A0A087WY49_HUMAN Loading...

Myosin XIX

AlphaFold DB , UniProt , Accession A0A087WY49, Species HUMAN (Homo sapiens, Human), Gene MYO19, Length 186 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	38.8	Very low	44.2	Very low	248 Å²	248	150 Å²	150	100%	1.222	83%	0.833	S	S	*	*				0	87.1	0	-151.3	174.1	-160.8	0	0	106.7
2	L	38.3	Very low	45.1	Very low	179 Å²	179	144.1 Å²	144.1	94%	0.937	81%	0.809	S	S	*	*			trans	-116.2	109.8	179.8	-82.9	161.4	0	0	0	106.3
3	Q	39.8	Very low	46.1	Very low	190 Å²	190	140.6 Å²	140.6	89%	0.888	79%	0.788	S	S	*	*			trans	-102.8	109.7	172.2	-136.1	170.8	17.6	0	0	107.1
4	Q	43.8	Very low	47.3	Very low	182 Å²	182	133.9 Å²	133.9	85%	0.85	77%	0.766	S	S	*	*			trans	-71.6	128	167.4	-74.4	-170.3	-15.3	0	0	108.8
5	V	44.7	Very low	48.6	Very low	135 Å²	135	133 Å²	133	82%	0.818	75%	0.752	S	S	*	*			trans	-100.8	104.8	166.8	-178.5	0	0	0	0	106.7
6	N	45.2	Very low	49.8	Very low	161 Å²	161	127.8 Å²	127.8	86%	0.861	73%	0.731	S	S	*	*			trans	-134.9	102.8	164.3	-105.9	-8.4	0	0	0	107.7
7	G	40.4	Very low	51.1	Low	74 Å²	74	130.5 Å²	130.5	76%	0.763	73%	0.726	S	S	*	*			trans	-133.7	79.4	173.6	0	0	0	0	0	109.3
8	H	47.2	Very low	52.4	Low	190 Å²	190	130.6 Å²	130.6	88%	0.88	72%	0.721	S	S	*	*			trans	-94	111.4	163.6	-142.7	70.6	0	0	0	106.3	P10	H8-P10 WeakPolarHBondContact O-CD 3.43Å
9	N	49.7	Very low	53.4	Low	127 Å²	127	130.7 Å²	130.7	68%	0.679	71%	0.71	S	S	*	*			trans	-99.9	106.6	-175.5	-158.3	8.3	0	0	0	109.1	G11	N9-G11 PolarHBondContact O-N 3.03Å
10	P	47.6	Very low	54.5	Low	112 Å²	112	128.6 Å²	128.6	73%	0.727	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-2.2	-172.9	30.1	-34.7	0	0	0	114.2	H8	H8-P10 WeakPolarHBondContact O-CD 3.43Å
11	G	50.6	Low	55.6	Low	52 Å²	52	130.8 Å²	130.8	54%	0.536	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	-20.8	-176.5	0	0	0	0	0	116.1	N9	N9-G11 PolarHBondContact O-N 3.03Å
12	S	54.6	Low	57.5	Low	79 Å²	79	124.3 Å²	124.3	55%	0.552	66%	0.662	S	S	*	*	H	α-helix	trans	-76.3	-26.2	-178.9	61.6	0	0	0	0	113.3	A16	S12-A16 PolarHBondContact O-N 2.88Å
13	D	58.4	Low	59.4	Low	99 Å²	99	119.1 Å²	119.1	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-73.9	-30.3	-175.2	-116.4	28.9	0	0	0	112.8	R17	D13-R17 WeakPolarHBondContact O-CB 3.46Å; D13-R17 WeakPolarHBondContact O-CD 3.46Å; D13-R17 WeakPolarHBondContact O-CG 3.32Å; D13-R17 PolarHBondContact O-N 2.84Å
14	G	63.4	Low	61.2	Low	46 Å²	46	111.3 Å²	111.3	47%	0.474	60%	0.6	S	S	.	*	H	α-helix	trans	-71.4	-44	177.8	0	0	0	0	0	112.6	R17 E18	G14-R17 PolarHBondContact O-N 2.89Å; G14-E18 PolarHBondContact O-N 3.02Å
15	Q	67.3	Low	62.8	Low	121 Å²	121	108.6 Å²	108.6	57%	0.565	59%	0.587	S	S	*	*	H	α-helix	trans	-72	-40.1	-176.1	-152	174	5.4	0	0	112	R17 E18 Y19	Q15-R17 VanDerWaalsContact C-N 3.28Å; Q15-R17 PolarHBondContact O-N 3.29Å; Q15-E18 PolarHBondContact O-N 3.39Å; Q15-Y19 HydrophobicContact CG-CD2 4.35Å; Q15-Y19 HydrophobicContact CG-CE2 3.82Å; Q15-Y19 WeakPolarHBondContact O-CD2 3.38Å; Q15-Y19 PolarHBondContact O-N 2.94Å
16	A	67.4	Low	64.5	Low	50 Å²	50	109.1 Å²	109.1	41%	0.413	58%	0.581	S	S	.	*	H	α-helix	trans	-62.6	-34.1	174.3	0	0	0	0	0	112.8	S12 L20	S12-A16 PolarHBondContact O-N 2.88Å; A16-L20 WeakPolarHBondContact O-CB 3.47Å; A16-L20 VanDerWaalsContact O-CG 3.31Å; A16-L20 WeakPolarHBondContact O-CG 3.34Å; A16-L20 PolarHBondContact O-N 2.93Å; A16-L20 VanDerWaalsContact O-N 3.13Å
17	R	71	Confident	66.1	Low	173 Å²	173	102.6 Å²	102.6	65%	0.653	55%	0.545	S	S	*	.	H	α-helix	trans	-71.4	-33.4	177.4	-77.6	177.1	-178.1	-168.3	4	113.3	D13 G14 Q15 R21	D13-R17 WeakPolarHBondContact O-CB 3.46Å; D13-R17 WeakPolarHBondContact O-CD 3.46Å; D13-R17 WeakPolarHBondContact O-CG 3.32Å; D13-R17 PolarHBondContact O-N 2.84Å; G14-R17 PolarHBondContact O-N 2.89Å; Q15-R17 VanDerWaalsContact C-N 3.28Å; Q15-R17 PolarHBondContact O-N 3.29Å; R17-R21 WeakPolarHBondContact O-CB 3.38Å; R17-R21 PolarHBondContact O-N 3.03Å
18	E	74.4	Confident	67.8	Low	133 Å²	133	101.8 Å²	101.8	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-69.6	-46	174.4	-73.6	-156.5	150.5	0	0	111.6	G14 Q15 L20 R21 E22	G14-E18 PolarHBondContact O-N 3.02Å; Q15-E18 PolarHBondContact O-N 3.39Å; E18-L20 PolarHBondContact O-N 3.08Å; E18-R21 WeakPolarHBondContact O-CA 3.47Å; E18-R21 VanDerWaalsContact O-CB 3.32Å; E18-R21 WeakPolarHBondContact O-CB 3.22Å; E18-R21 PolarHBondContact O-N 3.2Å; E18-E22 PolarHBondContact O-N 3.02Å
19	Y	72.6	Confident	68.8	Low	133 Å²	133	96 Å²	96	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-58	-45.9	175.6	-74.3	-63.7	0	0	0	112.7	Q15 R21 E22 D23	Q15-Y19 HydrophobicContact CG-CD2 4.35Å; Q15-Y19 HydrophobicContact CG-CE2 3.82Å; Q15-Y19 WeakPolarHBondContact O-CD2 3.38Å; Q15-Y19 PolarHBondContact O-N 2.94Å; Y19-R21 PolarHBondContact O-N 3.22Å; Y19-E22 PolarHBondContact O-N 2.97Å; Y19-D23 PolarHBondContact O-N 3.19Å
20	L	74.9	Confident	69.6	Low	88 Å²	88	91.8 Å²	91.8	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-60.8	-30.6	176	-76.1	168.4	0	0	0	113	A16 E18 L24	A16-L20 WeakPolarHBondContact O-CB 3.47Å; A16-L20 VanDerWaalsContact O-CG 3.31Å; A16-L20 WeakPolarHBondContact O-CG 3.34Å; A16-L20 PolarHBondContact O-N 2.93Å; A16-L20 VanDerWaalsContact O-N 3.13Å; E18-L20 PolarHBondContact O-N 3.08Å; L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 PolarHBondContact O-N 3.14Å; L20-L24 VanDerWaalsContact O-N 3.16Å
21	R	77.6	Confident	70.3	Confident	174 Å²	174	95.8 Å²	95.8	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-74.4	-38.9	178.8	-169	-178.8	-135.1	-120.8	1.2	111.5	R17 E18 Y19 Q25	R17-R21 WeakPolarHBondContact O-CB 3.38Å; R17-R21 PolarHBondContact O-N 3.03Å; E18-R21 WeakPolarHBondContact O-CA 3.47Å; E18-R21 VanDerWaalsContact O-CB 3.32Å; E18-R21 WeakPolarHBondContact O-CB 3.22Å; E18-R21 PolarHBondContact O-N 3.2Å; Y19-R21 PolarHBondContact O-N 3.22Å; R21-Q25 WeakPolarHBondContact O-CG 3.2Å; R21-Q25 PolarHBondContact O-N 3.11Å
22	E	78.3	Confident	71	Confident	112 Å²	112	96.7 Å²	96.7	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-51.4	175	-69.3	177.6	174	0	0	111	E18 Y19 L24 Q25 E26	E18-E22 PolarHBondContact O-N 3.02Å; Y19-E22 PolarHBondContact O-N 2.97Å; E22-L24 PolarHBondContact O-N 3.38Å; E22-Q25 PolarHBondContact O-N 3.29Å; E22-Q25 VanDerWaalsContact O-N 3.08Å; E22-E26 PolarHBondContact O-N 2.93Å
23	D	78	Confident	72.3	Confident	71 Å²	71	96.8 Å²	96.8	38%	0.38	50%	0.499	S	S	.	.	H	α-helix	trans	-56.4	-37.4	176.7	-72.3	-12.5	0	0	0	112	Y19 F27 P45	Y19-D23 PolarHBondContact O-N 3.19Å; D23-F27 WeakPolarHBondContact O-CB 3.37Å; D23-F27 PolarHBondContact O-N 3.16Å; D23-P45 HydrophobicContact CB-CG 4.07Å
24	L	78.8	Confident	73.6	Confident	25 Å²	25	93.4 Å²	93.4	13%	0.131	48%	0.481	C	S	.	.	H	α-helix	trans	-72.6	-38.6	179.3	-171.3	136.2	0	0	0	112.1	L20 E22 L28 P45 T47 E49 T50	L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 PolarHBondContact O-N 3.14Å; L20-L24 VanDerWaalsContact O-N 3.16Å; E22-L24 PolarHBondContact O-N 3.38Å; L24-L28 HydrophobicContact CD2-CD1 3.6Å; L24-L28 HydrophobicContact CD2-CG 4.5Å; L24-L28 HydrophobicContact CG-CD1 4.13Å; L24-L28 WeakPolarHBondContact O-CB 3.46Å; L24-L28 WeakPolarHBondContact O-CG 3Å; L24-L28 PolarHBondContact O-N 2.8Å; L24-P45 HydrophobicContact CB-CG 4.42Å; L24-T47 HydrophobicContact CD1-CG2 4.26Å; L24-T47 WeakPolarHBondContact CD1-OG1 3.46Å; L24-E49 HydrophobicContact CD1-CB 4.21Å; L24-E49 HydrophobicContact CD1-CG 4.48Å; L24-E49 HydrophobicContact CD2-CG 4.5Å; L24-E49 WeakPolarHBondContact CD2-OE2 3.27Å; L24-T50 HydrophobicContact CD1-CG2 3.94Å; L24-T50 HydrophobicContact CG-CG2 4.12Å
25	Q	77.7	Confident	74.8	Confident	125 Å²	125	95.7 Å²	95.7	58%	0.584	48%	0.476	S	S	*	.	H	α-helix	trans	-66	-38.7	172.9	-79.5	-177.5	-17	0	0	111.9	R21 E22 G29	R21-Q25 WeakPolarHBondContact O-CG 3.2Å; R21-Q25 PolarHBondContact O-N 3.11Å; E22-Q25 PolarHBondContact O-N 3.29Å; E22-Q25 VanDerWaalsContact O-N 3.08Å; Q25-G29 WeakPolarHBondContact O-CA 3.35Å; Q25-G29 PolarHBondContact O-N 3.04Å
26	E	79.9	Confident	75.9	Confident	147 Å²	147	95.4 Å²	95.4	69%	0.687	47%	0.473	S	S	*	.	H	α-helix	trans	-64.7	-48.2	175.3	-172.9	179.7	177.2	0	0	111.2	E22 L28 G29 G30	E22-E26 PolarHBondContact O-N 2.93Å; E26-L28 VanDerWaalsContact C-N 3.34Å; E26-L28 PolarHBondContact O-N 2.87Å; E26-G29 PolarHBondContact O-N 3.13Å; E26-G30 PolarHBondContact O-N 2.76Å
27	F	78.8	Confident	77.1	Confident	23 Å²	23	94.5 Å²	94.5	10%	0.101	46%	0.461	C	S	.	.	H	α-helix	trans	-60.8	-41.6	178.7	179.9	-99.1	0	0	0	112.7	D23 L34 L37 V43 N44 T50	D23-F27 WeakPolarHBondContact O-CB 3.37Å; D23-F27 PolarHBondContact O-N 3.16Å; F27-L34 HydrophobicContact CD1-CD2 4.5Å; F27-L34 HydrophobicContact CE1-CD2 3.58Å; F27-L34 HydrophobicContact CE2-CD2 4.17Å; F27-L34 HydrophobicContact CZ-CD2 3.37Å; F27-L37 HydrophobicContact CE2-CD1 4.48Å; F27-L37 HydrophobicContact CZ-CD1 4.12Å; F27-V43 HydrophobicContact CE1-CG1 3.94Å; F27-V43 HydrophobicContact CE2-CG1 4.26Å; F27-V43 HydrophobicContact CZ-CB 4.42Å; F27-V43 HydrophobicContact CZ-CG1 3.67Å; F27-V43 HydrophobicContact CZ-CG2 4.46Å; F27-N44 WeakPolarHBondContact CD2-O 3.45Å; F27-N44 WeakPolarHBondContact CG-O 3.41Å; F27-T50 HydrophobicContact CD1-CG2 3.53Å; F27-T50 HydrophobicContact CE1-CG2 3.96Å; F27-T50 HydrophobicContact CG-CG2 4.32Å
28	L	75.4	Confident	78.3	Confident	57 Å²	57	88.4 Å²	88.4	30%	0.298	44%	0.441	S	S	.	.	H	α-helix	trans	-79.9	-24.2	180	-65.4	177.8	0	0	0	113.4	L24 E26 E49 R53	L24-L28 HydrophobicContact CD2-CD1 3.6Å; L24-L28 HydrophobicContact CD2-CG 4.5Å; L24-L28 HydrophobicContact CG-CD1 4.13Å; L24-L28 WeakPolarHBondContact O-CB 3.46Å; L24-L28 WeakPolarHBondContact O-CG 3Å; L24-L28 PolarHBondContact O-N 2.8Å; E26-L28 VanDerWaalsContact C-N 3.34Å; E26-L28 PolarHBondContact O-N 2.87Å; L28-E49 HydrophobicContact CD1-CG 4.28Å; L28-R53 HydrophobicContact CD2-CB 3.91Å; L28-R53 HydrophobicContact CD2-CG 3.76Å
29	G	68.8	Low	79.3	Confident	68 Å²	68	83.8 Å²	83.8	70%	0.701	42%	0.42	S	S	*	.	H	α-helix	trans	-90.8	-18.3	179.5	0	0	0	0	0	114.3	Q25 E26	Q25-G29 WeakPolarHBondContact O-CA 3.35Å; Q25-G29 PolarHBondContact O-N 3.04Å; E26-G29 PolarHBondContact O-N 3.13Å
30	G	66.7	Low	80.4	Confident	39 Å²	39	78.1 Å²	78.1	40%	0.402	40%	0.399	S	S	.	.	S	Bend	trans	-70.6	159.7	-179.1	0	0	0	0	0	114.1	E26 V32	E26-G30 PolarHBondContact O-N 2.76Å; G30-V32 PolarHBondContact O-N 3.11Å
31	E	61.3	Low	81.2	Confident	196 Å²	196	77.9 Å²	77.9	92%	0.916	40%	0.402	S	S	*	.			trans	-67	14.8	172.1	-62.6	-170.9	157.4	0	0	113.8	L33	E31-L33 PolarHBondContact O-N 3.16Å
32	V	66.4	Low	81.9	Confident	71 Å²	71	78.8 Å²	78.8	43%	0.43	41%	0.405	S	S	.	.			trans	-64.3	114.4	178.8	-177.9	0	0	0	0	107.8	G30 L34 L37	G30-V32 PolarHBondContact O-N 3.11Å; V32-L34 HydrophobicContact CB-CD2 4.34Å; V32-L34 HydrophobicContact CG1-CD2 4.01Å; V32-L34 PolarHBondContact O-N 3.24Å; V32-L37 HydrophobicContact CG1-CD1 4.21Å
33	L	80.7	Confident	82.4	Confident	81 Å²	81	73.5 Å²	73.5	42%	0.424	38%	0.38	S	S	.	.			trans	-70	82	173	-61.1	172.8	0	0	0	108.2	E31 Y35 K36	E31-L33 PolarHBondContact O-N 3.16Å; L33-Y35 HydrophobicContact CB-CD1 4.12Å; L33-Y35 HydrophobicContact CB-CE1 3.68Å; L33-Y35 HydrophobicContact CD1-CE1 4.45Å; L33-Y35 HydrophobicContact CD2-CE1 3.71Å; L33-Y35 HydrophobicContact CG-CE1 4.13Å; L33-Y35 PolarHBondContact O-N 3.22Å; L33-K36 HydrophobicContact CB-CB 4.39Å; L33-K36 HydrophobicContact CB-CD 3.97Å; L33-K36 HydrophobicContact CB-CG 3.98Å; L33-K36 HydrophobicContact CD1-CD 3.76Å; L33-K36 WeakPolarHBondContact O-CB 3.49Å; L33-K36 PolarHBondContact O-N 3.13Å
34	L	86.4	Confident	82.8	Confident	29 Å²	29	75.9 Å²	75.9	15%	0.152	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-51.1	-35	-174.7	-63.8	-179.9	0	0	0	112.1	F27 V32 K36 L37 R53 A57	F27-L34 HydrophobicContact CD1-CD2 4.5Å; F27-L34 HydrophobicContact CE1-CD2 3.58Å; F27-L34 HydrophobicContact CE2-CD2 4.17Å; F27-L34 HydrophobicContact CZ-CD2 3.37Å; V32-L34 HydrophobicContact CB-CD2 4.34Å; V32-L34 HydrophobicContact CG1-CD2 4.01Å; V32-L34 PolarHBondContact O-N 3.24Å; L34-K36 PolarHBondContact O-N 3.22Å; L34-K36 VanDerWaalsContact O-N 3.16Å; L34-L37 HydrophobicContact CD2-CD1 4.09Å; L34-L37 WeakPolarHBondContact O-CB 3.36Å; L34-L37 PolarHBondContact O-N 3.01Å; L34-L37 VanDerWaalsContact O-N 3.13Å; L34-R53 HydrophobicContact CD1-CB 4.34Å; L34-A57 HydrophobicContact CB-CB 3.77Å
35	Y	87.5	Confident	83.2	Confident	94 Å²	94	75.2 Å²	75.2	37%	0.369	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-63.2	-18.6	176.8	71.8	-93.8	0	0	0	114.3	L33 R58 A61	L33-Y35 HydrophobicContact CB-CD1 4.12Å; L33-Y35 HydrophobicContact CB-CE1 3.68Å; L33-Y35 HydrophobicContact CD1-CE1 4.45Å; L33-Y35 HydrophobicContact CD2-CE1 3.71Å; L33-Y35 HydrophobicContact CG-CE1 4.13Å; L33-Y35 PolarHBondContact O-N 3.22Å; Y35-R58 WeakPolarHBondContact O-CG 3.12Å; Y35-R58 PolarHBondContact O-NH1 3.39Å; Y35-A61 HydrophobicContact CD2-CB 4.12Å; Y35-A61 HydrophobicContact CG-CB 4.05Å
36	K	91.1	Very high	83.8	Confident	115 Å²	115	73.8 Å²	73.8	50%	0.5	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-87.8	-7.5	177.4	-64.6	-171.8	176	171.6	0	113.7	L33 L34 D38	L33-K36 HydrophobicContact CB-CB 4.39Å; L33-K36 HydrophobicContact CB-CD 3.97Å; L33-K36 HydrophobicContact CB-CG 3.98Å; L33-K36 HydrophobicContact CD1-CD 3.76Å; L33-K36 WeakPolarHBondContact O-CB 3.49Å; L33-K36 PolarHBondContact O-N 3.13Å; L34-K36 PolarHBondContact O-N 3.22Å; L34-K36 VanDerWaalsContact O-N 3.16Å; K36-D38 PolarHBondContact O-N 3.31Å; K36-D38 VanDerWaalsContact O-N 3.11Å
37	L	93.2	Very high	84.3	Confident	31 Å²	31	68.7 Å²	68.7	16%	0.162	37%	0.369	C	S	.	.			trans	-76.2	100.8	179.6	-68.9	169.2	0	0	0	110.3	F27 V32 L34 D39 V43 R58	F27-L37 HydrophobicContact CE2-CD1 4.48Å; F27-L37 HydrophobicContact CZ-CD1 4.12Å; V32-L37 HydrophobicContact CG1-CD1 4.21Å; L34-L37 HydrophobicContact CD2-CD1 4.09Å; L34-L37 WeakPolarHBondContact O-CB 3.36Å; L34-L37 PolarHBondContact O-N 3.01Å; L34-L37 VanDerWaalsContact O-N 3.13Å; L37-D39 VanDerWaalsContact C-N 3.31Å; L37-D39 PolarHBondContact O-N 3.36Å; L37-V43 HydrophobicContact CD1-CG2 4.21Å; L37-R58 WeakPolarHBondContact O-CD 3.42Å; L37-R58 VanDerWaalsContact O-CZ 3.3Å; L37-R58 PolarHBondContact O-NH1 3.1Å
38	D	95.7	Very high	84.9	Confident	44 Å²	44	74.9 Å²	74.9	24%	0.235	40%	0.402	C	S	.	.			trans	-79.6	-12.5	-177.3	-72	-32.1	0	0	0	113.9	K36 R58 N67 K103 P104	K36-D38 PolarHBondContact O-N 3.31Å; K36-D38 VanDerWaalsContact O-N 3.11Å; D38-R58 IonicContact OD1-CZ 3.93Å; D38-R58 IonicContact OD1-NH1 2.88Å; D38-R58 PolarHBondContact OD1-NH1 3.5Å; D38-R58 IonicContact OD1-NH2 2.94Å; D38-R58 PolarHBondContact OD1-NH2 3.02Å; D38-N67 WeakPolarHBondContact O-CB 3.47Å; D38-N67 PolarHBondContact O-N 3.25Å; D38-K103 IonicContact OD1-NZ 3.3Å; D38-K103 PolarHBondContact OD1-NZ 3.3Å; D38-K103 VanDerWaalsContact OD2-CD 3.32Å; D38-K103 WeakPolarHBondContact OD2-CD 3.48Å; D38-K103 IonicContact OD2-NZ 2.67Å; D38-K103 PolarHBondContact OD2-NZ 3.19Å; D38-P104 HydrophobicContact CB-CG 3.57Å; D38-P104 WeakPolarHBondContact O-CG 3.46Å
39	D	95.8	Very high	85.7	Confident	36 Å²	36	76.5 Å²	76.5	19%	0.193	41%	0.408	C	S	.	.	B	Isolated β-bridge	trans	-135.7	119.5	179.6	-167.7	-26.6	0	0	0	110.8	L37 T41 R42 N67 G69	L37-D39 VanDerWaalsContact C-N 3.31Å; L37-D39 PolarHBondContact O-N 3.36Å; D39-T41 PolarHBondContact O-N 3.34Å; D39-T41 WeakPolarHBondContact OD1-CB 3.5Å; D39-T41 WeakPolarHBondContact OD1-CG2 3.31Å; D39-T41 PolarHBondContact OD1-N 3.07Å; D39-T41 PolarHBondContact OD1-OG1 3.34Å; D39-T41 PolarHBondContact OD2-OG1 3.18Å; D39-R42 HydrophobicContact CB-CG 4.14Å; D39-R42 WeakPolarHBondContact O-CB 3.42Å; D39-R42 PolarHBondContact O-N 2.63Å; D39-R42 VanDerWaalsContact O-N 3.1Å; D39-N67 CarbonylContact C-O 3.59Å; D39-N67 WeakPolarHBondContact CA-O 3.32Å; D39-N67 HydrophobicContact CB-CB 4.08Å; D39-G69 PolarHBondContact OD1-N 3.43Å
40	L	95.3	Very high	86.7	Confident	14 Å²	14	73.3 Å²	73.3	7%	0.073	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-65.8	-20.9	-179.4	-66.4	176.7	0	0	0	113	R42 V43 V51 C54 L55 T66 N67 A68 V73	L40-R42 PolarHBondContact O-N 3.48Å; L40-V43 HydrophobicContact CD2-CG2 4.27Å; L40-V43 WeakPolarHBondContact O-CB 3.09Å; L40-V43 WeakPolarHBondContact O-CG2 3.31Å; L40-V43 PolarHBondContact O-N 3.47Å; L40-V51 HydrophobicContact CD1-CG1 3.94Å; L40-V51 HydrophobicContact CD2-CG1 4.24Å; L40-C54 HydrophobicContact CD2-CB 4.12Å; L40-L55 HydrophobicContact CD1-CD1 4.41Å; L40-L55 HydrophobicContact CD1-CD2 4.2Å; L40-L55 HydrophobicContact CD1-CG 4.39Å; L40-L55 HydrophobicContact CD2-CD2 4.39Å; L40-L55 HydrophobicContact CD2-CG 4.34Å; L40-T66 HydrophobicContact CD2-CG2 4.08Å; L40-T66 HydrophobicContact CG-CG2 3.86Å; L40-N67 PolarHBondContact N-O 3.32Å; L40-A68 HydrophobicContact CB-CB 4.48Å; L40-A68 HydrophobicContact CD1-CB 4.31Å; L40-V73 HydrophobicContact CD1-CG2 4.13Å
41	T	92.5	Very high	88.1	Confident	84 Å²	84	73 Å²	73	52%	0.515	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-69	-13.9	174.4	63.7	0	0	0	0	112.8	D39	D39-T41 PolarHBondContact O-N 3.34Å; D39-T41 WeakPolarHBondContact OD1-CB 3.5Å; D39-T41 WeakPolarHBondContact OD1-CG2 3.31Å; D39-T41 PolarHBondContact OD1-N 3.07Å; D39-T41 PolarHBondContact OD1-OG1 3.34Å; D39-T41 PolarHBondContact OD2-OG1 3.18Å
42	R	90.9	Very high	89.6	Confident	192 Å²	192	67.8 Å²	67.8	73%	0.725	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-93.6	-2	176.8	-57.1	-178.7	64.4	-179.2	-0.6	113.2	D39 L40	D39-R42 HydrophobicContact CB-CG 4.14Å; D39-R42 WeakPolarHBondContact O-CB 3.42Å; D39-R42 PolarHBondContact O-N 2.63Å; D39-R42 VanDerWaalsContact O-N 3.1Å; L40-R42 PolarHBondContact O-N 3.48Å
43	V	89.3	Confident	90.8	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.012	35%	0.346	C	S	.	.			trans	-71.5	132.7	171.6	174.3	0	0	0	0	107.9	F27 L37 L40 V46 T50 C54	F27-V43 HydrophobicContact CE1-CG1 3.94Å; F27-V43 HydrophobicContact CE2-CG1 4.26Å; F27-V43 HydrophobicContact CZ-CB 4.42Å; F27-V43 HydrophobicContact CZ-CG1 3.67Å; F27-V43 HydrophobicContact CZ-CG2 4.46Å; L37-V43 HydrophobicContact CD1-CG2 4.21Å; L40-V43 HydrophobicContact CD2-CG2 4.27Å; L40-V43 WeakPolarHBondContact O-CB 3.09Å; L40-V43 WeakPolarHBondContact O-CG2 3.31Å; L40-V43 PolarHBondContact O-N 3.47Å; V43-V46 WeakPolarHBondContact O-CG2 3.48Å; V43-T50 VanDerWaalsContact CG1-CB 3.47Å; V43-T50 VanDerWaalsContact CG1-OG1 3.29Å; V43-T50 WeakPolarHBondContact CG1-OG1 3.22Å; V43-C54 HydrophobicContact CG2-CB 4.33Å
44	N	86.6	Confident	91.5	Very high	120 Å²	120	66.7 Å²	66.7	64%	0.642	33%	0.326	S	S	*	.	S	Bend	trans	-138.2	121.2	179.7	-174.1	48.4	0	0	0	110	F27	F27-N44 WeakPolarHBondContact CD2-O 3.45Å; F27-N44 WeakPolarHBondContact CG-O 3.41Å
45	P	88.1	Confident	92	Very high	11 Å²	11	66.5 Å²	66.5	7%	0.071	33%	0.325	C	S	.	.	S	Bend	cis	-71.7	147.7	-2.8	29.7	-34	0	0	0	111.9	D23 L24 T47 T50	D23-P45 HydrophobicContact CB-CG 4.07Å; L24-P45 HydrophobicContact CB-CG 4.42Å; P45-T47 HydrophobicContact CB-CG2 4Å; P45-T47 HydrophobicContact CG-CG2 4.06Å; P45-T47 PolarHBondContact O-N 2.94Å; P45-T47 VanDerWaalsContact O-N 3.12Å; P45-T50 HydrophobicContact CG-CG2 4.4Å; P45-T50 WeakPolarHBondContact O-CB 3.32Å; P45-T50 WeakPolarHBondContact O-CG2 3.41Å; P45-T50 PolarHBondContact O-OG1 3.43Å
46	V	89.7	Confident	92.4	Very high	96 Å²	96	66.3 Å²	66.3	58%	0.582	33%	0.327	S	S	*	.			trans	-76.7	97.2	172.4	-175	0	0	0	0	109	V43 V51	V43-V46 WeakPolarHBondContact O-CG2 3.48Å; V46-V51 HydrophobicContact CG1-CG2 4.23Å
47	T	90.9	Very high	92.5	Very high	39 Å²	39	62.1 Å²	62.1	24%	0.239	31%	0.314	C	S	.	.			trans	-129.3	165.1	176.3	76.9	0	0	0	0	110.3	L24 P45 E49 T50 V51	L24-T47 HydrophobicContact CD1-CG2 4.26Å; L24-T47 WeakPolarHBondContact CD1-OG1 3.46Å; P45-T47 HydrophobicContact CB-CG2 4Å; P45-T47 HydrophobicContact CG-CG2 4.06Å; P45-T47 PolarHBondContact O-N 2.94Å; P45-T47 VanDerWaalsContact O-N 3.12Å; T47-E49 PolarHBondContact O-N 3.28Å; T47-E49 PolarHBondContact OG1-N 2.89Å; T47-T50 PolarHBondContact N-OG1 3.44Å; T47-T50 PolarHBondContact O-N 2.91Å; T47-T50 PolarHBondContact O-OG1 3.43Å; T47-T50 PolarHBondContact OG1-N 2.95Å; T47-T50 PolarHBondContact OG1-OG1 3.45Å; T47-V51 WeakPolarHBondContact O-CB 3.36Å; T47-V51 VanDerWaalsContact O-CG2 3.27Å; T47-V51 WeakPolarHBondContact O-CG2 3.4Å; T47-V51 PolarHBondContact O-N 2.87Å
48	L	91.8	Very high	92.7	Very high	154 Å²	154	60.7 Å²	60.7	81%	0.806	31%	0.306	S	S	*	.	H	α-helix	trans	-54.5	-42.3	174.2	176.5	62.2	0	0	0	111.6	L52	L48-L52 WeakPolarHBondContact O-CB 3.34Å; L48-L52 PolarHBondContact O-N 2.67Å
49	E	90.5	Very high	92.7	Very high	91 Å²	91	62.3 Å²	62.3	43%	0.425	31%	0.31	S	S	.	.	H	α-helix	trans	-68.9	-47.2	-177.7	179.1	171.8	-173.2	0	0	112.1	L24 L28 T47 V51 L52 R53	L24-E49 HydrophobicContact CD1-CB 4.21Å; L24-E49 HydrophobicContact CD1-CG 4.48Å; L24-E49 HydrophobicContact CD2-CG 4.5Å; L24-E49 WeakPolarHBondContact CD2-OE2 3.27Å; L28-E49 HydrophobicContact CD1-CG 4.28Å; T47-E49 PolarHBondContact O-N 3.28Å; T47-E49 PolarHBondContact OG1-N 2.89Å; E49-V51 PolarHBondContact O-N 3.27Å; E49-L52 PolarHBondContact O-N 2.94Å; E49-R53 HydrophobicContact CG-CG 4.47Å; E49-R53 WeakPolarHBondContact O-CB 3.48Å; E49-R53 WeakPolarHBondContact O-CG 3.37Å; E49-R53 PolarHBondContact O-N 2.75Å
50	T	91.6	Very high	92.6	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-39.1	-179.3	57.8	0	0	0	0	111.6	L24 F27 V43 P45 T47 C54	L24-T50 HydrophobicContact CD1-CG2 3.94Å; L24-T50 HydrophobicContact CG-CG2 4.12Å; F27-T50 HydrophobicContact CD1-CG2 3.53Å; F27-T50 HydrophobicContact CE1-CG2 3.96Å; F27-T50 HydrophobicContact CG-CG2 4.32Å; V43-T50 VanDerWaalsContact CG1-CB 3.47Å; V43-T50 VanDerWaalsContact CG1-OG1 3.29Å; V43-T50 WeakPolarHBondContact CG1-OG1 3.22Å; P45-T50 HydrophobicContact CG-CG2 4.4Å; P45-T50 WeakPolarHBondContact O-CB 3.32Å; P45-T50 WeakPolarHBondContact O-CG2 3.41Å; P45-T50 PolarHBondContact O-OG1 3.43Å; T47-T50 PolarHBondContact N-OG1 3.44Å; T47-T50 PolarHBondContact O-N 2.91Å; T47-T50 PolarHBondContact O-OG1 3.43Å; T47-T50 PolarHBondContact OG1-N 2.95Å; T47-T50 PolarHBondContact OG1-OG1 3.45Å; T50-C54 WeakPolarHBondContact O-CB 3.44Å; T50-C54 PolarHBondContact O-N 2.88Å
51	V	94.1	Very high	92.6	Very high	32 Å²	32	69.9 Å²	69.9	19%	0.194	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-47	174.2	169.8	0	0	0	0	111.2	L40 V46 T47 E49 R53 C54 L55	L40-V51 HydrophobicContact CD1-CG1 3.94Å; L40-V51 HydrophobicContact CD2-CG1 4.24Å; V46-V51 HydrophobicContact CG1-CG2 4.23Å; T47-V51 WeakPolarHBondContact O-CB 3.36Å; T47-V51 VanDerWaalsContact O-CG2 3.27Å; T47-V51 WeakPolarHBondContact O-CG2 3.4Å; T47-V51 PolarHBondContact O-N 2.87Å; E49-V51 PolarHBondContact O-N 3.27Å; V51-R53 PolarHBondContact O-N 3.3Å; V51-C54 WeakPolarHBondContact O-CB 3.19Å; V51-C54 PolarHBondContact O-N 3.03Å; V51-L55 HydrophobicContact CG1-CD1 3.99Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CG 3.33Å; V51-L55 PolarHBondContact O-N 2.96Å
52	L	94.3	Very high	92.7	Very high	88 Å²	88	70 Å²	70	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-44.9	179.4	179.9	62.7	0	0	0	111.3	L48 E49 C54 L55 Q56	L48-L52 WeakPolarHBondContact O-CB 3.34Å; L48-L52 PolarHBondContact O-N 2.67Å; E49-L52 PolarHBondContact O-N 2.94Å; L52-C54 VanDerWaalsContact C-N 3.35Å; L52-C54 PolarHBondContact O-N 2.84Å; L52-L55 PolarHBondContact O-N 3.34Å; L52-Q56 HydrophobicContact CD1-CG 4.34Å; L52-Q56 HydrophobicContact CG-CG 4.46Å; L52-Q56 WeakPolarHBondContact O-CB 3.4Å; L52-Q56 VanDerWaalsContact O-CG 3.27Å; L52-Q56 WeakPolarHBondContact O-CG 3.4Å; L52-Q56 PolarHBondContact O-N 3.27Å
53	R	92.1	Very high	92.9	Very high	128 Å²	128	63.1 Å²	63.1	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-41.2	177.2	-71.7	-72.6	-167.8	157.5	4.6	112.2	L28 L34 E49 V51 Q56 A57	L28-R53 HydrophobicContact CD2-CB 3.91Å; L28-R53 HydrophobicContact CD2-CG 3.76Å; L34-R53 HydrophobicContact CD1-CB 4.34Å; E49-R53 HydrophobicContact CG-CG 4.47Å; E49-R53 WeakPolarHBondContact O-CB 3.48Å; E49-R53 WeakPolarHBondContact O-CG 3.37Å; E49-R53 PolarHBondContact O-N 2.75Å; V51-R53 PolarHBondContact O-N 3.3Å; R53-Q56 PolarHBondContact O-N 3Å; R53-A57 WeakPolarHBondContact O-CB 3.48Å; R53-A57 PolarHBondContact O-N 3.45Å
54	C	94.7	Very high	93.3	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-50.6	174.8	-176.9	0	0	0	0	111.6	L40 V43 T50 V51 L52 Q56 A57 R58	L40-C54 HydrophobicContact CD2-CB 4.12Å; V43-C54 HydrophobicContact CG2-CB 4.33Å; T50-C54 WeakPolarHBondContact O-CB 3.44Å; T50-C54 PolarHBondContact O-N 2.88Å; V51-C54 WeakPolarHBondContact O-CB 3.19Å; V51-C54 PolarHBondContact O-N 3.03Å; L52-C54 VanDerWaalsContact C-N 3.35Å; L52-C54 PolarHBondContact O-N 2.84Å; C54-Q56 PolarHBondContact O-N 3.48Å; C54-A57 PolarHBondContact O-N 2.94Å; C54-R58 WeakPolarHBondContact O-CG 3.29Å; C54-R58 PolarHBondContact O-N 3.34Å
55	L	96.4	Very high	93.8	Very high	26 Å²	26	57.8 Å²	57.8	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-41.3	178.2	-72.3	174.1	0	0	0	112.3	L40 V51 L52 R58 Y59 V73 L75	L40-L55 HydrophobicContact CD1-CD1 4.41Å; L40-L55 HydrophobicContact CD1-CD2 4.2Å; L40-L55 HydrophobicContact CD1-CG 4.39Å; L40-L55 HydrophobicContact CD2-CD2 4.39Å; L40-L55 HydrophobicContact CD2-CG 4.34Å; V51-L55 HydrophobicContact CG1-CD1 3.99Å; V51-L55 HydrophobicContact CG1-CG 4.49Å; V51-L55 WeakPolarHBondContact O-CG 3.33Å; V51-L55 PolarHBondContact O-N 2.96Å; L52-L55 PolarHBondContact O-N 3.34Å; L55-R58 PolarHBondContact O-N 2.95Å; L55-Y59 WeakPolarHBondContact O-CB 3.27Å; L55-Y59 PolarHBondContact O-N 3.17Å; L55-V73 HydrophobicContact CD2-CG1 4.07Å; L55-L75 HydrophobicContact CB-CD1 4.21Å; L55-L75 HydrophobicContact CD2-CD1 4.24Å
56	Q	95.4	Very high	94.3	Very high	89 Å²	89	57.3 Å²	57.3	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-48.3	174.8	-76.7	174.6	-19.7	0	0	111.8	L52 R53 C54 R58 Y59 M60	L52-Q56 HydrophobicContact CD1-CG 4.34Å; L52-Q56 HydrophobicContact CG-CG 4.46Å; L52-Q56 WeakPolarHBondContact O-CB 3.4Å; L52-Q56 VanDerWaalsContact O-CG 3.27Å; L52-Q56 WeakPolarHBondContact O-CG 3.4Å; L52-Q56 PolarHBondContact O-N 3.27Å; R53-Q56 PolarHBondContact O-N 3Å; C54-Q56 PolarHBondContact O-N 3.48Å; Q56-R58 VanDerWaalsContact C-N 3.33Å; Q56-R58 PolarHBondContact O-N 3.48Å; Q56-Y59 PolarHBondContact O-N 3Å; Q56-M60 VanDerWaalsContact O-CG 3.32Å; Q56-M60 WeakPolarHBondContact O-CG 2.98Å; Q56-M60 PolarHBondContact O-N 3.22Å
57	A	94.3	Very high	94.7	Very high	27 Å²	27	54.6 Å²	54.6	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-41.4	178.9	0	0	0	0	0	111.9	L34 R53 C54 M60 A61	L34-A57 HydrophobicContact CB-CB 3.77Å; R53-A57 WeakPolarHBondContact O-CB 3.48Å; R53-A57 PolarHBondContact O-N 3.45Å; C54-A57 PolarHBondContact O-N 2.94Å; A57-M60 PolarHBondContact O-N 3.41Å; A57-A61 WeakPolarHBondContact O-CB 3.33Å; A57-A61 PolarHBondContact O-N 3.3Å; A57-A61 VanDerWaalsContact O-N 3.14Å
58	R	96.4	Very high	94.9	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-44.7	174.8	-72	-178.5	69.2	84.3	-14.9	112.2	Y35 L37 D38 C54 L55 Q56 M60 A61 D62 T63 Y65 T66	Y35-R58 WeakPolarHBondContact O-CG 3.12Å; Y35-R58 PolarHBondContact O-NH1 3.39Å; L37-R58 WeakPolarHBondContact O-CD 3.42Å; L37-R58 VanDerWaalsContact O-CZ 3.3Å; L37-R58 PolarHBondContact O-NH1 3.1Å; D38-R58 IonicContact OD1-CZ 3.93Å; D38-R58 IonicContact OD1-NH1 2.88Å; D38-R58 PolarHBondContact OD1-NH1 3.5Å; D38-R58 IonicContact OD1-NH2 2.94Å; D38-R58 PolarHBondContact OD1-NH2 3.02Å; C54-R58 WeakPolarHBondContact O-CG 3.29Å; C54-R58 PolarHBondContact O-N 3.34Å; L55-R58 PolarHBondContact O-N 2.95Å; Q56-R58 VanDerWaalsContact C-N 3.33Å; Q56-R58 PolarHBondContact O-N 3.48Å; R58-M60 PolarHBondContact O-N 3.41Å; R58-A61 CarbonylContact O-C 3.6Å; R58-A61 PolarHBondContact O-N 3.24Å; R58-A61 VanDerWaalsContact O-N 3.11Å; R58-D62 PolarHBondContact O-N 3.38Å; R58-T63 CarbonylContact C-O 3.4Å; R58-T63 VanDerWaalsContact CZ-CG2 3.43Å; R58-T63 VanDerWaalsContact NH2-CG2 3.25Å; R58-T63 WeakPolarHBondContact O-CA 3.2Å; R58-T63 WeakPolarHBondContact O-CB 3.49Å; R58-T63 PolarHBondContact O-N 3.24Å; R58-Y65 PolarHBondContact NH2-O 3.26Å; R58-T66 WeakPolarHBondContact CD-OG1 3.35Å; R58-T66 PolarHBondContact NE-OG1 3.29Å
59	Y	96.1	Very high	94.9	Very high	79 Å²	79	48.9 Å²	48.9	31%	0.31	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-44.6	177	-169.8	-90.3	0	0	0	112	L55 Q56 A61 D62 F64 L75 N76 P77	L55-Y59 WeakPolarHBondContact O-CB 3.27Å; L55-Y59 PolarHBondContact O-N 3.17Å; Q56-Y59 PolarHBondContact O-N 3Å; Y59-A61 PolarHBondContact O-N 2.62Å; Y59-D62 PolarHBondContact O-N 3.42Å; Y59-D62 VanDerWaalsContact O-N 3.07Å; Y59-F64 AromaticContact CD2-CD1 3.76Å; Y59-F64 HydrophobicContact CD2-CD1 3.76Å; Y59-F64 AromaticContact CD2-CE1 3.81Å; Y59-F64 HydrophobicContact CD2-CE1 3.81Å; Y59-F64 AromaticContact CE2-CD1 3.85Å; Y59-F64 HydrophobicContact CE2-CD1 3.85Å; Y59-F64 AromaticContact CE2-CE1 3.75Å; Y59-F64 HydrophobicContact CE2-CE1 3.75Å; Y59-F64 HydrophobicContact CG-CE1 4.4Å; Y59-L75 HydrophobicContact CD2-CB 3.87Å; Y59-L75 HydrophobicContact CD2-CD1 3.92Å; Y59-L75 HydrophobicContact CE2-CB 4.26Å; Y59-L75 HydrophobicContact CG-CD1 4.45Å; Y59-N76 WeakPolarHBondContact CE2-O 3.4Å; Y59-N76 PolarHBondContact OH-O 3.25Å; Y59-P77 PolarHBondContact OH-O 3.19Å; Y59-P77 VanDerWaalsContact OH-O 3.13Å
60	M	94.7	Very high	94.9	Very high	164 Å²	164	51.2 Å²	51.2	81%	0.808	29%	0.287	S	S	*	.	H	α-helix	trans	-64.2	-24.4	176.3	-69.9	178.5	71.3	0	0	113	Q56 A57 R58 D62	Q56-M60 VanDerWaalsContact O-CG 3.32Å; Q56-M60 WeakPolarHBondContact O-CG 2.98Å; Q56-M60 PolarHBondContact O-N 3.22Å; A57-M60 PolarHBondContact O-N 3.41Å; R58-M60 PolarHBondContact O-N 3.41Å; M60-D62 VanDerWaalsContact C-N 3.34Å
61	A	94	Very high	95.1	Very high	44 Å²	44	55.5 Å²	55.5	36%	0.364	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	19.1	175.1	0	0	0	0	0	113.2	Y35 A57 R58 Y59 T63	Y35-A61 HydrophobicContact CD2-CB 4.12Å; Y35-A61 HydrophobicContact CG-CB 4.05Å; A57-A61 WeakPolarHBondContact O-CB 3.33Å; A57-A61 PolarHBondContact O-N 3.3Å; A57-A61 VanDerWaalsContact O-N 3.14Å; R58-A61 CarbonylContact O-C 3.6Å; R58-A61 PolarHBondContact O-N 3.24Å; R58-A61 VanDerWaalsContact O-N 3.11Å; Y59-A61 PolarHBondContact O-N 2.62Å; A61-T63 PolarHBondContact O-N 3.2Å; A61-T63 PolarHBondContact O-OG1 3.12Å
62	D	94.4	Very high	95.3	Very high	88 Å²	88	55.9 Å²	55.9	47%	0.471	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	32.8	-179.4	-74.2	-26.7	0	0	0	114.6	R58 Y59 M60 F64 K79	R58-D62 PolarHBondContact O-N 3.38Å; Y59-D62 PolarHBondContact O-N 3.42Å; Y59-D62 VanDerWaalsContact O-N 3.07Å; M60-D62 VanDerWaalsContact C-N 3.34Å; D62-F64 HydrophobicContact CB-CE2 4.13Å; D62-F64 HydrophobicContact CB-CZ 4.05Å; D62-F64 VanDerWaalsContact O-CE2 3.31Å; D62-F64 WeakPolarHBondContact O-CE2 3.26Å; D62-F64 WeakPolarHBondContact OD1-CZ 3.26Å; D62-K79 VanDerWaalsContact CG-NZ 3.29Å; D62-K79 WeakPolarHBondContact OD1-CE 3.14Å; D62-K79 IonicContact OD1-NZ 2.63Å; D62-K79 PolarHBondContact OD1-NZ 3.05Å; D62-K79 IonicContact OD2-NZ 3.18Å; D62-K79 PolarHBondContact OD2-NZ 3.28Å
63	T	95.7	Very high	95.4	Very high	46 Å²	46	53.7 Å²	53.7	28%	0.282	31%	0.305	S	S	.	.			trans	-112.2	106	175.8	-56.6	0	0	0	0	110.1	R58 A61	R58-T63 CarbonylContact C-O 3.4Å; R58-T63 VanDerWaalsContact CZ-CG2 3.43Å; R58-T63 VanDerWaalsContact NH2-CG2 3.25Å; R58-T63 WeakPolarHBondContact O-CA 3.2Å; R58-T63 WeakPolarHBondContact O-CB 3.49Å; R58-T63 PolarHBondContact O-N 3.24Å; A61-T63 PolarHBondContact O-N 3.2Å; A61-T63 PolarHBondContact O-OG1 3.12Å
64	F	97.1	Very high	95.7	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.018	30%	0.299	C	S	.	.			trans	-101.4	-8	-166.4	-56.2	-67	0	0	0	115.2	Y59 D62 A74 L75 P77 V81 L84	Y59-F64 AromaticContact CD2-CD1 3.76Å; Y59-F64 HydrophobicContact CD2-CD1 3.76Å; Y59-F64 AromaticContact CD2-CE1 3.81Å; Y59-F64 HydrophobicContact CD2-CE1 3.81Å; Y59-F64 AromaticContact CE2-CD1 3.85Å; Y59-F64 HydrophobicContact CE2-CD1 3.85Å; Y59-F64 AromaticContact CE2-CE1 3.75Å; Y59-F64 HydrophobicContact CE2-CE1 3.75Å; Y59-F64 HydrophobicContact CG-CE1 4.4Å; D62-F64 HydrophobicContact CB-CE2 4.13Å; D62-F64 HydrophobicContact CB-CZ 4.05Å; D62-F64 VanDerWaalsContact O-CE2 3.31Å; D62-F64 WeakPolarHBondContact O-CE2 3.26Å; D62-F64 WeakPolarHBondContact OD1-CZ 3.26Å; F64-A74 CarbonylContact O-C 3.33Å; F64-A74 WeakPolarHBondContact O-CA 3.42Å; F64-L75 WeakPolarHBondContact CB-O 3.38Å; F64-L75 PolarHBondContact O-N 3.25Å; F64-P77 HydrophobicContact CD1-CB 3.79Å; F64-P77 HydrophobicContact CD2-CB 4.16Å; F64-P77 HydrophobicContact CE1-CB 3.55Å; F64-P77 HydrophobicContact CE2-CB 3.93Å; F64-P77 HydrophobicContact CG-CB 4.09Å; F64-P77 HydrophobicContact CZ-CB 3.61Å; F64-V81 HydrophobicContact CD2-CG2 4.41Å; F64-V81 HydrophobicContact CE2-CG1 4.31Å; F64-V81 HydrophobicContact CE2-CG2 3.74Å; F64-V81 HydrophobicContact CZ-CG2 4.34Å; F64-L84 HydrophobicContact CD2-CD2 4Å
65	Y	97.8	Very high	95.8	Very high	7 Å²	7	52 Å²	52	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.8	-179.1	-71.5	-71.6	0	0	0	110.1	R58 L72 V73 A74 L84 Y85 P104 H105 V106	R58-Y65 PolarHBondContact NH2-O 3.26Å; Y65-L72 HydrophobicContact CD1-CD1 4.43Å; Y65-L72 HydrophobicContact CD1-CD2 3.72Å; Y65-L72 HydrophobicContact CD1-CG 4.1Å; Y65-L72 HydrophobicContact CE1-CD2 4.17Å; Y65-V73 CarbonylContact C-O 3.59Å; Y65-V73 WeakPolarHBondContact CA-O 3.26Å; Y65-A74 HydrophobicContact CD1-CB 3.75Å; Y65-A74 HydrophobicContact CE1-CB 3.51Å; Y65-L84 HydrophobicContact CD2-CD1 4.11Å; Y65-L84 HydrophobicContact CE2-CD1 3.99Å; Y65-L84 HydrophobicContact CE2-CD2 4.08Å; Y65-L84 HydrophobicContact CE2-CG 4.13Å; Y65-Y85 HydrophobicContact CE2-CE1 4.21Å; Y65-Y85 VanDerWaalsContact OH-CE1 3.29Å; Y65-Y85 WeakPolarHBondContact OH-CE1 3.42Å; Y65-Y85 PolarHBondContact OH-OH 3.08Å; Y65-P104 WeakPolarHBondContact CB-O 3.46Å; Y65-H105 AromaticContact CD2-CD2 3.45Å; Y65-H105 VanDerWaalsContact CD2-CD2 3.45Å; Y65-H105 WeakPolarHBondContact CD2-CD2 3.31Å; Y65-H105 AromaticContact CD2-NE2 3.79Å; Y65-H105 AromaticContact CE2-CD2 3.65Å; Y65-H105 AromaticContact CE2-NE2 3.47Å; Y65-H105 WeakPolarHBondContact CE2-NE2 3.46Å; Y65-V106 HydrophobicContact CE1-CB 4.09Å
66	T	98	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	135.2	179.5	-42.3	0	0	0	0	109.4	L40 R58 V73	L40-T66 HydrophobicContact CD2-CG2 4.08Å; L40-T66 HydrophobicContact CG-CG2 3.86Å; R58-T66 WeakPolarHBondContact CD-OG1 3.35Å; R58-T66 PolarHBondContact NE-OG1 3.29Å; T66-V73 PolarHBondContact N-O 2.75Å; T66-V73 WeakPolarHBondContact O-CB 3.49Å; T66-V73 PolarHBondContact O-N 3.17Å
67	N	97.8	Very high	95.8	Very high	40 Å²	40	49.7 Å²	49.7	21%	0.214	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	149.4	174.5	-65.6	-25.4	0	0	0	110.4	D38 D39 L40 L72	D38-N67 WeakPolarHBondContact O-CB 3.47Å; D38-N67 PolarHBondContact O-N 3.25Å; D39-N67 CarbonylContact C-O 3.59Å; D39-N67 WeakPolarHBondContact CA-O 3.32Å; D39-N67 HydrophobicContact CB-CB 4.08Å; L40-N67 PolarHBondContact N-O 3.32Å; N67-L72 WeakPolarHBondContact OD1-CD1 3.3Å
68	A	95.4	Very high	95.8	Very high	30 Å²	30	56.2 Å²	56.2	25%	0.248	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	76.8	168.1	0	0	0	0	0	107	L40 C70 T71 V73	L40-A68 HydrophobicContact CB-CB 4.48Å; L40-A68 HydrophobicContact CD1-CB 4.31Å; A68-C70 PolarHBondContact O-N 2.92Å; A68-T71 PolarHBondContact N-O 3.05Å; A68-T71 PolarHBondContact O-N 3Å; A68-T71 VanDerWaalsContact O-N 3.08Å; A68-T71 PolarHBondContact O-OG1 3.13Å; A68-V73 HydrophobicContact CB-CG2 3.92Å
69	G	92.5	Very high	95.6	Very high	42 Å²	42	61 Å²	61	43%	0.433	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	-119.2	-170.3	0	0	0	0	0	111	D39 T71	D39-G69 PolarHBondContact OD1-N 3.43Å; G69-T71 VanDerWaalsContact C-N 3.29Å; G69-T71 PolarHBondContact O-N 3.28Å
70	C	90.5	Very high	95.2	Very high	140 Å²	140	63 Å²	63	95%	0.946	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-8.1	177.9	61	0	0	0	0	114.3	A68	A68-C70 PolarHBondContact O-N 2.92Å
71	T	95.2	Very high	95	Very high	90 Å²	90	56.9 Å²	56.9	55%	0.552	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	150.8	-178.3	-22.6	0	0	0	0	110.3	A68 G69	A68-T71 PolarHBondContact N-O 3.05Å; A68-T71 PolarHBondContact O-N 3Å; A68-T71 VanDerWaalsContact O-N 3.08Å; A68-T71 PolarHBondContact O-OG1 3.13Å; G69-T71 VanDerWaalsContact C-N 3.29Å; G69-T71 PolarHBondContact O-N 3.28Å
72	L	97.9	Very high	94.5	Very high	40 Å²	40	59.8 Å²	59.8	21%	0.209	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.9	172.7	-176	71.5	0	0	0	109.8	Y65 N67 P104 H105 V106 V109	Y65-L72 HydrophobicContact CD1-CD1 4.43Å; Y65-L72 HydrophobicContact CD1-CD2 3.72Å; Y65-L72 HydrophobicContact CD1-CG 4.1Å; Y65-L72 HydrophobicContact CE1-CD2 4.17Å; N67-L72 WeakPolarHBondContact OD1-CD1 3.3Å; L72-P104 HydrophobicContact CD1-CB 3.92Å; L72-H105 VanDerWaalsContact CD2-C 3.45Å; L72-V106 HydrophobicContact CD2-CB 4.33Å; L72-V109 HydrophobicContact CB-CG2 4.16Å; L72-V109 HydrophobicContact CD2-CG2 3.97Å
73	V	97.8	Very high	94.2	Very high	42 Å²	42	63 Å²	63	26%	0.255	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.9	171.1	-178.9	0	0	0	0	108.6	L40 L55 Y65 T66 A68	L40-V73 HydrophobicContact CD1-CG2 4.13Å; L55-V73 HydrophobicContact CD2-CG1 4.07Å; Y65-V73 CarbonylContact C-O 3.59Å; Y65-V73 WeakPolarHBondContact CA-O 3.26Å; T66-V73 PolarHBondContact N-O 2.75Å; T66-V73 WeakPolarHBondContact O-CB 3.49Å; T66-V73 PolarHBondContact O-N 3.17Å; A68-V73 HydrophobicContact CB-CG2 3.92Å
74	A	97.5	Very high	94.1	Very high	45 Å²	45	62 Å²	62	37%	0.372	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.6	176.3	0	0	0	0	0	109.9	F64 Y65	F64-A74 CarbonylContact O-C 3.33Å; F64-A74 WeakPolarHBondContact O-CA 3.42Å; Y65-A74 HydrophobicContact CD1-CB 3.75Å; Y65-A74 HydrophobicContact CE1-CB 3.51Å
75	L	97.3	Very high	93.8	Very high	49 Å²	49	64 Å²	64	26%	0.257	37%	0.37	S	S	.	.			trans	-100.6	127.9	174.1	-61.2	179.1	0	0	0	109.3	L55 Y59 F64 P77	L55-L75 HydrophobicContact CB-CD1 4.21Å; L55-L75 HydrophobicContact CD2-CD1 4.24Å; Y59-L75 HydrophobicContact CD2-CB 3.87Å; Y59-L75 HydrophobicContact CD2-CD1 3.92Å; Y59-L75 HydrophobicContact CE2-CB 4.26Å; Y59-L75 HydrophobicContact CG-CD1 4.45Å; F64-L75 WeakPolarHBondContact CB-O 3.38Å; F64-L75 PolarHBondContact O-N 3.25Å; L75-P77 VanDerWaalsContact O-CD 3.3Å; L75-P77 WeakPolarHBondContact O-CD 3.33Å
76	N	96.3	Very high	93.5	Very high	47 Å²	47	64.9 Å²	64.9	25%	0.251	38%	0.377	S	S	.	.			trans	-68.2	118.2	177.4	-175.9	-7.3	0	0	0	110.1	Y59 F78 G135	Y59-N76 WeakPolarHBondContact CE2-O 3.4Å; Y59-N76 PolarHBondContact OH-O 3.25Å; N76-F78 HydrophobicContact CB-CD2 4.33Å; N76-F78 HydrophobicContact CB-CE2 4Å; N76-F78 HydrophobicContact CB-CZ 4.15Å; N76-F78 WeakPolarHBondContact ND2-CE1 3.45Å; N76-F78 VanDerWaalsContact O-CD2 3.26Å; N76-F78 WeakPolarHBondContact O-CD2 3.47Å; N76-F78 PolarHBondContact O-N 3.49Å; N76-F78 PolarHBondContact OD1-N 3.31Å; N76-G135 PolarHBondContact ND2-O 3.13Å
77	P	95.1	Very high	93.1	Very high	18 Å²	18	67.9 Å²	67.9	12%	0.117	40%	0.397	C	S	.	.			trans	-68.9	-18.3	-178.7	28.4	-36.3	0	0	0	113.5	Y59 F64 L75 K79 V81	Y59-P77 PolarHBondContact OH-O 3.19Å; Y59-P77 VanDerWaalsContact OH-O 3.13Å; F64-P77 HydrophobicContact CD1-CB 3.79Å; F64-P77 HydrophobicContact CD2-CB 4.16Å; F64-P77 HydrophobicContact CE1-CB 3.55Å; F64-P77 HydrophobicContact CE2-CB 3.93Å; F64-P77 HydrophobicContact CG-CB 4.09Å; F64-P77 HydrophobicContact CZ-CB 3.61Å; L75-P77 VanDerWaalsContact O-CD 3.3Å; L75-P77 WeakPolarHBondContact O-CD 3.33Å; P77-K79 HydrophobicContact CB-CG 4.11Å; P77-K79 PolarHBondContact O-N 3.21Å; P77-V81 HydrophobicContact CB-CG2 3.94Å; P77-V81 HydrophobicContact CG-CG2 4.12Å
78	F	93.3	Very high	92.9	Very high	165 Å²	165	71.3 Å²	71.3	72%	0.724	41%	0.411	S	S	*	.	S	Bend	trans	51.2	17.5	-171.8	-64.9	-75.1	0	0	0	114.8	N76	N76-F78 HydrophobicContact CB-CD2 4.33Å; N76-F78 HydrophobicContact CB-CE2 4Å; N76-F78 HydrophobicContact CB-CZ 4.15Å; N76-F78 WeakPolarHBondContact ND2-CE1 3.45Å; N76-F78 VanDerWaalsContact O-CD2 3.26Å; N76-F78 WeakPolarHBondContact O-CD2 3.47Å; N76-F78 PolarHBondContact O-N 3.49Å; N76-F78 PolarHBondContact OD1-N 3.31Å
79	K	92.3	Very high	92.8	Very high	100 Å²	100	71.4 Å²	71.4	44%	0.435	41%	0.408	S	S	.	.	S	Bend	trans	-143.6	152.6	176.4	66.3	-176.6	178	176.7	0	110	D62 P77 V81	D62-K79 VanDerWaalsContact CG-NZ 3.29Å; D62-K79 WeakPolarHBondContact OD1-CE 3.14Å; D62-K79 IonicContact OD1-NZ 2.63Å; D62-K79 PolarHBondContact OD1-NZ 3.05Å; D62-K79 IonicContact OD2-NZ 3.18Å; D62-K79 PolarHBondContact OD2-NZ 3.28Å; P77-K79 HydrophobicContact CB-CG 4.11Å; P77-K79 PolarHBondContact O-N 3.21Å; K79-V81 HydrophobicContact CG-CG2 4.2Å; K79-V81 PolarHBondContact O-N 2.94Å
80	P	88.4	Confident	92.9	Very high	122 Å²	122	69.7 Å²	69.7	79%	0.792	39%	0.388	S	S	*	.			trans	-61.9	132	170.7	-19.6	32.1	0	0	0	110.8
81	V	91.5	Very high	93.1	Very high	35 Å²	35	69.2 Å²	69.2	21%	0.212	37%	0.367	C	S	.	.			trans	-127.2	82	173.6	-167.3	0	0	0	0	107.8	F64 P77 K79 Q83 L84	F64-V81 HydrophobicContact CD2-CG2 4.41Å; F64-V81 HydrophobicContact CE2-CG1 4.31Å; F64-V81 HydrophobicContact CE2-CG2 3.74Å; F64-V81 HydrophobicContact CZ-CG2 4.34Å; P77-V81 HydrophobicContact CB-CG2 3.94Å; P77-V81 HydrophobicContact CG-CG2 4.12Å; K79-V81 HydrophobicContact CG-CG2 4.2Å; K79-V81 PolarHBondContact O-N 2.94Å; V81-Q83 VanDerWaalsContact C-N 3.26Å; V81-Q83 PolarHBondContact O-N 3.47Å; V81-Q83 VanDerWaalsContact O-N 3.17Å; V81-L84 HydrophobicContact CB-CB 3.94Å; V81-L84 HydrophobicContact CB-CD2 4.17Å; V81-L84 HydrophobicContact CG1-CB 3.79Å; V81-L84 HydrophobicContact CG1-CD2 4.38Å; V81-L84 VanDerWaalsContact O-CB 3.26Å; V81-L84 WeakPolarHBondContact O-CB 3.38Å; V81-L84 PolarHBondContact O-N 3.15Å
82	P	82.3	Confident	93.1	Very high	106 Å²	106	70 Å²	70	69%	0.688	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-56.4	-38.3	-167.1	-27.2	34.7	0	0	0	114	L84	P82-L84 VanDerWaalsContact C-N 3.25Å; P82-L84 PolarHBondContact O-N 3.21Å
83	Q	89.6	Confident	93.1	Very high	156 Å²	156	68.5 Å²	68.5	73%	0.729	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-65.4	-28.7	-177.9	-32.6	-77.2	19.9	0	0	112.4	V81 Y85 S86	V81-Q83 VanDerWaalsContact C-N 3.26Å; V81-Q83 PolarHBondContact O-N 3.47Å; V81-Q83 VanDerWaalsContact O-N 3.17Å; Q83-Y85 VanDerWaalsContact C-N 3.29Å; Q83-Y85 PolarHBondContact O-N 2.82Å; Q83-S86 PolarHBondContact O-N 3.44Å; Q83-S86 PolarHBondContact O-OG 3.38Å
84	L	92.2	Very high	93	Very high	25 Å²	25	69.5 Å²	69.5	13%	0.131	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-68.7	-25.6	-167.9	-170.4	63	0	0	0	113.2	F64 Y65 V81 P82 L89 H105	F64-L84 HydrophobicContact CD2-CD2 4Å; Y65-L84 HydrophobicContact CD2-CD1 4.11Å; Y65-L84 HydrophobicContact CE2-CD1 3.99Å; Y65-L84 HydrophobicContact CE2-CD2 4.08Å; Y65-L84 HydrophobicContact CE2-CG 4.13Å; V81-L84 HydrophobicContact CB-CB 3.94Å; V81-L84 HydrophobicContact CB-CD2 4.17Å; V81-L84 HydrophobicContact CG1-CB 3.79Å; V81-L84 HydrophobicContact CG1-CD2 4.38Å; V81-L84 VanDerWaalsContact O-CB 3.26Å; V81-L84 WeakPolarHBondContact O-CB 3.38Å; V81-L84 PolarHBondContact O-N 3.15Å; P82-L84 VanDerWaalsContact C-N 3.25Å; P82-L84 PolarHBondContact O-N 3.21Å; L84-L89 WeakPolarHBondContact O-CD2 3.44Å; L84-H105 WeakPolarHBondContact CD1-NE2 3.37Å; L84-H105 PolarHBondContact O-CE1 3.05Å; L84-H105 PolarHBondContact O-NE2 3.36Å
85	Y	91.1	Very high	92.8	Very high	45 Å²	45	71.1 Å²	71.1	18%	0.176	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-128.9	28.4	-178.3	-52.4	-67.8	0	0	0	112.4	Y65 Q83 V106 F107 W140 C144	Y65-Y85 HydrophobicContact CE2-CE1 4.21Å; Y65-Y85 VanDerWaalsContact OH-CE1 3.29Å; Y65-Y85 WeakPolarHBondContact OH-CE1 3.42Å; Y65-Y85 PolarHBondContact OH-OH 3.08Å; Q83-Y85 VanDerWaalsContact C-N 3.29Å; Q83-Y85 PolarHBondContact O-N 2.82Å; Y85-V106 HydrophobicContact CE1-CG1 4.33Å; Y85-F107 HydrophobicContact CD1-CE1 4.44Å; Y85-F107 HydrophobicContact CD1-CZ 4.01Å; Y85-W140 HydrophobicContact CD2-CZ2 4.25Å; Y85-W140 AromaticContact CD2-NE1 3.72Å; Y85-W140 HydrophobicContact CE2-CZ2 4.47Å; Y85-W140 AromaticContact CE2-NE1 3.18Å; Y85-W140 AromaticContact CZ-NE1 3.55Å; Y85-C144 HydrophobicContact CD1-CB 4.08Å; Y85-C144 VanDerWaalsContact CD1-SG 3.59Å; Y85-C144 HydrophobicContact CE1-CB 4.24Å
86	S	92.1	Very high	92.7	Very high	26 Å²	26	69.5 Å²	69.5	18%	0.182	36%	0.364	C	S	.	.			trans	-67.3	144.6	179.6	61.3	0	0	0	0	111.7	Q83 E88 L89 M90	Q83-S86 PolarHBondContact O-N 3.44Å; Q83-S86 PolarHBondContact O-OG 3.38Å; S86-E88 PolarHBondContact O-N 2.81Å; S86-L89 PolarHBondContact O-N 3.15Å; S86-L89 VanDerWaalsContact O-N 3.13Å; S86-L89 VanDerWaalsContact OG-CB 3.26Å; S86-L89 WeakPolarHBondContact OG-CB 3.14Å; S86-L89 PolarHBondContact OG-N 3.15Å; S86-M90 WeakPolarHBondContact O-CG 3.34Å; S86-M90 PolarHBondContact O-N 3.35Å
87	P	89.5	Confident	92.6	Very high	63 Å²	63	72.8 Å²	72.8	41%	0.409	39%	0.389	S	S	.	.	H	α-helix	trans	-58.2	-28.8	172.9	-24.8	34.7	0	0	0	113.4	R91	P87-R91 WeakPolarHBondContact O-CG 3.15Å; P87-R91 PolarHBondContact O-N 3.23Å; P87-R91 VanDerWaalsContact O-N 3.1Å; P87-R91 PolarHBondContact O-NE 3.43Å; P87-R91 VanDerWaalsContact O-NE 3.15Å
88	E	92.6	Very high	92.5	Very high	111 Å²	111	76.3 Å²	76.3	52%	0.519	40%	0.403	S	S	.	.	H	α-helix	trans	-62.7	-49.4	173.9	-67.8	63.3	-135.5	0	0	110.5	S86 M90 R91 E92	S86-E88 PolarHBondContact O-N 2.81Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 2.9Å; E88-R91 PolarHBondContact O-N 2.79Å; E88-R91 IonicContact OE1-CZ 3.84Å; E88-R91 IonicContact OE1-NH2 3.32Å; E88-R91 PolarHBondContact OE1-NH2 3.19Å; E88-E92 PolarHBondContact O-N 2.69Å
89	L	94.9	Very high	92.4	Very high	33 Å²	33	68.4 Å²	68.4	17%	0.173	37%	0.369	C	S	.	.	H	α-helix	trans	-64.1	-40.5	177.5	-169.1	66.3	0	0	0	111.2	L84 S86 R91 E92 Y93 F107	L84-L89 WeakPolarHBondContact O-CD2 3.44Å; S86-L89 PolarHBondContact O-N 3.15Å; S86-L89 VanDerWaalsContact O-N 3.13Å; S86-L89 VanDerWaalsContact OG-CB 3.26Å; S86-L89 WeakPolarHBondContact OG-CB 3.14Å; S86-L89 PolarHBondContact OG-N 3.15Å; L89-R91 VanDerWaalsContact C-N 3.29Å; L89-R91 PolarHBondContact O-N 2.96Å; L89-E92 WeakPolarHBondContact O-CB 3.45Å; L89-E92 PolarHBondContact O-N 2.91Å; L89-E92 VanDerWaalsContact O-N 3.15Å; L89-Y93 HydrophobicContact CD1-CD2 4.12Å; L89-Y93 HydrophobicContact CD1-CE2 3.69Å; L89-Y93 HydrophobicContact CD2-CE2 4.36Å; L89-Y93 HydrophobicContact CG-CD2 4.01Å; L89-Y93 HydrophobicContact CG-CE2 3.81Å; L89-Y93 WeakPolarHBondContact O-CD2 3.47Å; L89-Y93 PolarHBondContact O-N 3.31Å; L89-F107 HydrophobicContact CB-CE2 4.31Å; L89-F107 HydrophobicContact CD2-CD2 4.4Å; L89-F107 HydrophobicContact CD2-CE2 4.13Å; L89-F107 HydrophobicContact CG-CD2 4.24Å; L89-F107 HydrophobicContact CG-CE2 4.19Å
90	M	94.8	Very high	92.3	Very high	5 Å²	5	68.9 Å²	68.9	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-55.7	-45.8	174.1	-65.8	177.7	-177.1	0	0	111.6	S86 E88 Y93 H94 F107 K147 F148 V151	S86-M90 WeakPolarHBondContact O-CG 3.34Å; S86-M90 PolarHBondContact O-N 3.35Å; E88-M90 VanDerWaalsContact C-N 3.35Å; E88-M90 PolarHBondContact O-N 2.9Å; M90-Y93 PolarHBondContact O-N 2.82Å; M90-H94 PolarHBondContact O-N 2.8Å; M90-H94 VanDerWaalsContact O-N 3.1Å; M90-F107 HydrophobicContact CB-CE2 4.35Å; M90-F107 HydrophobicContact CE-CE1 3.88Å; M90-F107 HydrophobicContact CE-CE2 4.47Å; M90-F107 HydrophobicContact CE-CZ 3.53Å; M90-F107 HydrophobicContact CG-CD1 4.4Å; M90-F107 HydrophobicContact CG-CD2 4.04Å; M90-F107 HydrophobicContact CG-CE1 3.88Å; M90-F107 HydrophobicContact CG-CE2 3.46Å; M90-F107 VanDerWaalsContact CG-CE2 3.46Å; M90-F107 HydrophobicContact CG-CG 4.5Å; M90-F107 HydrophobicContact CG-CZ 3.38Å; M90-F107 HydrophobicContact SD-CZ 4.29Å; M90-K147 HydrophobicContact CE-CB 3.95Å; M90-F148 HydrophobicContact CB-CD2 3.85Å; M90-F148 HydrophobicContact CB-CE2 4.36Å; M90-F148 HydrophobicContact CG-CD2 3.96Å; M90-F148 WeakPolarHBondContact O-CE2 3.48Å; M90-F148 HydrophobicContact SD-CB 4.4Å; M90-V151 HydrophobicContact CB-CG1 4.31Å; M90-V151 HydrophobicContact SD-CB 4.19Å; M90-V151 HydrophobicContact SD-CG2 3.8Å
91	R	93.5	Very high	92.5	Very high	130 Å²	130	70.7 Å²	70.7	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-36.5	177	-77.8	177.7	-83	143.5	-8.8	112.5	P87 E88 L89 H94 A95 V151	P87-R91 WeakPolarHBondContact O-CG 3.15Å; P87-R91 PolarHBondContact O-N 3.23Å; P87-R91 VanDerWaalsContact O-N 3.1Å; P87-R91 PolarHBondContact O-NE 3.43Å; P87-R91 VanDerWaalsContact O-NE 3.15Å; E88-R91 PolarHBondContact O-N 2.79Å; E88-R91 IonicContact OE1-CZ 3.84Å; E88-R91 IonicContact OE1-NH2 3.32Å; E88-R91 PolarHBondContact OE1-NH2 3.19Å; L89-R91 VanDerWaalsContact C-N 3.29Å; L89-R91 PolarHBondContact O-N 2.96Å; R91-H94 PolarHBondContact O-N 2.84Å; R91-A95 VanDerWaalsContact O-CB 3.31Å; R91-A95 WeakPolarHBondContact O-CB 3.46Å; R91-A95 PolarHBondContact O-N 3.32Å; R91-V151 HydrophobicContact CG-CG1 4.17Å
92	E	95.5	Very high	92.7	Very high	106 Å²	106	71.3 Å²	71.3	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-50.2	175.1	-174	-173.2	151.7	0	0	111.6	E88 L89 H94 A95 A96	E88-E92 PolarHBondContact O-N 2.69Å; L89-E92 WeakPolarHBondContact O-CB 3.45Å; L89-E92 PolarHBondContact O-N 2.91Å; L89-E92 VanDerWaalsContact O-N 3.15Å; E92-H94 VanDerWaalsContact C-N 3.29Å; E92-H94 PolarHBondContact O-N 3.15Å; E92-A95 PolarHBondContact O-N 3.1Å; E92-A96 PolarHBondContact O-N 2.71Å; E92-A96 VanDerWaalsContact O-N 3.08Å
93	Y	97.1	Very high	93.3	Very high	9 Å²	9	71.8 Å²	71.8	4%	0.035	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-37	177.5	-83.6	-96	0	0	0	112.2	L89 M90 L102 K103 H105 F107 T108	L89-Y93 HydrophobicContact CD1-CD2 4.12Å; L89-Y93 HydrophobicContact CD1-CE2 3.69Å; L89-Y93 HydrophobicContact CD2-CE2 4.36Å; L89-Y93 HydrophobicContact CG-CD2 4.01Å; L89-Y93 HydrophobicContact CG-CE2 3.81Å; L89-Y93 WeakPolarHBondContact O-CD2 3.47Å; L89-Y93 PolarHBondContact O-N 3.31Å; M90-Y93 PolarHBondContact O-N 2.82Å; Y93-L102 HydrophobicContact CD1-CB 4.35Å; Y93-L102 HydrophobicContact CD1-CD1 3.62Å; Y93-L102 HydrophobicContact CD2-CD1 4.23Å; Y93-L102 HydrophobicContact CE1-CB 3.69Å; Y93-L102 HydrophobicContact CE1-CD1 3.75Å; Y93-L102 HydrophobicContact CE1-CG 4.39Å; Y93-L102 HydrophobicContact CE2-CD1 4.37Å; Y93-L102 HydrophobicContact CG-CD1 3.86Å; Y93-K103 PolarHBondContact OH-O 3.23Å; Y93-H105 HydrophobicContact CE1-CB 3.7Å; Y93-H105 HydrophobicContact CE2-CB 4.15Å; Y93-H105 VanDerWaalsContact CZ-CB 3.46Å; Y93-H105 WeakPolarHBondContact OH-CB 3.29Å; Y93-F107 HydrophobicContact CD1-CB 3.98Å; Y93-F107 HydrophobicContact CD2-CB 4Å; Y93-F107 AromaticContact CD2-CD2 4Å; Y93-F107 HydrophobicContact CD2-CD2 4Å; Y93-F107 HydrophobicContact CE2-CD2 4.47Å; Y93-F107 HydrophobicContact CG-CB 3.63Å; Y93-F107 HydrophobicContact CG-CD2 4.46Å; Y93-T108 WeakPolarHBondContact CD1-OG1 3.38Å; Y93-T108 WeakPolarHBondContact CE1-OG1 3.42Å
94	H	95.3	Very high	93.7	Very high	63 Å²	63	64.8 Å²	64.8	29%	0.292	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-44.9	177.4	-173.3	53.1	0	0	0	112.7	M90 R91 E92 A96 E111 Y114 R115 V152	M90-H94 PolarHBondContact O-N 2.8Å; M90-H94 VanDerWaalsContact O-N 3.1Å; R91-H94 PolarHBondContact O-N 2.84Å; E92-H94 VanDerWaalsContact C-N 3.29Å; E92-H94 PolarHBondContact O-N 3.15Å; H94-A96 VanDerWaalsContact C-N 3.31Å; H94-A96 PolarHBondContact O-N 2.88Å; H94-E111 IonicContact CE1-OE1 3.28Å; H94-E111 IonicContact CE1-OE2 2.96Å; H94-E111 IonicContact CG-OE2 3.39Å; H94-E111 IonicContact ND1-OE1 2.69Å; H94-E111 PolarHBondContact ND1-OE1 3.23Å; H94-E111 IonicContact ND1-OE2 2.63Å; H94-E111 PolarHBondContact ND1-OE2 3.39Å; H94-Y114 AromaticContact CE1-CE1 3.66Å; H94-R115 PolarHBondContact O-NH2 3.04Å; H94-V152 HydrophobicContact CB-CB 4.4Å; H94-V152 HydrophobicContact CB-CG1 3.6Å
95	A	94.2	Very high	94	Very high	79 Å²	79	63.9 Å²	63.9	65%	0.653	32%	0.324	S	S	*	.	H	α-helix	trans	-73.5	-21.4	-177.7	0	0	0	0	0	113.3	R91 E92 P97	R91-A95 VanDerWaalsContact O-CB 3.31Å; R91-A95 WeakPolarHBondContact O-CB 3.46Å; R91-A95 PolarHBondContact O-N 3.32Å; E92-A95 PolarHBondContact O-N 3.1Å; A95-P97 WeakPolarHBondContact O-CD 3.38Å
96	A	95.9	Very high	94.3	Very high	15 Å²	15	62 Å²	62	12%	0.124	32%	0.317	C	S	.	.			trans	-64.6	125.7	-177.3	0	0	0	0	0	111.7	E92 H94 Q98 L102 R115	E92-A96 PolarHBondContact O-N 2.71Å; E92-A96 VanDerWaalsContact O-N 3.08Å; H94-A96 VanDerWaalsContact C-N 3.31Å; H94-A96 PolarHBondContact O-N 2.88Å; A96-Q98 PolarHBondContact O-N 3.1Å; A96-L102 HydrophobicContact CB-CD1 3.66Å; A96-L102 HydrophobicContact CB-CG 4.2Å; A96-R115 PolarHBondContact O-NH2 3.19Å
97	P	93.8	Very high	94.5	Very high	117 Å²	117	60.7 Å²	60.7	76%	0.76	31%	0.308	S	S	*	.	S	Bend	trans	-59.2	-34.5	177.3	-25.2	34	0	0	0	112.7	A95 R115	A95-P97 WeakPolarHBondContact O-CD 3.38Å; P97-R115 PolarHBondContact O-NH1 2.89Å
98	Q	93.1	Very high	94.9	Very high	91 Å²	91	58.9 Å²	58.9	43%	0.425	30%	0.296	S	S	.	.			trans	-130	77.9	-177.2	-68.1	177.6	-18.7	0	0	110	A96 Q100 K101	A96-Q98 PolarHBondContact O-N 3.1Å; Q98-Q100 VanDerWaalsContact CA-OE1 3.28Å; Q98-Q100 PolarHBondContact O-N 3.35Å; Q98-Q100 VanDerWaalsContact O-N 3.15Å; Q98-K101 HydrophobicContact CB-CB 4.44Å; Q98-K101 HydrophobicContact CB-CD 4.14Å; Q98-K101 HydrophobicContact CB-CG 4.14Å; Q98-K101 WeakPolarHBondContact O-CB 3.38Å; Q98-K101 PolarHBondContact O-N 2.91Å
99	P	91.1	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24	-175.8	26.3	-35.9	0	0	0	113	K101 L102 T108 E111	P99-K101 PolarHBondContact O-N 3.47Å; P99-L102 WeakPolarHBondContact O-CB 3.37Å; P99-L102 PolarHBondContact O-N 3.1Å; P99-L102 VanDerWaalsContact O-N 3.15Å; P99-T108 HydrophobicContact CB-CG2 4.36Å; P99-E111 HydrophobicContact CB-CG 4.21Å; P99-E111 HydrophobicContact CG-CB 4.49Å; P99-E111 HydrophobicContact CG-CG 3.93Å
100	Q	90.5	Very high	95.1	Very high	110 Å²	110	54.3 Å²	54.3	51%	0.514	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-67.4	-16.5	173.7	73	-78.9	13.5	0	0	114.4	Q98	Q98-Q100 VanDerWaalsContact CA-OE1 3.28Å; Q98-Q100 PolarHBondContact O-N 3.35Å; Q98-Q100 VanDerWaalsContact O-N 3.15Å
101	K	92.4	Very high	95.2	Very high	159 Å²	159	54.3 Å²	54.3	69%	0.691	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-88.1	-13.1	173.4	-70	-171.3	174.8	172.7	0	112.9	Q98 P99	Q98-K101 HydrophobicContact CB-CB 4.44Å; Q98-K101 HydrophobicContact CB-CD 4.14Å; Q98-K101 HydrophobicContact CB-CG 4.14Å; Q98-K101 WeakPolarHBondContact O-CB 3.38Å; Q98-K101 PolarHBondContact O-N 2.91Å; P99-K101 PolarHBondContact O-N 3.47Å
102	L	95.1	Very high	95.2	Very high	49 Å²	49	52.2 Å²	52.2	26%	0.257	27%	0.273	S	S	.	.	S	Bend	trans	-72.8	174.3	171.7	-59.9	-178.9	0	0	0	110.2	Y93 A96 P99	Y93-L102 HydrophobicContact CD1-CB 4.35Å; Y93-L102 HydrophobicContact CD1-CD1 3.62Å; Y93-L102 HydrophobicContact CD2-CD1 4.23Å; Y93-L102 HydrophobicContact CE1-CB 3.69Å; Y93-L102 HydrophobicContact CE1-CD1 3.75Å; Y93-L102 HydrophobicContact CE1-CG 4.39Å; Y93-L102 HydrophobicContact CE2-CD1 4.37Å; Y93-L102 HydrophobicContact CG-CD1 3.86Å; A96-L102 HydrophobicContact CB-CD1 3.66Å; A96-L102 HydrophobicContact CB-CG 4.2Å; P99-L102 WeakPolarHBondContact O-CB 3.37Å; P99-L102 PolarHBondContact O-N 3.1Å; P99-L102 VanDerWaalsContact O-N 3.15Å
103	K	95.8	Very high	95.2	Very high	116 Å²	116	48.2 Å²	48.2	50%	0.504	26%	0.255	S	S	.	.			trans	-57.5	149.2	174	-72.3	-66.8	-176.6	-179.3	0	110.7	D38 Y93 H105	D38-K103 IonicContact OD1-NZ 3.3Å; D38-K103 PolarHBondContact OD1-NZ 3.3Å; D38-K103 VanDerWaalsContact OD2-CD 3.32Å; D38-K103 WeakPolarHBondContact OD2-CD 3.48Å; D38-K103 IonicContact OD2-NZ 2.67Å; D38-K103 PolarHBondContact OD2-NZ 3.19Å; Y93-K103 PolarHBondContact OH-O 3.23Å; K103-H105 PolarHBondContact O-N 3.47Å
104	P	97.4	Very high	95	Very high	9 Å²	9	49.6 Å²	49.6	6%	0.058	26%	0.261	C	S	.	.	S	Bend	trans	-55.6	128.5	174.2	-24.8	33.8	0	0	0	110.2	D38 Y65 L72	D38-P104 HydrophobicContact CB-CG 3.57Å; D38-P104 WeakPolarHBondContact O-CG 3.46Å; Y65-P104 WeakPolarHBondContact CB-O 3.46Å; L72-P104 HydrophobicContact CD1-CB 3.92Å
105	H	97.7	Very high	94.9	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.028	26%	0.259	C	S	.	.			trans	-159.5	155.1	179.2	-156.3	-99.8	0	0	0	111.5	Y65 L72 L84 Y93 K103 F107 T108	Y65-H105 AromaticContact CD2-CD2 3.45Å; Y65-H105 VanDerWaalsContact CD2-CD2 3.45Å; Y65-H105 WeakPolarHBondContact CD2-CD2 3.31Å; Y65-H105 AromaticContact CD2-NE2 3.79Å; Y65-H105 AromaticContact CE2-CD2 3.65Å; Y65-H105 AromaticContact CE2-NE2 3.47Å; Y65-H105 WeakPolarHBondContact CE2-NE2 3.46Å; L72-H105 VanDerWaalsContact CD2-C 3.45Å; L84-H105 WeakPolarHBondContact CD1-NE2 3.37Å; L84-H105 PolarHBondContact O-CE1 3.05Å; L84-H105 PolarHBondContact O-NE2 3.36Å; Y93-H105 HydrophobicContact CE1-CB 3.7Å; Y93-H105 HydrophobicContact CE2-CB 4.15Å; Y93-H105 VanDerWaalsContact CZ-CB 3.46Å; Y93-H105 WeakPolarHBondContact OH-CB 3.29Å; K103-H105 PolarHBondContact O-N 3.47Å; H105-F107 AromaticContact CE1-CD2 3.35Å; H105-F107 WeakPolarHBondContact CE1-CD2 3.19Å; H105-F107 AromaticContact CE1-CE2 3.34Å; H105-F107 WeakPolarHBondContact CE1-CE2 3.22Å; H105-F107 AromaticContact CE1-CG 3.69Å; H105-F107 AromaticContact CE1-CZ 3.68Å; H105-F107 AromaticContact ND1-CD1 3.8Å; H105-F107 AromaticContact ND1-CD2 3.14Å; H105-F107 WeakPolarHBondContact ND1-CD2 3.34Å; H105-F107 AromaticContact ND1-CE2 3.68Å; H105-F107 AromaticContact ND1-CG 3.19Å; H105-F107 WeakPolarHBondContact ND1-CG 3.14Å; H105-F107 PolarHBondContact ND1-N 3.07Å; H105-F107 PolarHBondContact O-N 2.81Å; H105-T108 WeakPolarHBondContact O-CB 3.4Å; H105-T108 PolarHBondContact O-N 2.71Å
106	V	97.3	Very high	94.8	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.024	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-26.3	174.5	71.4	0	0	0	0	112.1	Y65 L72 Y85 T108 V109 G110 T141 L145	Y65-V106 HydrophobicContact CE1-CB 4.09Å; L72-V106 HydrophobicContact CD2-CB 4.33Å; Y85-V106 HydrophobicContact CE1-CG1 4.33Å; V106-T108 VanDerWaalsContact C-N 3.32Å; V106-T108 PolarHBondContact O-N 2.96Å; V106-V109 WeakPolarHBondContact O-CB 3.35Å; V106-V109 PolarHBondContact O-N 2.69Å; V106-G110 PolarHBondContact O-N 3.43Å; V106-T141 HydrophobicContact CG2-CG2 3.78Å; V106-L145 HydrophobicContact CG2-CD1 4.05Å; V106-L145 HydrophobicContact CG2-CD2 3.77Å; V106-L145 HydrophobicContact CG2-CG 3.66Å
107	F	97.4	Very high	94.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.9	-27.3	177.3	-59.1	-23.6	0	0	0	112.7	Y85 L89 M90 Y93 H105 V109 G110 E111 F148	Y85-F107 HydrophobicContact CD1-CE1 4.44Å; Y85-F107 HydrophobicContact CD1-CZ 4.01Å; L89-F107 HydrophobicContact CB-CE2 4.31Å; L89-F107 HydrophobicContact CD2-CD2 4.4Å; L89-F107 HydrophobicContact CD2-CE2 4.13Å; L89-F107 HydrophobicContact CG-CD2 4.24Å; L89-F107 HydrophobicContact CG-CE2 4.19Å; M90-F107 HydrophobicContact CB-CE2 4.35Å; M90-F107 HydrophobicContact CE-CE1 3.88Å; M90-F107 HydrophobicContact CE-CE2 4.47Å; M90-F107 HydrophobicContact CE-CZ 3.53Å; M90-F107 HydrophobicContact CG-CD1 4.4Å; M90-F107 HydrophobicContact CG-CD2 4.04Å; M90-F107 HydrophobicContact CG-CE1 3.88Å; M90-F107 HydrophobicContact CG-CE2 3.46Å; M90-F107 VanDerWaalsContact CG-CE2 3.46Å; M90-F107 HydrophobicContact CG-CG 4.5Å; M90-F107 HydrophobicContact CG-CZ 3.38Å; M90-F107 HydrophobicContact SD-CZ 4.29Å; Y93-F107 HydrophobicContact CD1-CB 3.98Å; Y93-F107 HydrophobicContact CD2-CB 4Å; Y93-F107 AromaticContact CD2-CD2 4Å; Y93-F107 HydrophobicContact CD2-CD2 4Å; Y93-F107 HydrophobicContact CE2-CD2 4.47Å; Y93-F107 HydrophobicContact CG-CB 3.63Å; Y93-F107 HydrophobicContact CG-CD2 4.46Å; H105-F107 AromaticContact CE1-CD2 3.35Å; H105-F107 WeakPolarHBondContact CE1-CD2 3.19Å; H105-F107 AromaticContact CE1-CE2 3.34Å; H105-F107 WeakPolarHBondContact CE1-CE2 3.22Å; H105-F107 AromaticContact CE1-CG 3.69Å; H105-F107 AromaticContact CE1-CZ 3.68Å; H105-F107 AromaticContact ND1-CD1 3.8Å; H105-F107 AromaticContact ND1-CD2 3.14Å; H105-F107 WeakPolarHBondContact ND1-CD2 3.34Å; H105-F107 AromaticContact ND1-CE2 3.68Å; H105-F107 AromaticContact ND1-CG 3.19Å; H105-F107 WeakPolarHBondContact ND1-CG 3.14Å; H105-F107 PolarHBondContact ND1-N 3.07Å; H105-F107 PolarHBondContact O-N 2.81Å; F107-V109 VanDerWaalsContact C-N 3.32Å; F107-G110 PolarHBondContact O-N 3.18Å; F107-E111 WeakPolarHBondContact O-CB 3.37Å; F107-E111 PolarHBondContact O-N 2.98Å; F107-F148 HydrophobicContact CB-CD2 3.9Å; F107-F148 HydrophobicContact CB-CE2 3.84Å; F107-F148 HydrophobicContact CD1-CB 3.91Å; F107-F148 AromaticContact CD1-CD2 3.56Å; F107-F148 HydrophobicContact CD1-CD2 3.56Å; F107-F148 HydrophobicContact CD1-CE2 4.38Å; F107-F148 AromaticContact CD1-CG 3.92Å; F107-F148 HydrophobicContact CD1-CG 3.92Å; F107-F148 HydrophobicContact CD2-CD2 4.44Å; F107-F148 HydrophobicContact CE1-CB 4.04Å; F107-F148 HydrophobicContact CE1-CD2 4.23Å; F107-F148 HydrophobicContact CE1-CG 4.5Å; F107-F148 AromaticContact CG-CD2 3.71Å; F107-F148 HydrophobicContact CG-CD2 3.71Å; F107-F148 HydrophobicContact CG-CE2 4.13Å; F107-F148 HydrophobicContact CG-CG 4.48Å
108	T	96.9	Very high	94.3	Very high	24 Å²	24	52 Å²	52	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-42.2	169.8	-52.5	0	0	0	0	110.9	Y93 P99 H105 V106 Q112	Y93-T108 WeakPolarHBondContact CD1-OG1 3.38Å; Y93-T108 WeakPolarHBondContact CE1-OG1 3.42Å; P99-T108 HydrophobicContact CB-CG2 4.36Å; H105-T108 WeakPolarHBondContact O-CB 3.4Å; H105-T108 PolarHBondContact O-N 2.71Å; V106-T108 VanDerWaalsContact C-N 3.32Å; V106-T108 PolarHBondContact O-N 2.96Å; T108-Q112 WeakPolarHBondContact O-CB 3.43Å; T108-Q112 PolarHBondContact O-N 2.89Å
109	V	96.9	Very high	93.9	Very high	49 Å²	49	51.8 Å²	51.8	30%	0.297	26%	0.255	S	S	.	.	H	α-helix	trans	-64.3	-48.3	176.6	-177.3	0	0	0	0	110.2	L72 V106 F107 E111 Q112 T113 I128	L72-V109 HydrophobicContact CB-CG2 4.16Å; L72-V109 HydrophobicContact CD2-CG2 3.97Å; V106-V109 WeakPolarHBondContact O-CB 3.35Å; V106-V109 PolarHBondContact O-N 2.69Å; F107-V109 VanDerWaalsContact C-N 3.32Å; V109-E111 PolarHBondContact O-N 3.33Å; V109-Q112 PolarHBondContact O-N 2.96Å; V109-T113 PolarHBondContact O-N 3.36Å; V109-T113 PolarHBondContact O-OG1 3.08Å; V109-I128 HydrophobicContact CG1-CD1 4.07Å; V109-I128 HydrophobicContact CG1-CG1 4.26Å; V109-I128 HydrophobicContact CG1-CG2 4.16Å
110	G	96.1	Very high	93.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.7	-46.9	176.6	0	0	0	0	0	112.8	V106 F107 T113 Y114 Y149	V106-G110 PolarHBondContact O-N 3.43Å; F107-G110 PolarHBondContact O-N 3.18Å; G110-T113 PolarHBondContact O-N 3.5Å; G110-Y114 WeakPolarHBondContact O-CB 3.39Å; G110-Y114 PolarHBondContact O-N 3.24Å; G110-Y149 WeakPolarHBondContact O-CE1 3.44Å; G110-Y149 PolarHBondContact O-OH 2.63Å
111	E	95.9	Very high	92.7	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.019	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-42.1	179.9	-177.5	59	-165.7	0	0	111.9	H94 P99 F107 V109 T113 Y114 R115 F148	H94-E111 IonicContact CE1-OE1 3.28Å; H94-E111 IonicContact CE1-OE2 2.96Å; H94-E111 IonicContact CG-OE2 3.39Å; H94-E111 IonicContact ND1-OE1 2.69Å; H94-E111 PolarHBondContact ND1-OE1 3.23Å; H94-E111 IonicContact ND1-OE2 2.63Å; H94-E111 PolarHBondContact ND1-OE2 3.39Å; P99-E111 HydrophobicContact CB-CG 4.21Å; P99-E111 HydrophobicContact CG-CB 4.49Å; P99-E111 HydrophobicContact CG-CG 3.93Å; F107-E111 WeakPolarHBondContact O-CB 3.37Å; F107-E111 PolarHBondContact O-N 2.98Å; V109-E111 PolarHBondContact O-N 3.33Å; E111-T113 VanDerWaalsContact C-N 3.34Å; E111-T113 PolarHBondContact O-N 2.97Å; E111-Y114 PolarHBondContact O-N 3.49Å; E111-R115 HydrophobicContact CG-CG 4.49Å; E111-R115 WeakPolarHBondContact O-CB 3.4Å; E111-R115 WeakPolarHBondContact O-CG 3.45Å; E111-R115 PolarHBondContact O-N 3.19Å; E111-R115 IonicContact OE1-CZ 3.95Å; E111-R115 VanDerWaalsContact OE1-CZ 3.28Å; E111-R115 IonicContact OE1-NE 3.74Å; E111-R115 PolarHBondContact OE1-NE 3.27Å; E111-R115 IonicContact OE1-NH2 2.75Å; E111-R115 PolarHBondContact OE1-NH2 3.44Å; E111-F148 HydrophobicContact CB-CE1 4.33Å; E111-F148 HydrophobicContact CB-CZ 3.87Å; E111-F148 WeakPolarHBondContact OE2-CZ 3.21Å
112	Q	94.4	Very high	92.4	Very high	86 Å²	86	59 Å²	59	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-45.7	176.3	-173.9	61.9	56.1	0	0	111.1	T108 V109 R115 N116	T108-Q112 WeakPolarHBondContact O-CB 3.43Å; T108-Q112 PolarHBondContact O-N 2.89Å; V109-Q112 PolarHBondContact O-N 2.96Å; Q112-R115 PolarHBondContact O-N 2.95Å; Q112-N116 PolarHBondContact NE2-OD1 2.96Å; Q112-N116 WeakPolarHBondContact O-CB 3.01Å; Q112-N116 PolarHBondContact O-N 2.97Å; Q112-N116 PolarHBondContact O-OD1 2.78Å
113	T	94.4	Very high	91.9	Very high	22 Å²	22	60.9 Å²	60.9	14%	0.135	31%	0.312	C	S	.	.	H	α-helix	trans	-60.2	-45.1	175.2	-66.1	0	0	0	0	111.7	V109 G110 E111 N116 V117 Q126 I128 Y149	V109-T113 PolarHBondContact O-N 3.36Å; V109-T113 PolarHBondContact O-OG1 3.08Å; G110-T113 PolarHBondContact O-N 3.5Å; E111-T113 VanDerWaalsContact C-N 3.34Å; E111-T113 PolarHBondContact O-N 2.97Å; T113-N116 PolarHBondContact O-N 3.39Å; T113-V117 WeakPolarHBondContact O-CG2 3.42Å; T113-V117 PolarHBondContact O-N 3.49Å; T113-Q126 HydrophobicContact CG2-CB 3.55Å; T113-Q126 HydrophobicContact CG2-CG 3.96Å; T113-I128 HydrophobicContact CG2-CD1 4.26Å; T113-I128 HydrophobicContact CG2-CG1 4.44Å; T113-Y149 WeakPolarHBondContact CB-OH 3.2Å; T113-Y149 VanDerWaalsContact CG2-OH 3.28Å; T113-Y149 WeakPolarHBondContact CG2-OH 3.46Å
114	Y	93.3	Very high	91.7	Very high	38 Å²	38	59.3 Å²	59.3	15%	0.149	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-46.8	177.9	179.8	-95.6	0	0	0	112.2	H94 G110 E111 V117 K118 Y149 V152	H94-Y114 AromaticContact CE1-CE1 3.66Å; G110-Y114 WeakPolarHBondContact O-CB 3.39Å; G110-Y114 PolarHBondContact O-N 3.24Å; E111-Y114 PolarHBondContact O-N 3.49Å; Y114-V117 PolarHBondContact O-N 3.47Å; Y114-K118 HydrophobicContact CE1-CD 3.66Å; Y114-K118 HydrophobicContact CE1-CG 4.29Å; Y114-K118 PolarHBondContact O-N 2.9Å; Y114-K118 VanDerWaalsContact O-N 3.08Å; Y114-K118 WeakPolarHBondContact OH-CE 3.49Å; Y114-K118 PolarHBondContact OH-NZ 3.2Å; Y114-Y149 HydrophobicContact CD2-CD1 4.41Å; Y114-V152 HydrophobicContact CD2-CG2 4.1Å; Y114-V152 HydrophobicContact CE2-CG2 4.05Å; Y114-V152 HydrophobicContact CG-CG2 4.47Å
115	R	92.6	Very high	91.4	Very high	69 Å²	69	66.5 Å²	66.5	26%	0.26	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-43.1	177.5	-73	-178.8	-171.2	-170.8	5.8	112.1	H94 A96 P97 E111 Q112 V117 K118 S119	H94-R115 PolarHBondContact O-NH2 3.04Å; A96-R115 PolarHBondContact O-NH2 3.19Å; P97-R115 PolarHBondContact O-NH1 2.89Å; E111-R115 HydrophobicContact CG-CG 4.49Å; E111-R115 WeakPolarHBondContact O-CB 3.4Å; E111-R115 WeakPolarHBondContact O-CG 3.45Å; E111-R115 PolarHBondContact O-N 3.19Å; E111-R115 IonicContact OE1-CZ 3.95Å; E111-R115 VanDerWaalsContact OE1-CZ 3.28Å; E111-R115 IonicContact OE1-NE 3.74Å; E111-R115 PolarHBondContact OE1-NE 3.27Å; E111-R115 IonicContact OE1-NH2 2.75Å; E111-R115 PolarHBondContact OE1-NH2 3.44Å; Q112-R115 PolarHBondContact O-N 2.95Å; R115-V117 VanDerWaalsContact C-N 3.27Å; R115-V117 PolarHBondContact O-N 3.19Å; R115-K118 CarbonylContact O-C 3.59Å; R115-K118 PolarHBondContact O-N 3.29Å; R115-K118 VanDerWaalsContact O-N 3.09Å; R115-S119 VanDerWaalsContact O-CB 3.29Å; R115-S119 WeakPolarHBondContact O-CB 3.46Å; R115-S119 PolarHBondContact O-N 3.02Å; R115-S119 PolarHBondContact O-OG 3.45Å; R115-S119 VanDerWaalsContact O-OG 3.12Å
116	N	92.3	Very high	91.3	Very high	50 Å²	50	69.7 Å²	69.7	27%	0.267	37%	0.365	S	S	.	.	H	α-helix	trans	-58.3	-40	177.9	-70.1	-4.8	0	0	0	112.1	Q112 T113 S119 Q126	Q112-N116 PolarHBondContact NE2-OD1 2.96Å; Q112-N116 WeakPolarHBondContact O-CB 3.01Å; Q112-N116 PolarHBondContact O-N 2.97Å; Q112-N116 PolarHBondContact O-OD1 2.78Å; T113-N116 PolarHBondContact O-N 3.39Å; N116-S119 PolarHBondContact O-OG 3.45Å; N116-Q126 HydrophobicContact CB-CG 4.27Å; N116-Q126 PolarHBondContact ND2-OE1 3.37Å; N116-Q126 VanDerWaalsContact ND2-OE1 3.12Å
117	V	91.3	Very high	91.2	Very high	58 Å²	58	74.6 Å²	74.6	35%	0.352	40%	0.4	S	S	.	.	H	α-helix	trans	-67.6	-41.1	175.7	175.6	0	0	0	0	111	T113 Y114 R115 P123 Q126	T113-V117 WeakPolarHBondContact O-CG2 3.42Å; T113-V117 PolarHBondContact O-N 3.49Å; Y114-V117 PolarHBondContact O-N 3.47Å; R115-V117 VanDerWaalsContact C-N 3.27Å; R115-V117 PolarHBondContact O-N 3.19Å; V117-P123 HydrophobicContact CG1-CB 4.18Å; V117-Q126 HydrophobicContact CG2-CB 4.38Å; V117-Q126 HydrophobicContact CG2-CG 3.52Å
118	K	88.1	Confident	91.1	Very high	147 Å²	147	77.3 Å²	77.3	64%	0.639	41%	0.414	S	S	*	.	H	α-helix	trans	-78.6	-26.3	-177.4	-90.7	-157.5	169.7	178	0	115.4	Y114 R115 L120	Y114-K118 HydrophobicContact CE1-CD 3.66Å; Y114-K118 HydrophobicContact CE1-CG 4.29Å; Y114-K118 PolarHBondContact O-N 2.9Å; Y114-K118 VanDerWaalsContact O-N 3.08Å; Y114-K118 WeakPolarHBondContact OH-CE 3.49Å; Y114-K118 PolarHBondContact OH-NZ 3.2Å; R115-K118 CarbonylContact O-C 3.59Å; R115-K118 PolarHBondContact O-N 3.29Å; R115-K118 VanDerWaalsContact O-N 3.09Å; K118-L120 VanDerWaalsContact C-N 3.29Å; K118-L120 PolarHBondContact O-N 2.99Å
119	S	85.3	Confident	91.1	Very high	87 Å²	87	82.2 Å²	82.2	61%	0.608	44%	0.443	S	S	*	.	S	Bend	trans	-78.9	-12.1	-171.1	60	0	0	0	0	114.2	R115 N116	R115-S119 VanDerWaalsContact O-CB 3.29Å; R115-S119 WeakPolarHBondContact O-CB 3.46Å; R115-S119 PolarHBondContact O-N 3.02Å; R115-S119 PolarHBondContact O-OG 3.45Å; R115-S119 VanDerWaalsContact O-OG 3.12Å; N116-S119 PolarHBondContact O-OG 3.45Å
120	L	78.4	Confident	91	Very high	80 Å²	80	82 Å²	82	42%	0.419	44%	0.442	S	S	.	.	S	Bend	trans	-102	138.8	-173.8	-58.6	175.2	0	0	0	110.4	K118 E122 V124	K118-L120 VanDerWaalsContact C-N 3.29Å; K118-L120 PolarHBondContact O-N 2.99Å; L120-E122 WeakPolarHBondContact CB-O 3.28Å; L120-E122 PolarHBondContact O-N 3.27Å; L120-V124 HydrophobicContact CD1-CB 4.01Å; L120-V124 HydrophobicContact CD1-CG2 3.72Å
121	I	78.8	Confident	91	Very high	177 Å²	177	87 Å²	87	91%	0.908	48%	0.477	S	S	*	.	S	Bend	trans	-57.7	-39.7	172.4	-62.3	171.7	0	0	0	109.6
122	E	84.5	Confident	91	Very high	163 Å²	163	88.9 Å²	88.9	76%	0.762	50%	0.497	S	S	*	.	S	Bend	trans	-110.9	108.7	169.6	-67.6	-173.2	173.1	0	0	109.2	L120 V124	L120-E122 WeakPolarHBondContact CB-O 3.28Å; L120-E122 PolarHBondContact O-N 3.27Å; E122-V124 PolarHBondContact O-N 2.94Å
123	P	85.7	Confident	90.9	Very high	89 Å²	89	92.7 Å²	92.7	58%	0.578	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-61	129.2	-179.6	-24.2	33.8	0	0	0	111.9	V117	V117-P123 HydrophobicContact CG1-CB 4.18Å
124	V	91	Very high	90.8	Very high	84 Å²	84	97.6 Å²	97.6	51%	0.509	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-99.7	129.4	174.1	177.9	0	0	0	0	109.7	L120 E122 Q126	L120-V124 HydrophobicContact CD1-CB 4.01Å; L120-V124 HydrophobicContact CD1-CG2 3.72Å; E122-V124 PolarHBondContact O-N 2.94Å; V124-Q126 PolarHBondContact O-N 3.35Å; V124-Q126 PolarHBondContact O-NE2 3.13Å; V124-Q126 VanDerWaalsContact O-NE2 3.09Å
125	N	91.8	Very high	90.6	Very high	159 Å²	159	98.1 Å²	98.1	85%	0.85	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-55.5	133.1	176.9	-68.4	-30.7	0	0	0	111.3
126	Q	94.5	Very high	90.6	Very high	74 Å²	74	96.9 Å²	96.9	35%	0.346	57%	0.571	S	S	.	*			trans	-109.8	154.2	178.9	-57.8	-65.5	-71.9	0	0	110.5	T113 N116 V117 V124	T113-Q126 HydrophobicContact CG2-CB 3.55Å; T113-Q126 HydrophobicContact CG2-CG 3.96Å; N116-Q126 HydrophobicContact CB-CG 4.27Å; N116-Q126 PolarHBondContact ND2-OE1 3.37Å; N116-Q126 VanDerWaalsContact ND2-OE1 3.12Å; V117-Q126 HydrophobicContact CG2-CB 4.38Å; V117-Q126 HydrophobicContact CG2-CG 3.52Å; V124-Q126 PolarHBondContact O-N 3.35Å; V124-Q126 PolarHBondContact O-NE2 3.13Å; V124-Q126 VanDerWaalsContact O-NE2 3.09Å
127	S	95.4	Very high	90.6	Very high	107 Å²	107	95.5 Å²	95.5	75%	0.748	57%	0.569	S	S	*	*			trans	-130.1	141.3	172.1	63.2	0	0	0	0	110.6
128	I	96	Very high	90.7	Very high	57 Å²	57	96 Å²	96	29%	0.292	57%	0.567	S	S	.	*			trans	-116.1	120.1	170.3	-61.2	174.1	0	0	0	106.9	V109 T113 V130 L145 Y149	V109-I128 HydrophobicContact CG1-CD1 4.07Å; V109-I128 HydrophobicContact CG1-CG1 4.26Å; V109-I128 HydrophobicContact CG1-CG2 4.16Å; T113-I128 HydrophobicContact CG2-CD1 4.26Å; T113-I128 HydrophobicContact CG2-CG1 4.44Å; I128-V130 HydrophobicContact CG2-CG2 4.21Å; I128-L145 HydrophobicContact CD1-CD1 3.93Å; I128-L145 HydrophobicContact CD1-CD2 3.94Å; I128-L145 HydrophobicContact CG2-CD1 3.88Å; I128-Y149 VanDerWaalsContact CD1-OH 3.25Å; I128-Y149 WeakPolarHBondContact CD1-OH 3.27Å
129	V	96.6	Very high	90.6	Very high	126 Å²	126	92.1 Å²	92.1	76%	0.764	56%	0.555	S	S	*	*			trans	-97.5	118.1	178.2	179.9	0	0	0	0	109
130	V	95.9	Very high	90.8	Very high	45 Å²	45	93.9 Å²	93.9	27%	0.273	55%	0.549	S	S	.	.			trans	-107.7	105.9	176	-171	0	0	0	0	108.8	I128 K138 T141	I128-V130 HydrophobicContact CG2-CG2 4.21Å; V130-K138 HydrophobicContact CG1-CB 4.04Å; V130-K138 HydrophobicContact CG1-CG 4.18Å; V130-T141 HydrophobicContact CG1-CG2 3.98Å; V130-T141 HydrophobicContact CG2-CG2 4.13Å
131	S	95.6	Very high	91.5	Very high	105 Å²	105	91 Å²	91	73%	0.734	53%	0.534	S	S	*	.			trans	-105.2	161.2	-179.3	60	0	0	0	0	112.1
132	G	94.5	Very high	92.1	Very high	43 Å²	43	85 Å²	85	44%	0.443	51%	0.508	S	S	.	.			trans	147.4	162.1	178.5	0	0	0	0	0	112.7	K138	G132-K138 WeakPolarHBondContact O-CD 3.22Å; G132-K138 WeakPolarHBondContact O-CE 3.43Å; G132-K138 PolarHBondContact O-NZ 3.5Å
133	E	93.6	Very high	92.2	Very high	167 Å²	167	80.3 Å²	80.3	78%	0.78	48%	0.483	S	S	*	.	S	Bend	trans	-69.1	175.9	177.4	-65	-175.6	173	0	0	112.6	G135 A136 K138	E133-G135 PolarHBondContact O-N 3.22Å; E133-A136 VanDerWaalsContact O-CB 3.22Å; E133-A136 WeakPolarHBondContact O-CB 3.42Å; E133-A136 PolarHBondContact O-N 3.33Å; E133-K138 PolarHBondContact O-NZ 3.24Å
134	S	91.5	Very high	92.4	Very high	125 Å²	125	76.2 Å²	76.2	87%	0.874	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	135.9	172.1	-167.4	0	0	0	0	110.1	A136	S134-A136 VanDerWaalsContact C-N 3.27Å; S134-A136 PolarHBondContact O-N 3.45Å
135	G	88.9	Confident	92.6	Very high	49 Å²	49	72.6 Å²	72.6	51%	0.505	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-4.5	-176.5	0	0	0	0	0	116.1	N76 E133 G137	N76-G135 PolarHBondContact ND2-O 3.13Å; E133-G135 PolarHBondContact O-N 3.22Å; G135-G137 PolarHBondContact O-N 3.19Å; G135-G137 VanDerWaalsContact O-N 3.1Å
136	A	92.6	Very high	92.4	Very high	42 Å²	42	69.3 Å²	69.3	35%	0.347	42%	0.415	S	S	.	.	S	Bend	trans	-67.1	-10.1	179	0	0	0	0	0	114.7	E133 S134	E133-A136 VanDerWaalsContact O-CB 3.22Å; E133-A136 WeakPolarHBondContact O-CB 3.42Å; E133-A136 PolarHBondContact O-N 3.33Å; S134-A136 VanDerWaalsContact C-N 3.27Å; S134-A136 PolarHBondContact O-N 3.45Å
137	G	92.2	Very high	92.1	Very high	21 Å²	21	68.8 Å²	68.8	22%	0.216	41%	0.412	C	S	.	.	S	Bend	trans	96.5	13.8	178.2	0	0	0	0	0	115.5	G135 T139 W140 T141	G135-G137 PolarHBondContact O-N 3.19Å; G135-G137 VanDerWaalsContact O-N 3.1Å; G137-T139 PolarHBondContact O-N 2.97Å; G137-W140 WeakPolarHBondContact O-CB 3.38Å; G137-W140 PolarHBondContact O-N 2.97Å; G137-W140 VanDerWaalsContact O-N 3.13Å; G137-T141 PolarHBondContact O-N 3.01Å; G137-T141 PolarHBondContact O-OG1 2.77Å
138	K	93.1	Very high	92	Very high	69 Å²	69	63.7 Å²	63.7	30%	0.3	38%	0.376	S	S	.	.	H	α-helix	trans	-50.6	-53.9	-179.6	-59.8	-173.9	-66.6	-74.2	0	113.6	V130 G132 E133 W140 T141 S142	V130-K138 HydrophobicContact CG1-CB 4.04Å; V130-K138 HydrophobicContact CG1-CG 4.18Å; G132-K138 WeakPolarHBondContact O-CD 3.22Å; G132-K138 WeakPolarHBondContact O-CE 3.43Å; G132-K138 PolarHBondContact O-NZ 3.5Å; E133-K138 PolarHBondContact O-NZ 3.24Å; K138-W140 VanDerWaalsContact C-N 3.28Å; K138-W140 PolarHBondContact O-N 3.4Å; K138-T141 PolarHBondContact O-N 3.32Å; K138-S142 PolarHBondContact O-N 2.83Å; K138-S142 PolarHBondContact O-OG 2.91Å
139	T	87.7	Confident	91.7	Very high	66 Å²	66	63.6 Å²	63.6	41%	0.405	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-39	-179.9	-50.6	0	0	0	0	111.9	G137 R143	G137-T139 PolarHBondContact O-N 2.97Å; T139-R143 VanDerWaalsContact O-CG 3.28Å; T139-R143 WeakPolarHBondContact O-CG 3.48Å; T139-R143 PolarHBondContact O-N 3.33Å
140	W	88.6	Confident	91.2	Very high	124 Å²	124	58 Å²	58	47%	0.47	34%	0.34	S	S	.	.	H	α-helix	trans	-66.4	-46.5	177.8	-175.6	-99.7	0	0	0	111.8	Y85 G137 K138 S142 R143 C144	Y85-W140 HydrophobicContact CD2-CZ2 4.25Å; Y85-W140 AromaticContact CD2-NE1 3.72Å; Y85-W140 HydrophobicContact CE2-CZ2 4.47Å; Y85-W140 AromaticContact CE2-NE1 3.18Å; Y85-W140 AromaticContact CZ-NE1 3.55Å; G137-W140 WeakPolarHBondContact O-CB 3.38Å; G137-W140 PolarHBondContact O-N 2.97Å; G137-W140 VanDerWaalsContact O-N 3.13Å; K138-W140 VanDerWaalsContact C-N 3.28Å; K138-W140 PolarHBondContact O-N 3.4Å; W140-S142 PolarHBondContact O-N 3.48Å; W140-R143 WeakPolarHBondContact O-CB 3.16Å; W140-R143 PolarHBondContact O-N 3.16Å; W140-C144 PolarHBondContact NE1-SG 3.47Å; W140-C144 VanDerWaalsContact NE1-SG 3.39Å; W140-C144 PolarHBondContact O-N 3.41Å; W140-C144 PolarHBondContact O-SG 3.18Å
141	T	93.3	Very high	90.7	Very high	19 Å²	19	57.9 Å²	57.9	12%	0.117	34%	0.339	C	S	.	.	H	α-helix	trans	-57.6	-46.3	175.4	-64	0	0	0	0	111.4	V106 V130 G137 K138 R143 C144 L145	V106-T141 HydrophobicContact CG2-CG2 3.78Å; V130-T141 HydrophobicContact CG1-CG2 3.98Å; V130-T141 HydrophobicContact CG2-CG2 4.13Å; G137-T141 PolarHBondContact O-N 3.01Å; G137-T141 PolarHBondContact O-OG1 2.77Å; K138-T141 PolarHBondContact O-N 3.32Å; T141-R143 PolarHBondContact O-N 3.03Å; T141-C144 PolarHBondContact O-N 2.88Å; T141-L145 HydrophobicContact CG2-CD1 4.49Å; T141-L145 PolarHBondContact O-N 2.85Å
142	S	91.1	Very high	90.3	Very high	51 Å²	51	53.5 Å²	53.5	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-42.8	176.2	-61.7	0	0	0	0	112.2	K138 W140 C144 L145 M146	K138-S142 PolarHBondContact O-N 2.83Å; K138-S142 PolarHBondContact O-OG 2.91Å; W140-S142 PolarHBondContact O-N 3.48Å; S142-C144 VanDerWaalsContact C-N 3.34Å; S142-C144 PolarHBondContact O-N 3.27Å; S142-L145 PolarHBondContact O-N 2.87Å; S142-M146 VanDerWaalsContact O-CG 3.24Å; S142-M146 WeakPolarHBondContact O-CG 3.4Å; S142-M146 PolarHBondContact O-N 3.49Å; S142-M146 VanDerWaalsContact O-N 3.09Å
143	R	86.8	Confident	89.6	Confident	64 Å²	64	54.8 Å²	54.8	24%	0.242	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-41.5	174.7	-73.4	165.2	64.7	141.9	-11.5	111.9	T139 W140 T141 M146 K147 I172 N176	T139-R143 VanDerWaalsContact O-CG 3.28Å; T139-R143 WeakPolarHBondContact O-CG 3.48Å; T139-R143 PolarHBondContact O-N 3.33Å; W140-R143 WeakPolarHBondContact O-CB 3.16Å; W140-R143 PolarHBondContact O-N 3.16Å; T141-R143 PolarHBondContact O-N 3.03Å; R143-M146 PolarHBondContact O-N 3.4Å; R143-K147 WeakPolarHBondContact O-CG 3.35Å; R143-K147 PolarHBondContact O-N 3.36Å; R143-I172 HydrophobicContact CG-CG2 4.18Å; R143-N176 PolarHBondContact NH1-ND2 3.42Å; R143-N176 VanDerWaalsContact NH1-ND2 3.15Å
144	C	90.8	Very high	88.5	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.02	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-41.6	178.3	-68	0	0	0	0	112.3	Y85 W140 T141 S142 M146 K147 F148	Y85-C144 HydrophobicContact CD1-CB 4.08Å; Y85-C144 VanDerWaalsContact CD1-SG 3.59Å; Y85-C144 HydrophobicContact CE1-CB 4.24Å; W140-C144 PolarHBondContact NE1-SG 3.47Å; W140-C144 VanDerWaalsContact NE1-SG 3.39Å; W140-C144 PolarHBondContact O-N 3.41Å; W140-C144 PolarHBondContact O-SG 3.18Å; T141-C144 PolarHBondContact O-N 2.88Å; S142-C144 VanDerWaalsContact C-N 3.34Å; S142-C144 PolarHBondContact O-N 3.27Å; C144-M146 VanDerWaalsContact C-N 3.33Å; C144-M146 PolarHBondContact O-N 2.98Å; C144-K147 PolarHBondContact O-N 3.44Å; C144-F148 WeakPolarHBondContact O-CB 3.37Å; C144-F148 PolarHBondContact O-N 3.41Å
145	L	93.5	Very high	86.9	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-43	174	-79.6	165.2	0	0	0	112.1	V106 I128 T141 S142 F148 Y149	V106-L145 HydrophobicContact CG2-CD1 4.05Å; V106-L145 HydrophobicContact CG2-CD2 3.77Å; V106-L145 HydrophobicContact CG2-CG 3.66Å; I128-L145 HydrophobicContact CD1-CD1 3.93Å; I128-L145 HydrophobicContact CD1-CD2 3.94Å; I128-L145 HydrophobicContact CG2-CD1 3.88Å; T141-L145 HydrophobicContact CG2-CD1 4.49Å; T141-L145 PolarHBondContact O-N 2.85Å; S142-L145 PolarHBondContact O-N 2.87Å; L145-F148 WeakPolarHBondContact O-CB 3.48Å; L145-F148 PolarHBondContact O-N 2.93Å; L145-Y149 HydrophobicContact CB-CE2 4.45Å; L145-Y149 WeakPolarHBondContact O-CD2 3.46Å; L145-Y149 PolarHBondContact O-N 3.02Å
146	M	89.2	Confident	85.3	Confident	90 Å²	90	49 Å²	49	44%	0.443	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-41.1	178.7	-66.2	-71.6	-176.9	0	0	112.4	S142 R143 C144 F148 Y149 A150 I172	S142-M146 VanDerWaalsContact O-CG 3.24Å; S142-M146 WeakPolarHBondContact O-CG 3.4Å; S142-M146 PolarHBondContact O-N 3.49Å; S142-M146 VanDerWaalsContact O-N 3.09Å; R143-M146 PolarHBondContact O-N 3.4Å; C144-M146 VanDerWaalsContact C-N 3.33Å; C144-M146 PolarHBondContact O-N 2.98Å; M146-F148 VanDerWaalsContact C-N 3.34Å; M146-Y149 PolarHBondContact O-N 3.36Å; M146-A150 WeakPolarHBondContact O-CB 3.21Å; M146-A150 PolarHBondContact O-N 3.34Å; M146-I172 HydrophobicContact CB-CD1 3.39Å; M146-I172 HydrophobicContact CG-CD1 3.58Å; M146-I172 HydrophobicContact SD-CD1 3.88Å
147	K	87.8	Confident	83.4	Confident	62 Å²	62	51.1 Å²	51.1	27%	0.27	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-43.9	171.6	-71	-175.1	-172.5	-134.7	0	111.5	M90 R143 C144 Y149 A150 V151 E169	M90-K147 HydrophobicContact CE-CB 3.95Å; R143-K147 WeakPolarHBondContact O-CG 3.35Å; R143-K147 PolarHBondContact O-N 3.36Å; C144-K147 PolarHBondContact O-N 3.44Å; K147-Y149 PolarHBondContact O-N 3.39Å; K147-A150 WeakPolarHBondContact O-CB 3.34Å; K147-A150 PolarHBondContact O-N 3.49Å; K147-V151 WeakPolarHBondContact O-CG2 3.48Å; K147-V151 PolarHBondContact O-N 2.91Å; K147-E169 WeakPolarHBondContact CE-OE1 3.28Å; K147-E169 HydrophobicContact CG-CG 4.29Å; K147-E169 IonicContact NZ-OE1 2.83Å; K147-E169 PolarHBondContact NZ-OE1 3.19Å
148	F	92.1	Very high	81.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-55.1	-50.5	175.3	173.9	-93	0	0	0	111	M90 F107 E111 C144 L145 M146 A150 V151 V152	M90-F148 HydrophobicContact CB-CD2 3.85Å; M90-F148 HydrophobicContact CB-CE2 4.36Å; M90-F148 HydrophobicContact CG-CD2 3.96Å; M90-F148 WeakPolarHBondContact O-CE2 3.48Å; M90-F148 HydrophobicContact SD-CB 4.4Å; F107-F148 HydrophobicContact CB-CD2 3.9Å; F107-F148 HydrophobicContact CB-CE2 3.84Å; F107-F148 HydrophobicContact CD1-CB 3.91Å; F107-F148 AromaticContact CD1-CD2 3.56Å; F107-F148 HydrophobicContact CD1-CD2 3.56Å; F107-F148 HydrophobicContact CD1-CE2 4.38Å; F107-F148 AromaticContact CD1-CG 3.92Å; F107-F148 HydrophobicContact CD1-CG 3.92Å; F107-F148 HydrophobicContact CD2-CD2 4.44Å; F107-F148 HydrophobicContact CE1-CB 4.04Å; F107-F148 HydrophobicContact CE1-CD2 4.23Å; F107-F148 HydrophobicContact CE1-CG 4.5Å; F107-F148 AromaticContact CG-CD2 3.71Å; F107-F148 HydrophobicContact CG-CD2 3.71Å; F107-F148 HydrophobicContact CG-CE2 4.13Å; F107-F148 HydrophobicContact CG-CG 4.48Å; E111-F148 HydrophobicContact CB-CE1 4.33Å; E111-F148 HydrophobicContact CB-CZ 3.87Å; E111-F148 WeakPolarHBondContact OE2-CZ 3.21Å; C144-F148 WeakPolarHBondContact O-CB 3.37Å; C144-F148 PolarHBondContact O-N 3.41Å; L145-F148 WeakPolarHBondContact O-CB 3.48Å; L145-F148 PolarHBondContact O-N 2.93Å; M146-F148 VanDerWaalsContact C-N 3.34Å; F148-A150 VanDerWaalsContact C-N 3.33Å; F148-A150 PolarHBondContact O-N 3.25Å; F148-V151 PolarHBondContact O-N 3.39Å; F148-V152 HydrophobicContact CD1-CG2 4.4Å; F148-V152 HydrophobicContact CD2-CG1 4.26Å; F148-V152 HydrophobicContact CE1-CG1 4.16Å; F148-V152 HydrophobicContact CE1-CG2 4.08Å; F148-V152 HydrophobicContact CE2-CG1 3.84Å; F148-V152 HydrophobicContact CZ-CG1 3.78Å; F148-V152 HydrophobicContact CZ-CG2 4.47Å; F148-V152 WeakPolarHBondContact O-CG1 3.04Å; F148-V152 WeakPolarHBondContact O-CG2 3.38Å; F148-V152 PolarHBondContact O-N 3.16Å
149	Y	91.1	Very high	80.2	Confident	55 Å²	55	58.4 Å²	58.4	22%	0.216	32%	0.324	C	S	.	.	H	α-helix	trans	-61.2	-39.9	176.8	-64.9	-45.1	0	0	0	113.5	G110 T113 Y114 I128 L145 M146 K147 V151 V152 A153	G110-Y149 WeakPolarHBondContact O-CE1 3.44Å; G110-Y149 PolarHBondContact O-OH 2.63Å; T113-Y149 WeakPolarHBondContact CB-OH 3.2Å; T113-Y149 VanDerWaalsContact CG2-OH 3.28Å; T113-Y149 WeakPolarHBondContact CG2-OH 3.46Å; Y114-Y149 HydrophobicContact CD2-CD1 4.41Å; I128-Y149 VanDerWaalsContact CD1-OH 3.25Å; I128-Y149 WeakPolarHBondContact CD1-OH 3.27Å; L145-Y149 HydrophobicContact CB-CE2 4.45Å; L145-Y149 WeakPolarHBondContact O-CD2 3.46Å; L145-Y149 PolarHBondContact O-N 3.02Å; M146-Y149 PolarHBondContact O-N 3.36Å; K147-Y149 PolarHBondContact O-N 3.39Å; Y149-V151 VanDerWaalsContact C-N 3.34Å; Y149-V151 PolarHBondContact O-N 3.15Å; Y149-V152 PolarHBondContact O-N 3.37Å; Y149-A153 WeakPolarHBondContact O-CB 3.49Å; Y149-A153 PolarHBondContact O-N 2.83Å
150	A	85.5	Confident	78.9	Confident	9 Å²	9	60.9 Å²	60.9	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-45.8	175.8	0	0	0	0	0	111	M146 K147 F148 T154 A165	M146-A150 WeakPolarHBondContact O-CB 3.21Å; M146-A150 PolarHBondContact O-N 3.34Å; K147-A150 WeakPolarHBondContact O-CB 3.34Å; K147-A150 PolarHBondContact O-N 3.49Å; F148-A150 VanDerWaalsContact C-N 3.33Å; F148-A150 PolarHBondContact O-N 3.25Å; A150-T154 WeakPolarHBondContact O-CG2 3.24Å; A150-T154 PolarHBondContact O-N 3.22Å; A150-T154 PolarHBondContact O-OG1 3.46Å; A150-A165 HydrophobicContact CB-CB 3.78Å
151	V	85.6	Confident	77.5	Confident	43 Å²	43	56.2 Å²	56.2	26%	0.261	32%	0.317	S	S	.	.	H	α-helix	trans	-66.5	-43.6	179.4	173.4	0	0	0	0	112.5	M90 R91 K147 F148 Y149 T154	M90-V151 HydrophobicContact CB-CG1 4.31Å; M90-V151 HydrophobicContact SD-CB 4.19Å; M90-V151 HydrophobicContact SD-CG2 3.8Å; R91-V151 HydrophobicContact CG-CG1 4.17Å; K147-V151 WeakPolarHBondContact O-CG2 3.48Å; K147-V151 PolarHBondContact O-N 2.91Å; F148-V151 PolarHBondContact O-N 3.39Å; Y149-V151 VanDerWaalsContact C-N 3.34Å; Y149-V151 PolarHBondContact O-N 3.15Å; V151-T154 PolarHBondContact O-OG1 3.35Å
152	V	86.7	Confident	76.1	Confident	13 Å²	13	60.6 Å²	60.6	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-83.3	-22.6	-175.6	-54	0	0	0	0	113.5	H94 Y114 F148 Y149	H94-V152 HydrophobicContact CB-CB 4.4Å; H94-V152 HydrophobicContact CB-CG1 3.6Å; Y114-V152 HydrophobicContact CD2-CG2 4.1Å; Y114-V152 HydrophobicContact CE2-CG2 4.05Å; Y114-V152 HydrophobicContact CG-CG2 4.47Å; F148-V152 HydrophobicContact CD1-CG2 4.4Å; F148-V152 HydrophobicContact CD2-CG1 4.26Å; F148-V152 HydrophobicContact CE1-CG1 4.16Å; F148-V152 HydrophobicContact CE1-CG2 4.08Å; F148-V152 HydrophobicContact CE2-CG1 3.84Å; F148-V152 HydrophobicContact CZ-CG1 3.78Å; F148-V152 HydrophobicContact CZ-CG2 4.47Å; F148-V152 WeakPolarHBondContact O-CG1 3.04Å; F148-V152 WeakPolarHBondContact O-CG2 3.38Å; F148-V152 PolarHBondContact O-N 3.16Å; Y149-V152 PolarHBondContact O-N 3.37Å
153	A	79.4	Confident	74.9	Confident	69 Å²	69	63.2 Å²	63.2	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-79	-24	173.9	0	0	0	0	0	112.3	Y149 S155	Y149-A153 WeakPolarHBondContact O-CB 3.49Å; Y149-A153 PolarHBondContact O-N 2.83Å; A153-S155 PolarHBondContact O-N 3.47Å
154	T	71.1	Confident	74	Confident	31 Å²	31	64.5 Å²	64.5	19%	0.19	35%	0.352	C	S	.	.	S	Bend	trans	-72.1	114.1	175.7	37.8	0	0	0	0	111.7	A150 V151 S161 A165	A150-T154 WeakPolarHBondContact O-CG2 3.24Å; A150-T154 PolarHBondContact O-N 3.22Å; A150-T154 PolarHBondContact O-OG1 3.46Å; V151-T154 PolarHBondContact O-OG1 3.35Å; T154-S161 VanDerWaalsContact CG2-C 3.43Å; T154-S161 WeakPolarHBondContact CG2-O 3.25Å; T154-A165 HydrophobicContact CG2-CB 3.55Å
155	S	57.3	Low	72.8	Confident	61 Å²	61	65 Å²	65	43%	0.427	36%	0.356	S	S	.	.			trans	-67.2	134.7	165.8	177.9	0	0	0	0	109.3	A153 A157	A153-S155 PolarHBondContact O-N 3.47Å; S155-A157 PolarHBondContact O-N 2.86Å; S155-A157 WeakPolarHBondContact OG-CB 3.43Å; S155-A157 PolarHBondContact OG-N 3.3Å
156	P	56.8	Low	71.6	Confident	127 Å²	127	70.1 Å²	70.1	83%	0.825	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-6.1	173.4	23.4	-30.9	0	0	0	113.3
157	A	52.4	Low	70.8	Confident	88 Å²	88	73.3 Å²	73.3	73%	0.727	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-4.8	-173.9	0	0	0	0	0	115.7	S155	S155-A157 PolarHBondContact O-N 2.86Å; S155-A157 WeakPolarHBondContact OG-CB 3.43Å; S155-A157 PolarHBondContact OG-N 3.3Å
158	S	56.3	Low	70	Confident	46 Å²	46	74 Å²	74	32%	0.322	39%	0.393	S	S	.	.			trans	-149.5	139.6	177.7	89.8	0	0	0	0	115.9	E160 S161	S158-E160 PolarHBondContact O-N 3.11Å; S158-S161 WeakPolarHBondContact O-CB 3.06Å; S158-S161 PolarHBondContact O-N 3.11Å; S158-S161 PolarHBondContact OG-N 3.36Å; S158-S161 VanDerWaalsContact OG-N 3.11Å; S158-S161 PolarHBondContact OG-OG 3.15Å
159	W	60.3	Low	68.9	Low	196 Å²	196	76.8 Å²	76.8	74%	0.742	41%	0.406	S	S	*	.	H	α-helix	trans	-58.2	-30.8	168.7	175.8	-100.5	0	0	0	112.6	S161 H162 K163	W159-S161 VanDerWaalsContact C-N 3.35Å; W159-S161 PolarHBondContact O-N 2.9Å; W159-H162 PolarHBondContact O-N 2.81Å; W159-K163 PolarHBondContact O-N 2.96Å
160	E	60.8	Low	68.1	Low	118 Å²	118	78.2 Å²	78.2	55%	0.551	41%	0.414	S	S	*	.	H	α-helix	trans	-64.7	-38.1	177.5	-157.7	66.9	-139.6	0	0	111.7	S158 H162 K163 I164	S158-E160 PolarHBondContact O-N 3.11Å; E160-H162 PolarHBondContact O-N 3.24Å; E160-K163 PolarHBondContact O-N 3.35Å; E160-I164 WeakPolarHBondContact O-CG1 3.1Å; E160-I164 PolarHBondContact O-N 3.38Å; E160-I164 VanDerWaalsContact O-N 3.15Å
161	S	60.5	Low	67.4	Low	26 Å²	26	85.4 Å²	85.4	18%	0.182	44%	0.44	C	S	.	.	H	α-helix	trans	-63.1	-42.7	177.7	-58	0	0	0	0	111.6	T154 S158 W159 K163 I164 A165	T154-S161 VanDerWaalsContact CG2-C 3.43Å; T154-S161 WeakPolarHBondContact CG2-O 3.25Å; S158-S161 WeakPolarHBondContact O-CB 3.06Å; S158-S161 PolarHBondContact O-N 3.11Å; S158-S161 PolarHBondContact OG-N 3.36Å; S158-S161 VanDerWaalsContact OG-N 3.11Å; S158-S161 PolarHBondContact OG-OG 3.15Å; W159-S161 VanDerWaalsContact C-N 3.35Å; W159-S161 PolarHBondContact O-N 2.9Å; S161-K163 PolarHBondContact O-N 3.09Å; S161-I164 PolarHBondContact O-N 2.74Å; S161-I164 VanDerWaalsContact O-N 3.16Å; S161-A165 PolarHBondContact O-N 3.09Å; S161-A165 VanDerWaalsContact O-N 3.09Å
162	H	63.1	Low	66.6	Low	111 Å²	111	85 Å²	85	51%	0.514	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-42.4	177.3	-80.7	74.9	0	0	0	112.4	W159 E160 I164 A165 E166	W159-H162 PolarHBondContact O-N 2.81Å; E160-H162 PolarHBondContact O-N 3.24Å; H162-I164 VanDerWaalsContact C-N 3.3Å; H162-I164 PolarHBondContact O-N 3.26Å; H162-A165 PolarHBondContact O-N 3.29Å; H162-E166 WeakPolarHBondContact O-CB 3.35Å; H162-E166 PolarHBondContact O-N 3.08Å
163	K	66.8	Low	65.8	Low	106 Å²	106	86.3 Å²	86.3	46%	0.461	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-35.4	174.8	-78.8	-176.3	172.6	179.3	0	113.1	W159 E160 S161 R167	W159-K163 PolarHBondContact O-N 2.96Å; E160-K163 PolarHBondContact O-N 3.35Å; S161-K163 PolarHBondContact O-N 3.09Å; K163-R167 WeakPolarHBondContact O-CB 3.46Å; K163-R167 PolarHBondContact O-N 3.2Å
164	I	67.6	Low	65.4	Low	91 Å²	91	88.2 Å²	88.2	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-68.9	-45.7	178.2	-67.2	164.5	0	0	0	110.6	E160 S161 H162 R167 I168	E160-I164 WeakPolarHBondContact O-CG1 3.1Å; E160-I164 PolarHBondContact O-N 3.38Å; E160-I164 VanDerWaalsContact O-N 3.15Å; S161-I164 PolarHBondContact O-N 2.74Å; S161-I164 VanDerWaalsContact O-N 3.16Å; H162-I164 VanDerWaalsContact C-N 3.3Å; H162-I164 PolarHBondContact O-N 3.26Å; I164-R167 PolarHBondContact O-N 3.34Å; I164-I168 HydrophobicContact CG2-CD1 3.9Å; I164-I168 HydrophobicContact CG2-CG1 4.47Å; I164-I168 VanDerWaalsContact O-CG1 3.31Å; I164-I168 WeakPolarHBondContact O-CG1 3.28Å; I164-I168 PolarHBondContact O-N 3.12Å
165	A	65.3	Low	65.3	Low	14 Å²	14	88.9 Å²	88.9	12%	0.116	45%	0.449	C	S	.	.	H	α-helix	trans	-58.2	-48.6	175.2	0	0	0	0	0	111.9	A150 T154 S161 H162 R167 I168 E169	A150-A165 HydrophobicContact CB-CB 3.78Å; T154-A165 HydrophobicContact CG2-CB 3.55Å; S161-A165 PolarHBondContact O-N 3.09Å; S161-A165 VanDerWaalsContact O-N 3.09Å; H162-A165 PolarHBondContact O-N 3.29Å; A165-R167 VanDerWaalsContact C-N 3.31Å; A165-R167 PolarHBondContact O-N 3.37Å; A165-I168 PolarHBondContact O-N 2.8Å; A165-E169 PolarHBondContact O-N 3.09Å
166	E	68.1	Low	65.8	Low	116 Å²	116	86.8 Å²	86.8	54%	0.542	43%	0.433	S	S	.	.	H	α-helix	trans	-60.3	-41.9	176.9	-170.1	179	-162.3	0	0	111.1	H162 I168 E169 Q170	H162-E166 WeakPolarHBondContact O-CB 3.35Å; H162-E166 PolarHBondContact O-N 3.08Å; E166-I168 PolarHBondContact O-N 3.32Å; E166-E169 PolarHBondContact O-N 2.8Å; E166-Q170 HydrophobicContact CG-CG 4.47Å; E166-Q170 WeakPolarHBondContact O-CB 3.18Å; E166-Q170 WeakPolarHBondContact O-CG 3.42Å; E166-Q170 PolarHBondContact O-N 3.47Å
167	R	73.2	Confident	66.5	Low	158 Å²	158	84.4 Å²	84.4	60%	0.596	42%	0.417	S	S	*	.	H	α-helix	trans	-65.9	-37	177.2	-170.9	177.3	-176.8	-177.9	2.3	113.1	K163 I164 A165 R171	K163-R167 WeakPolarHBondContact O-CB 3.46Å; K163-R167 PolarHBondContact O-N 3.2Å; I164-R167 PolarHBondContact O-N 3.34Å; A165-R167 VanDerWaalsContact C-N 3.31Å; A165-R167 PolarHBondContact O-N 3.37Å; R167-R171 WeakPolarHBondContact O-CB 3.36Å; R167-R171 WeakPolarHBondContact O-CG 3.21Å; R167-R171 PolarHBondContact O-N 3.47Å
168	I	70.6	Confident	67.2	Low	77 Å²	77	84.3 Å²	84.3	40%	0.395	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-48.4	174.8	-70.1	167.7	0	0	0	109.4	I164 A165 E166 Q170 R171 I172	I164-I168 HydrophobicContact CG2-CD1 3.9Å; I164-I168 HydrophobicContact CG2-CG1 4.47Å; I164-I168 VanDerWaalsContact O-CG1 3.31Å; I164-I168 WeakPolarHBondContact O-CG1 3.28Å; I164-I168 PolarHBondContact O-N 3.12Å; A165-I168 PolarHBondContact O-N 2.8Å; E166-I168 PolarHBondContact O-N 3.32Å; I168-Q170 PolarHBondContact O-N 2.88Å; I168-R171 PolarHBondContact O-N 3.22Å; I168-I172 HydrophobicContact CG2-CD1 3.79Å; I168-I172 WeakPolarHBondContact O-CD1 3.37Å; I168-I172 VanDerWaalsContact O-CG1 3.29Å; I168-I172 WeakPolarHBondContact O-CG1 3.29Å; I168-I172 PolarHBondContact O-N 3.44Å; I168-I172 VanDerWaalsContact O-N 3.08Å
169	E	69.4	Low	67.7	Low	57 Å²	57	88 Å²	88	27%	0.266	42%	0.421	S	S	.	.	H	α-helix	trans	-56.3	-51.3	175.8	-175.2	177.6	-178	0	0	110.9	K147 A165 E166 R171 I172 L173	K147-E169 WeakPolarHBondContact CE-OE1 3.28Å; K147-E169 HydrophobicContact CG-CG 4.29Å; K147-E169 IonicContact NZ-OE1 2.83Å; K147-E169 PolarHBondContact NZ-OE1 3.19Å; A165-E169 PolarHBondContact O-N 3.09Å; E166-E169 PolarHBondContact O-N 2.8Å; E169-R171 VanDerWaalsContact C-N 3.34Å; E169-R171 PolarHBondContact O-N 3.36Å; E169-I172 PolarHBondContact O-N 3.12Å; E169-I172 VanDerWaalsContact O-N 3.11Å; E169-L173 HydrophobicContact CG-CD1 4.06Å; E169-L173 HydrophobicContact CG-CG 4.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.41Å; E169-L173 PolarHBondContact O-N 3.49Å
170	Q	72.7	Confident	68.3	Low	85 Å²	85	83 Å²	83	40%	0.397	41%	0.406	S	S	.	.	H	α-helix	trans	-60	-40.5	179.1	-71.7	-59.8	-38.5	0	0	112.8	E166 I168 I172 L173 N174	E166-Q170 HydrophobicContact CG-CG 4.47Å; E166-Q170 WeakPolarHBondContact O-CB 3.18Å; E166-Q170 WeakPolarHBondContact O-CG 3.42Å; E166-Q170 PolarHBondContact O-N 3.47Å; I168-Q170 PolarHBondContact O-N 2.88Å; Q170-I172 VanDerWaalsContact C-N 3.3Å; Q170-I172 PolarHBondContact O-N 3.41Å; Q170-L173 PolarHBondContact O-N 3.28Å; Q170-N174 VanDerWaalsContact O-CB 3.28Å; Q170-N174 WeakPolarHBondContact O-CB 3.29Å; Q170-N174 PolarHBondContact O-N 2.99Å; Q170-N174 PolarHBondContact O-ND2 2.91Å
171	R	72.4	Confident	68.8	Low	160 Å²	160	81.1 Å²	81.1	60%	0.604	41%	0.411	S	S	*	.	H	α-helix	trans	-61.6	-40.4	175.6	-87.4	174.4	165.4	173.8	-6.5	112.2	R167 I168 E169 N174 S175	R167-R171 WeakPolarHBondContact O-CB 3.36Å; R167-R171 WeakPolarHBondContact O-CG 3.21Å; R167-R171 PolarHBondContact O-N 3.47Å; I168-R171 PolarHBondContact O-N 3.22Å; E169-R171 VanDerWaalsContact C-N 3.34Å; E169-R171 PolarHBondContact O-N 3.36Å; R171-N174 PolarHBondContact O-N 3.08Å; R171-S175 PolarHBondContact O-N 2.94Å; R171-S175 PolarHBondContact O-OG 3.29Å
172	I	68.8	Low	69.3	Low	35 Å²	35	88.6 Å²	88.6	18%	0.179	44%	0.44	C	S	.	.	H	α-helix	trans	-70.7	-38.8	178	-65.7	164.7	0	0	0	110.8	R143 M146 I168 E169 Q170 N174 S175 N176	R143-I172 HydrophobicContact CG-CG2 4.18Å; M146-I172 HydrophobicContact CB-CD1 3.39Å; M146-I172 HydrophobicContact CG-CD1 3.58Å; M146-I172 HydrophobicContact SD-CD1 3.88Å; I168-I172 HydrophobicContact CG2-CD1 3.79Å; I168-I172 WeakPolarHBondContact O-CD1 3.37Å; I168-I172 VanDerWaalsContact O-CG1 3.29Å; I168-I172 WeakPolarHBondContact O-CG1 3.29Å; I168-I172 PolarHBondContact O-N 3.44Å; I168-I172 VanDerWaalsContact O-N 3.08Å; E169-I172 PolarHBondContact O-N 3.12Å; E169-I172 VanDerWaalsContact O-N 3.11Å; Q170-I172 VanDerWaalsContact C-N 3.3Å; Q170-I172 PolarHBondContact O-N 3.41Å; I172-N174 VanDerWaalsContact C-N 3.34Å; I172-S175 PolarHBondContact O-OG 3.12Å; I172-N176 VanDerWaalsContact O-CG 3.29Å; I172-N176 PolarHBondContact O-ND2 3.35Å
173	L	68	Low	69	Low	40 Å²	40	86 Å²	86	21%	0.209	44%	0.444	C	S	.	.	H	α-helix	trans	-61.8	-44.2	174.5	-67.8	178.1	0	0	0	111.3	E169 Q170 P177	E169-L173 HydrophobicContact CG-CD1 4.06Å; E169-L173 HydrophobicContact CG-CG 4.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.41Å; E169-L173 PolarHBondContact O-N 3.49Å; Q170-L173 PolarHBondContact O-N 3.28Å; L173-P177 WeakPolarHBondContact O-CD 3.45Å
174	N	72.4	Confident	68.3	Low	109 Å²	109	86.8 Å²	86.8	58%	0.583	45%	0.452	S	S	*	.	H	α-helix	trans	-76.4	-22.9	-175.7	-66.5	-17.9	0	0	0	113.5	Q170 R171 I172	Q170-N174 VanDerWaalsContact O-CB 3.28Å; Q170-N174 WeakPolarHBondContact O-CB 3.29Å; Q170-N174 PolarHBondContact O-N 2.99Å; Q170-N174 PolarHBondContact O-ND2 2.91Å; R171-N174 PolarHBondContact O-N 3.08Å; I172-N174 VanDerWaalsContact C-N 3.34Å
175	S	67.9	Low	67.6	Low	45 Å²	45	88.2 Å²	88.2	32%	0.315	47%	0.47	S	S	.	.	H	α-helix	trans	-76.5	-27.4	176.5	60.8	0	0	0	0	113.1	R171 I172 V178 M179	R171-S175 PolarHBondContact O-N 2.94Å; R171-S175 PolarHBondContact O-OG 3.29Å; I172-S175 PolarHBondContact O-OG 3.12Å; S175-V178 PolarHBondContact O-N 3.05Å; S175-M179 WeakPolarHBondContact O-CB 3.45Å; S175-M179 WeakPolarHBondContact O-CG 3.45Å; S175-M179 PolarHBondContact O-N 3.02Å
176	N	68.3	Low	66.9	Low	17 Å²	17	101 Å²	101	9%	0.091	52%	0.523	C	S	.	.	H	α-helix	trans	-64	-50	-174.9	-59.8	-41.2	0	0	0	113	R143 I172 V178 M179 E180	R143-N176 PolarHBondContact NH1-ND2 3.42Å; R143-N176 VanDerWaalsContact NH1-ND2 3.15Å; I172-N176 VanDerWaalsContact O-CG 3.29Å; I172-N176 PolarHBondContact O-ND2 3.35Å; N176-V178 PolarHBondContact O-N 3Å; N176-M179 PolarHBondContact O-N 3.16Å; N176-M179 VanDerWaalsContact O-N 3.16Å; N176-E180 WeakPolarHBondContact O-CB 3.35Å; N176-E180 WeakPolarHBondContact O-CG 3.31Å; N176-E180 PolarHBondContact O-N 3.4Å
177	P	71.2	Confident	66.9	Low	78 Å²	78	100.2 Å²	100.2	51%	0.506	52%	0.522	S	S	.	.	H	α-helix	trans	-59.1	-36.9	-179.1	-24.7	34.5	0	0	0	113.1	L173 A181	L173-P177 WeakPolarHBondContact O-CD 3.45Å; P177-A181 WeakPolarHBondContact O-CB 3.19Å; P177-A181 PolarHBondContact O-N 3.41Å
178	V	68.4	Low	66.6	Low	86 Å²	86	97.2 Å²	97.2	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-67.5	-50.2	176.7	-179.7	0	0	0	0	110.1	S175 N176 E180 A181 F182	S175-V178 PolarHBondContact O-N 3.05Å; N176-V178 PolarHBondContact O-N 3Å; V178-E180 VanDerWaalsContact C-N 3.32Å; V178-E180 PolarHBondContact O-N 2.79Å; V178-A181 PolarHBondContact O-N 3.1Å; V178-F182 HydrophobicContact CG1-CD2 3.88Å; V178-F182 HydrophobicContact CG1-CE2 4.08Å; V178-F182 VanDerWaalsContact O-CD2 3.24Å; V178-F182 WeakPolarHBondContact O-CD2 3.24Å; V178-F182 PolarHBondContact O-N 2.85Å; V178-F182 VanDerWaalsContact O-N 3.1Å
179	M	65.4	Low	66.3	Low	124 Å²	124	98.3 Å²	98.3	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-38.5	178.1	-77.7	173.9	41.7	0	0	112.8	S175 N176 G183	S175-M179 WeakPolarHBondContact O-CB 3.45Å; S175-M179 WeakPolarHBondContact O-CG 3.45Å; S175-M179 PolarHBondContact O-N 3.02Å; N176-M179 PolarHBondContact O-N 3.16Å; N176-M179 VanDerWaalsContact O-N 3.16Å; M179-G183 WeakPolarHBondContact O-CA 3.48Å; M179-G183 PolarHBondContact O-N 3.09Å
180	E	73.1	Confident	66.1	Low	89 Å²	89	100.7 Å²	100.7	42%	0.416	54%	0.54	S	S	.	.	H	α-helix	trans	-67.8	-42.1	177	-67.9	179	-176.7	0	0	110.8	N176 V178 F182 L184	N176-E180 WeakPolarHBondContact O-CB 3.35Å; N176-E180 WeakPolarHBondContact O-CG 3.31Å; N176-E180 PolarHBondContact O-N 3.4Å; V178-E180 VanDerWaalsContact C-N 3.32Å; V178-E180 PolarHBondContact O-N 2.79Å; E180-F182 VanDerWaalsContact C-N 3.34Å; E180-F182 PolarHBondContact O-N 3.37Å; E180-L184 HydrophobicContact CB-CD1 3.97Å; E180-L184 HydrophobicContact CG-CD1 3.66Å; E180-L184 WeakPolarHBondContact O-CB 3.34Å; E180-L184 PolarHBondContact O-N 3.35Å; E180-L184 VanDerWaalsContact O-N 3.12Å
181	A	70.9	Confident	65.7	Low	79 Å²	79	101.7 Å²	101.7	65%	0.653	55%	0.549	S	S	*	.	H	α-helix	trans	-65.3	-32.8	178.7	0	0	0	0	0	113.9	P177 V178	P177-A181 WeakPolarHBondContact O-CB 3.19Å; P177-A181 PolarHBondContact O-N 3.41Å; V178-A181 PolarHBondContact O-N 3.1Å
182	F	70.8	Confident	65.3	Low	183 Å²	183	97.8 Å²	97.8	80%	0.803	55%	0.546	S	S	*	.	H	α-helix	trans	-101.2	-19.1	-177.9	-72.3	-72.8	0	0	0	114.6	V178 E180	V178-F182 HydrophobicContact CG1-CD2 3.88Å; V178-F182 HydrophobicContact CG1-CE2 4.08Å; V178-F182 VanDerWaalsContact O-CD2 3.24Å; V178-F182 WeakPolarHBondContact O-CD2 3.24Å; V178-F182 PolarHBondContact O-N 2.85Å; V178-F182 VanDerWaalsContact O-N 3.1Å; E180-F182 VanDerWaalsContact C-N 3.34Å; E180-F182 PolarHBondContact O-N 3.37Å
183	G	56.7	Low	65	Low	57 Å²	57	102.3 Å²	102.3	59%	0.588	57%	0.572	S	S	*	*	H	α-helix	trans	-119.8	-13	-170.7	0	0	0	0	0	115.5	M179	M179-G183 WeakPolarHBondContact O-CA 3.48Å; M179-G183 PolarHBondContact O-N 3.09Å
184	L	53.6	Low	64.8	Low	123 Å²	123	107.1 Å²	107.1	64%	0.644	60%	0.6	S	S	*	*			trans	-110	94.8	177.6	-61.6	-179.5	0	0	0	110.5	E180	E180-L184 HydrophobicContact CB-CD1 3.97Å; E180-L184 HydrophobicContact CG-CD1 3.66Å; E180-L184 WeakPolarHBondContact O-CB 3.34Å; E180-L184 PolarHBondContact O-N 3.35Å; E180-L184 VanDerWaalsContact O-N 3.12Å
185	S	53.1	Low	64.2	Low	120 Å²	120	106.9 Å²	106.9	84%	0.839	60%	0.601	S	S	*	*			trans	-74.2	138.5	164.2	-42.8	0	0	0	0	109.3
186	K	50.7	Low	63.8	Low	282 Å²	282	112.5 Å²	112.5	100%	1.226	63%	0.627	S	S	*	*			trans	-77.4	0	166.5	-77.4	-170.6	177.2	175.1	0	111.2

Retrieved 186 of 186 residues in 161.3 ms (Link to these results)

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