 3.39Å; F150-I160 HydrophobicContact CD1-CD1 4Å; F150-I160 HydrophobicContact CD1-CG1 4.49Å; F150-I160 HydrophobicContact CE1-CD1 3.87Å; F150-L162 HydrophobicContact CB-CB 4.18Å; F150-L162 HydrophobicContact CD2-CD1 4.32Å; F150-L162 HydrophobicContact CE2-CD1 4.44Å; F150-L162 HydrophobicContact CG-CB 4.27Å
151	W	70.2	Confident	74.4	Confident	237 Å²	237	66 Å²	66	90%	0.898	38%	0.377	S	S	*	.	H	α-helix	trans	-97.4	-30.7	174.7	-164.6	-74.6	0	0	0	112.5	S148 M149	S148-W151 WeakPolarHBondContact O-CB 3.34Å; S148-W151 PolarHBondContact O-N 3.36Å; M149-W151 PolarHBondContact O-N 2.94Å
152	V	61.3	Low	75.1	Confident	122 Å²	122	67.1 Å²	67.1	74%	0.739	38%	0.378	S	S	*	.	H	α-helix	trans	-79.4	-37.2	179.5	174.3	0	0	0	0	111.4	S148 M149 A154	S148-V152 PolarHBondContact O-N 3.17Å; S148-V152 VanDerWaalsContact O-N 3.13Å; M149-V152 PolarHBondContact O-N 3.25Å; V152-A154 PolarHBondContact O-N 3.43Å
153	D	63.4	Low	75.6	Confident	51 Å²	51	66 Å²	66	27%	0.273	37%	0.372	S	S	.	.			trans	-89.2	95.3	-176.7	-160.2	-50.9	0	0	0	112.5	M149 E155 L156 G157	M149-D153 PolarHBondContact O-N 2.97Å; D153-E155 VanDerWaalsContact C-N 3.29Å; D153-E155 PolarHBondContact O-N 3.12Å; D153-E155 PolarHBondContact OD1-N 2.57Å; D153-L156 HydrophobicContact CB-CB 4.11Å; D153-L156 HydrophobicContact CB-CD1 3.99Å; D153-L156 HydrophobicContact CB-CG 4.4Å; D153-L156 PolarHBondContact OD1-N 2.63Å; D153-G157 PolarHBondContact O-N 3.49Å
154	A	55.3	Low	76.1	Confident	87 Å²	87	65.7 Å²	65.7	72%	0.719	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.8	178	0	0	0	0	0	114	V152	V152-A154 PolarHBondContact O-N 3.43Å
155	E	55.2	Low	76.5	Confident	169 Å²	169	67.5 Å²	67.5	79%	0.79	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-46.6	177.1	-65.2	-170.1	115.7	0	0	109.8	D153 G157 S158	D153-E155 VanDerWaalsContact C-N 3.29Å; D153-E155 PolarHBondContact O-N 3.12Å; D153-E155 PolarHBondContact OD1-N 2.57Å; E155-G157 VanDerWaalsContact C-N 3.32Å; E155-G157 PolarHBondContact O-N 2.88Å; E155-S158 WeakPolarHBondContact O-CB 3.18Å; E155-S158 PolarHBondContact O-N 3.25Å; E155-S158 PolarHBondContact O-OG 3.06Å
156	L	59.8	Low	77.1	Confident	21 Å²	21	69.5 Å²	69.5	11%	0.11	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-57.6	-44.9	165.1	-77.7	170.2	0	0	0	111.3	L117 I120 E121 D153 S158 D159 I160	L117-L156 HydrophobicContact CD2-CD1 3.83Å; I120-L156 HydrophobicContact CG2-CD2 4.14Å; E121-L156 HydrophobicContact CG-CD2 4.41Å; D153-L156 HydrophobicContact CB-CB 4.11Å; D153-L156 HydrophobicContact CB-CD1 3.99Å; D153-L156 HydrophobicContact CB-CG 4.4Å; D153-L156 PolarHBondContact OD1-N 2.63Å; L156-S158 PolarHBondContact O-N 3.15Å; L156-D159 PolarHBondContact O-N 3.41Å; L156-I160 HydrophobicContact CB-CD1 4.18Å; L156-I160 HydrophobicContact CB-CG1 4.36Å; L156-I160 HydrophobicContact CD2-CD1 4.02Å; L156-I160 PolarHBondContact O-N 3.03Å; L156-I160 VanDerWaalsContact O-N 3.16Å
157	G	54.9	Low	77.5	Confident	24 Å²	24	71.5 Å²	71.5	25%	0.247	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-60.9	-5.9	-179.3	0	0	0	0	0	115.5	K41 D153 E155	K41-G157 PolarHBondContact NZ-O 3.29Å; D153-G157 PolarHBondContact O-N 3.49Å; E155-G157 VanDerWaalsContact C-N 3.32Å; E155-G157 PolarHBondContact O-N 2.88Å
158	S	66.1	Low	77.8	Confident	74 Å²	74	72.5 Å²	72.5	52%	0.517	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-71.9	-35.7	168.7	67.6	0	0	0	0	113	K41 E155 L156	K41-S158 VanDerWaalsContact CE-O 3.24Å; K41-S158 WeakPolarHBondContact CE-O 3.49Å; E155-S158 WeakPolarHBondContact O-CB 3.18Å; E155-S158 PolarHBondContact O-N 3.25Å; E155-S158 PolarHBondContact O-OG 3.06Å; L156-S158 PolarHBondContact O-N 3.15Å
159	D	83.2	Confident	78.2	Confident	52 Å²	52	74 Å²	74	28%	0.278	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-15.9	-160	-117.7	9.3	0	0	0	113.9	K41 I42 M124 K127 L156	K41-D159 CarbonylContact C-O 3.59Å; K41-D159 VanDerWaalsContact CA-O 3.3Å; K41-D159 WeakPolarHBondContact CA-O 3.3Å; I42-D159 PolarHBondContact N-O 3.06Å; M124-D159 HydrophobicContact CE-CB 3.87Å; K127-D159 WeakPolarHBondContact CE-OD2 3.28Å; K127-D159 IonicContact NZ-OD1 3.61Å; K127-D159 PolarHBondContact NZ-OD1 3.38Å; K127-D159 IonicContact NZ-OD2 3.73Å; K127-D159 PolarHBondContact NZ-OD2 2.8Å; L156-D159 PolarHBondContact O-N 3.41Å
160	I	87.6	Confident	78.8	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.015	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	167.6	173	72.6	-178.5	0	0	0	111.1	I42 V44 I120 M124 I133 F150 L156	I42-I160 HydrophobicContact CB-CG2 4.27Å; I42-I160 VanDerWaalsContact O-CA 3.24Å; I42-I160 WeakPolarHBondContact O-CA 3.46Å; I42-I160 WeakPolarHBondContact O-CB 3.27Å; V44-I160 HydrophobicContact CG2-CB 4.05Å; V44-I160 HydrophobicContact CG2-CD1 4.11Å; V44-I160 HydrophobicContact CG2-CG1 4.39Å; I120-I160 HydrophobicContact CG2-CD1 3.57Å; M124-I160 HydrophobicContact CE-CG2 3.82Å; M124-I160 HydrophobicContact CG-CG2 4.34Å; M124-I160 HydrophobicContact SD-CG2 3.51Å; M124-I160 VanDerWaalsContact SD-CG2 3.51Å; I133-I160 HydrophobicContact CD1-CG2 4.33Å; F150-I160 HydrophobicContact CD1-CD1 4Å; F150-I160 HydrophobicContact CD1-CG1 4.49Å; F150-I160 HydrophobicContact CE1-CD1 3.87Å; L156-I160 HydrophobicContact CB-CD1 4.18Å; L156-I160 HydrophobicContact CB-CG1 4.36Å; L156-I160 HydrophobicContact CD2-CD1 4.02Å; L156-I160 PolarHBondContact O-N 3.03Å; L156-I160 VanDerWaalsContact O-N 3.16Å
161	Y	88.4	Confident	79.4	Confident	102 Å²	102	77.9 Å²	77.9	40%	0.4	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.6	168.5	70.7	-80.3	0	0	0	111.7	K41 I42 P43 V44 D163	K41-Y161 HydrophobicContact CB-CD1 3.76Å; K41-Y161 HydrophobicContact CB-CE1 4.33Å; I42-Y161 PolarHBondContact O-N 3.5Å; I42-Y161 VanDerWaalsContact O-N 3.07Å; P43-Y161 HydrophobicContact CB-CE1 3.89Å; P43-Y161 HydrophobicContact CB-CE2 4.33Å; V44-Y161 PolarHBondContact N-O 3.15Å; Y161-D163 HydrophobicContact CD2-CB 4.5Å; Y161-D163 HydrophobicContact CE2-CB 3.95Å; Y161-D163 PolarHBondContact O-N 3.3Å; Y161-D163 PolarHBondContact OH-OD1 3.1Å
162	L	90.6	Very high	80.3	Confident	58 Å²	58	73 Å²	73	30%	0.304	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	113.1	169.8	-178.1	69.4	0	0	0	109.1	I46 A147 F150	I46-L162 HydrophobicContact CD1-CD1 3.79Å; I46-L162 HydrophobicContact CG1-CD1 3.99Å; A147-L162 HydrophobicContact CB-CD2 3.63Å; F150-L162 HydrophobicContact CB-CB 4.18Å; F150-L162 HydrophobicContact CD2-CD1 4.32Å; F150-L162 HydrophobicContact CE2-CD1 4.44Å; F150-L162 HydrophobicContact CG-CB 4.27Å
163	D	93.9	Very high	81.5	Confident	77 Å²	77	72.7 Å²	72.7	41%	0.412	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-42.8	-179.7	-172.1	59.1	0	0	0	110.9	P43 V44 T45 Y132 Y161	P43-D163 HydrophobicContact CB-CB 3.67Å; V44-D163 PolarHBondContact O-N 3.21Å; T45-D163 PolarHBondContact OG1-OD2 2.84Å; Y132-D163 PolarHBondContact OH-OD2 2.87Å; Y161-D163 HydrophobicContact CD2-CB 4.5Å; Y161-D163 HydrophobicContact CE2-CB 3.95Å; Y161-D163 PolarHBondContact O-N 3.3Å; Y161-D163 PolarHBondContact OH-OD1 3.1Å
164	G	93.6	Very high	82.3	Confident	23 Å²	23	71.2 Å²	71.2	24%	0.237	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	178	176.3	0	0	0	0	0	115.4	T45 I46	T45-G164 WeakPolarHBondContact CA-O 3.27Å; I46-G164 PolarHBondContact N-O 3.3Å
165	I	93.6	Very high	83.5	Confident	74 Å²	74	75.8 Å²	75.8	38%	0.379	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	112.8	174	-52.2	177.3	0	0	0	107.6	I46 T48 P143 A147	I46-I165 HydrophobicContact CB-CG1 4.35Å; I46-I165 HydrophobicContact CB-CG2 4.35Å; I46-I165 HydrophobicContact CD1-CG1 4.37Å; I46-I165 HydrophobicContact CG2-CG2 4.28Å; I46-I165 CarbonylContact O-C 3.51Å; I46-I165 WeakPolarHBondContact O-CA 3.24Å; T48-I165 HydrophobicContact CG2-CG2 4.2Å; P143-I165 HydrophobicContact CB-CD1 4.38Å; P143-I165 HydrophobicContact CB-CG2 3.78Å; P143-I165 HydrophobicContact CG-CG2 4.29Å; A147-I165 HydrophobicContact CB-CD1 3.9Å
166	I	95	Very high	84.4	Confident	86 Å²	86	74.8 Å²	74.8	44%	0.441	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	109.7	-179.8	-61.2	-179.9	0	0	0	109	T45 I46 I47 T48 I168	T45-I166 HydrophobicContact CG2-CB 4.44Å; T45-I166 HydrophobicContact CG2-CD1 3.73Å; T45-I166 HydrophobicContact CG2-CG1 3.82Å; I46-I166 PolarHBondContact O-N 2.84Å; I47-I166 WeakPolarHBondContact CA-O 3.34Å; I47-I166 HydrophobicContact CG1-CB 4.43Å; T48-I166 PolarHBondContact N-O 3.19Å; I166-I168 HydrophobicContact CG2-CG1 4.45Å
167	T	92.3	Very high	84.8	Confident	70 Å²	70	75.1 Å²	75.1	43%	0.429	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	113.3	174	-56.5	0	0	0	0	110.1	T48 V169	T48-T167 HydrophobicContact CG2-CG2 4.11Å; T48-T167 VanDerWaalsContact CG2-OG1 3.24Å; T48-T167 WeakPolarHBondContact CG2-OG1 3.49Å; T167-V169 HydrophobicContact CG2-CG2 4Å
168	I	91.9	Very high	84.8	Confident	38 Å²	38	81.8 Å²	81.8	20%	0.195	43%	0.43	C	S	.	.			trans	-86	129.8	174.1	-40.9	-173.6	0	0	0	109.8	I47 T48 G49 A53 K55 L58 I166	I47-I168 HydrophobicContact CG2-CD1 3.99Å; I47-I168 HydrophobicContact CG2-CG1 4.19Å; T48-I168 PolarHBondContact O-N 3.26Å; G49-I168 WeakPolarHBondContact CA-O 3.29Å; A53-I168 WeakPolarHBondContact CB-O 3.37Å; A53-I168 WeakPolarHBondContact O-CG2 3.3Å; K55-I168 HydrophobicContact CB-CD1 4.38Å; K55-I168 HydrophobicContact CG-CD1 4.05Å; K55-I168 HydrophobicContact CG-CG1 4.4Å; L58-I168 HydrophobicContact CB-CD1 4.33Å; L58-I168 HydrophobicContact CD2-CD1 3.7Å; I166-I168 HydrophobicContact CG2-CG1 4.45Å
169	V	91.1	Very high	84.3	Confident	92 Å²	92	85.5 Å²	85.5	56%	0.558	43%	0.434	S	S	*	.			trans	-125.3	122.5	-175.1	-176.3	0	0	0	0	110.1	T167 S171	T167-V169 HydrophobicContact CG2-CG2 4Å; V169-S171 PolarHBondContact O-N 2.85Å
170	D	89.8	Confident	82.6	Confident	51 Å²	51	93.8 Å²	93.8	27%	0.273	47%	0.471	S	S	.	.			trans	-69.4	124	166.2	175.6	-61.8	0	0	0	109.2	K172 Y173 G174	D170-K172 VanDerWaalsContact C-N 3.31Å; D170-K172 PolarHBondContact O-N 2.98Å; D170-K172 VanDerWaalsContact OD1-CA 3.31Å; D170-K172 WeakPolarHBondContact OD1-CA 3.15Å; D170-K172 VanDerWaalsContact OD1-CB 3.3Å; D170-K172 WeakPolarHBondContact OD1-CB 3.26Å; D170-K172 PolarHBondContact OD1-N 2.89Å; D170-Y173 HydrophobicContact CB-CD2 4.49Å; D170-Y173 VanDerWaalsContact CG-CD2 3.48Å; D170-Y173 VanDerWaalsContact OD1-CD2 3.29Å; D170-Y173 WeakPolarHBondContact OD1-CD2 2.9Å; D170-Y173 PolarHBondContact OD1-N 2.67Å; D170-Y173 WeakPolarHBondContact OD2-CD2 3.1Å; D170-G174 VanDerWaalsContact O-CA 3.26Å; D170-G174 WeakPolarHBondContact O-CA 3.48Å; D170-G174 PolarHBondContact O-N 2.91Å
171	S	90.9	Very high	82.3	Confident	124 Å²	124	98.4 Å²	98.4	87%	0.867	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-19.5	-175.5	57	0	0	0	0	114.7	V169	V169-S171 PolarHBondContact O-N 2.85Å
172	K	88.9	Confident	82	Confident	136 Å²	136	98.2 Å²	98.2	59%	0.591	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-26.4	179.8	179.5	-176	176.7	-169.9	0	112.5	D170 K176	D170-K172 VanDerWaalsContact C-N 3.31Å; D170-K172 PolarHBondContact O-N 2.98Å; D170-K172 VanDerWaalsContact OD1-CA 3.31Å; D170-K172 WeakPolarHBondContact OD1-CA 3.15Å; D170-K172 VanDerWaalsContact OD1-CB 3.3Å; D170-K172 WeakPolarHBondContact OD1-CB 3.26Å; D170-K172 PolarHBondContact OD1-N 2.89Å; K172-K176 PolarHBondContact O-NZ 3.46Å
173	Y	85.8	Confident	81.5	Confident	115 Å²	115	100.4 Å²	100.4	45%	0.451	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-16.3	-177	-54.7	-61.6	0	0	0	114.6	D170 L175 K176 V177	D170-Y173 HydrophobicContact CB-CD2 4.49Å; D170-Y173 VanDerWaalsContact CG-CD2 3.48Å; D170-Y173 VanDerWaalsContact OD1-CD2 3.29Å; D170-Y173 WeakPolarHBondContact OD1-CD2 2.9Å; D170-Y173 PolarHBondContact OD1-N 2.67Å; D170-Y173 WeakPolarHBondContact OD2-CD2 3.1Å; Y173-L175 PolarHBondContact O-N 2.84Å; Y173-K176 HydrophobicContact CD1-CD 4.42Å; Y173-K176 WeakPolarHBondContact O-CA 3.46Å; Y173-K176 VanDerWaalsContact O-CB 3.29Å; Y173-K176 WeakPolarHBondContact O-CB 2.93Å; Y173-K176 PolarHBondContact O-N 3.04Å; Y173-V177 PolarHBondContact O-N 3.01Å
174	G	80.9	Confident	80.8	Confident	20 Å²	20	101.8 Å²	101.8	21%	0.206	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-54.5	-46.1	-174.5	0	0	0	0	0	114.1	D170 K176 V177	D170-G174 VanDerWaalsContact O-CA 3.26Å; D170-G174 WeakPolarHBondContact O-CA 3.48Å; D170-G174 PolarHBondContact O-N 2.91Å; G174-K176 PolarHBondContact O-N 2.97Å; G174-K176 VanDerWaalsContact O-N 3.07Å; G174-V177 WeakPolarHBondContact O-CB 3.14Å; G174-V177 PolarHBondContact O-N 2.93Å
175	L	80.6	Confident	80	Confident	183 Å²	183	106.7 Å²	106.7	96%	0.958	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-67.5	-5.2	175.6	-61.5	178.1	0	0	0	114.5	Y173	Y173-L175 PolarHBondContact O-N 2.84Å
176	K	74.4	Confident	79.1	Confident	147 Å²	147	108.9 Å²	108.9	64%	0.639	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-104.1	-12.9	174.9	-57.1	165.4	-173.7	145.2	0	112	K172 Y173 G174 K178	K172-K176 PolarHBondContact O-NZ 3.46Å; Y173-K176 HydrophobicContact CD1-CD 4.42Å; Y173-K176 WeakPolarHBondContact O-CA 3.46Å; Y173-K176 VanDerWaalsContact O-CB 3.29Å; Y173-K176 WeakPolarHBondContact O-CB 2.93Å; Y173-K176 PolarHBondContact O-N 3.04Å; G174-K176 PolarHBondContact O-N 2.97Å; G174-K176 VanDerWaalsContact O-N 3.07Å; K176-K178 PolarHBondContact O-N 2.7Å
177	V	66.4	Low	77.9	Confident	29 Å²	29	110.5 Å²	110.5	18%	0.176	55%	0.55	C	S	.	.			trans	-75.3	103.2	172.8	-179.9	0	0	0	0	108	Y50 Y173 G174 Y179	Y50-V177 HydrophobicContact CD1-CG2 3.81Å; Y50-V177 HydrophobicContact CD2-CG1 3.54Å; Y50-V177 HydrophobicContact CD2-CG2 4.22Å; Y50-V177 HydrophobicContact CE1-CG2 4.35Å; Y50-V177 HydrophobicContact CE2-CG1 4Å; Y50-V177 HydrophobicContact CG-CG1 3.87Å; Y50-V177 HydrophobicContact CG-CG2 3.73Å; Y173-V177 PolarHBondContact O-N 3.01Å; G174-V177 WeakPolarHBondContact O-CB 3.14Å; G174-V177 PolarHBondContact O-N 2.93Å; V177-Y179 HydrophobicContact CB-CE2 4.39Å; V177-Y179 HydrophobicContact CG1-CD2 4.04Å; V177-Y179 HydrophobicContact CG1-CE2 3.69Å; V177-Y179 PolarHBondContact O-N 3.14Å
178	K	56.6	Low	76.8	Confident	163 Å²	163	113.6 Å²	113.6	71%	0.709	56%	0.559	S	S	*	*			trans	-80.3	102.2	167.1	-67.6	-167.4	-179.9	-174.1	0	109.2	K176 H180	K176-K178 PolarHBondContact O-N 2.7Å; K178-H180 WeakPolarHBondContact CD-NE2 3.45Å
179	Y	54.2	Low	75.6	Confident	152 Å²	152	119.9 Å²	119.9	60%	0.596	59%	0.59	S	S	*	*			trans	-63.7	130.3	152.7	-63.6	-88.5	0	0	0	107.5	V177	V177-Y179 HydrophobicContact CB-CE2 4.39Å; V177-Y179 HydrophobicContact CG1-CD2 4.04Å; V177-Y179 HydrophobicContact CG1-CE2 3.69Å; V177-Y179 PolarHBondContact O-N 3.14Å
180	H	47.6	Very low	74.2	Confident	227 Å²	227	122.5 Å²	122.5	100%	1.051	59%	0.592	S	S	*	*			trans	-134.6	0	-171	-103	-47.6	0	0	0	110.3	K178	K178-H180 WeakPolarHBondContact CD-NE2 3.45Å

Retrieved 180 of 180 residues in 33.2 ms (Link to these results)

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