A0A3Q0KQJ2_SCHMA Loading...

Ephrin_rec_like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQJ2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 305 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	20.8	Very low	24.8	Very low	246 Å²	246	130.7 Å²	130.7	100%	1.212	63%	0.625	S	S	*	*				0	127.2	0	-164	177.1	-166.6	0	0	107.9	K3	M1-K3 PolarHBondContact O-N 2.78Å
2	V	23.3	Very low	25	Very low	115 Å²	115	126.1 Å²	126.1	70%	0.697	64%	0.637	S	S	*	*			trans	-84.5	103.7	-168.4	178.6	0	0	0	0	111.3	I4	V2-I4 HydrophobicContact CG1-CG1 4.05Å
3	K	20	Very low	25	Very low	167 Å²	167	127.5 Å²	127.5	73%	0.726	65%	0.646	S	S	*	*			trans	-42.1	139.5	147.3	-74.6	-175.1	169.9	-176.6	0	112.1	M1 K19	M1-K3 PolarHBondContact O-N 2.78Å; K3-K19 VanDerWaalsContact O-CD 3.3Å; K3-K19 WeakPolarHBondContact O-CD 3.07Å; K3-K19 WeakPolarHBondContact O-CE 3.34Å; K3-K19 PolarHBondContact O-NZ 2.92Å
4	I	26.5	Very low	25.2	Very low	105 Å²	105	126.6 Å²	126.6	54%	0.538	65%	0.653	S	S	.	*			trans	-133.6	123.3	156.3	-57.4	-176.4	0	0	0	106.6	V2	V2-I4 HydrophobicContact CG1-CG1 4.05Å
5	I	24.7	Very low	25.1	Very low	78 Å²	78	129.3 Å²	129.3	40%	0.4	66%	0.659	S	S	.	*			trans	-147.8	137	162.1	-36.6	174.1	0	0	0	107.1	I17 K19	I5-I17 HydrophobicContact CD1-CG2 4.28Å; I5-I17 HydrophobicContact CG2-CB 4Å; I5-I17 HydrophobicContact CG2-CG2 3.66Å; I5-K19 HydrophobicContact CB-CB 3.81Å; I5-K19 HydrophobicContact CG1-CB 4.13Å; I5-K19 WeakPolarHBondContact O-CB 3.41Å
6	E	26.6	Very low	25.2	Very low	91 Å²	91	130.6 Å²	130.6	43%	0.425	67%	0.666	S	S	.	*			trans	-107.9	145.5	-171.8	-66.2	166.2	-155.6	0	0	110.6	Y8	E6-Y8 HydrophobicContact CB-CD2 4.27Å; E6-Y8 HydrophobicContact CB-CE2 3.63Å; E6-Y8 HydrophobicContact CG-CE2 4.5Å; E6-Y8 WeakPolarHBondContact OE2-CE2 3.44Å; E6-Y8 VanDerWaalsContact OE2-CZ 3.31Å; E6-Y8 PolarHBondContact OE2-OH 3.07Å
7	H	25.3	Very low	25.2	Very low	104 Å²	104	129.1 Å²	129.1	48%	0.481	66%	0.658	S	S	.	*			trans	-98.9	126.2	171.8	-76.9	-87.4	0	0	0	110.7	I17 T18	H7-I17 PolarHBondContact CE1-O 2.72Å; H7-I17 PolarHBondContact ND1-O 3.11Å; H7-T18 PolarHBondContact CE1-OG1 2.98Å; H7-T18 WeakPolarHBondContact NE2-CA 3.29Å; H7-T18 WeakPolarHBondContact NE2-CG2 3.41Å
8	Y	27.2	Very low	25.4	Very low	76 Å²	76	124.5 Å²	124.5	30%	0.298	64%	0.638	S	S	.	*			trans	-126.5	125.8	162.7	-59.6	-96.7	0	0	0	108.3	E6 L40 K43	E6-Y8 HydrophobicContact CB-CD2 4.27Å; E6-Y8 HydrophobicContact CB-CE2 3.63Å; E6-Y8 HydrophobicContact CG-CE2 4.5Å; E6-Y8 WeakPolarHBondContact OE2-CE2 3.44Å; E6-Y8 VanDerWaalsContact OE2-CZ 3.31Å; E6-Y8 PolarHBondContact OE2-OH 3.07Å; Y8-L40 HydrophobicContact CD1-CD1 4.2Å; Y8-L40 HydrophobicContact CE1-CD1 3.44Å; Y8-L40 VanDerWaalsContact CE1-CD1 3.44Å; Y8-L40 HydrophobicContact CE1-CG 4.5Å; Y8-L40 HydrophobicContact CE2-CD1 4.27Å; Y8-L40 VanDerWaalsContact CZ-CD1 3.48Å; Y8-K43 HydrophobicContact CE1-CD 4.07Å; Y8-K43 PolarHBondContact OH-NZ 3.38Å
9	K	23.9	Very low	25.7	Very low	199 Å²	199	121.4 Å²	121.4	87%	0.865	62%	0.619	S	S	*	*			trans	-108.7	106.6	171.2	-176.4	179.3	177.2	-178.1	0	108.5
10	I	27.8	Very low	26	Very low	66 Å²	66	118 Å²	118	34%	0.338	60%	0.599	S	S	.	*			trans	-123.5	126.3	173.1	-66.1	172	0	0	0	107.1	G12 E47	I10-G12 PolarHBondContact O-N 3.38Å; I10-G12 VanDerWaalsContact O-N 3.15Å; I10-E47 WeakPolarHBondContact CD1-OE2 3.14Å
11	E	26.7	Very low	26.1	Very low	191 Å²	191	116.4 Å²	116.4	89%	0.893	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	116.2	172.9	-61.7	179.1	148.3	0	0	109.3
12	G	27.7	Very low	26.6	Very low	75 Å²	75	110.3 Å²	110.3	77%	0.773	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	152.4	-37.6	176.4	0	0	0	0	0	116.1	I10	I10-G12 PolarHBondContact O-N 3.38Å; I10-G12 VanDerWaalsContact O-N 3.15Å
13	L	24.3	Very low	27.1	Very low	144 Å²	144	108.5 Å²	108.5	75%	0.754	56%	0.558	S	S	*	*	S	Bend	trans	-139.7	130	-176.9	-83.3	164.4	0	0	0	112.1	F15	L13-F15 PolarHBondContact O-N 2.79Å
14	P	27.4	Very low	27.8	Very low	115 Å²	115	105.1 Å²	105.1	75%	0.747	56%	0.555	S	S	*	*			trans	-91.7	85.2	-169.3	35.9	-35.3	0	0	0	113
15	F	24.9	Very low	28.3	Very low	167 Å²	167	107.5 Å²	107.5	73%	0.732	56%	0.561	S	S	*	*			trans	-134.6	122.2	166	-66.9	-76.1	0	0	0	111.4	L13	L13-F15 PolarHBondContact O-N 2.79Å
16	I	26.4	Very low	28.8	Very low	150 Å²	150	105.5 Å²	105.5	77%	0.769	56%	0.56	S	S	*	*			trans	-106.4	120.5	173.8	-58.5	168.9	0	0	0	106.4
17	I	25.2	Very low	29.1	Very low	105 Å²	105	105.1 Å²	105.1	54%	0.538	56%	0.564	S	S	.	*			trans	-133.3	137.7	168.6	-34.4	-178.1	0	0	0	108.9	I5 H7	I5-I17 HydrophobicContact CD1-CG2 4.28Å; I5-I17 HydrophobicContact CG2-CB 4Å; I5-I17 HydrophobicContact CG2-CG2 3.66Å; H7-I17 PolarHBondContact CE1-O 2.72Å; H7-I17 PolarHBondContact ND1-O 3.11Å
18	T	29.2	Very low	29.5	Very low	47 Å²	47	102.1 Å²	102.1	29%	0.288	56%	0.555	S	S	.	*			trans	-133.1	139.1	-152.6	-48.6	0	0	0	0	110.6	H7 Y20	H7-T18 PolarHBondContact CE1-OG1 2.98Å; H7-T18 WeakPolarHBondContact NE2-CA 3.29Å; H7-T18 WeakPolarHBondContact NE2-CG2 3.41Å; T18-Y20 HydrophobicContact CG2-CD2 4.2Å; T18-Y20 HydrophobicContact CG2-CE1 4.39Å; T18-Y20 HydrophobicContact CG2-CE2 3.22Å; T18-Y20 WeakPolarHBondContact CG2-OH 3.27Å
19	K	30.4	Very low	30	Very low	65 Å²	65	101.2 Å²	101.2	28%	0.283	56%	0.555	S	S	.	*			trans	-138.7	125.7	170	-171	-155.1	144.3	-155.8	0	113.7	K3 I5 T21	K3-K19 VanDerWaalsContact O-CD 3.3Å; K3-K19 WeakPolarHBondContact O-CD 3.07Å; K3-K19 WeakPolarHBondContact O-CE 3.34Å; K3-K19 PolarHBondContact O-NZ 2.92Å; I5-K19 HydrophobicContact CB-CB 3.81Å; I5-K19 HydrophobicContact CG1-CB 4.13Å; I5-K19 WeakPolarHBondContact O-CB 3.41Å; K19-T21 VanDerWaalsContact CE-OG1 3.3Å; K19-T21 WeakPolarHBondContact CE-OG1 3.49Å; K19-T21 PolarHBondContact NZ-OG1 3.08Å; K19-T21 VanDerWaalsContact NZ-OG1 3.11Å
20	Y	31.7	Very low	30.5	Very low	54 Å²	54	93.7 Å²	93.7	21%	0.212	53%	0.529	C	S	.	.			trans	-99.2	151.8	164.6	-52.7	-74.4	0	0	0	110.7	T18 M83 I109	T18-Y20 HydrophobicContact CG2-CD2 4.2Å; T18-Y20 HydrophobicContact CG2-CE1 4.39Å; T18-Y20 HydrophobicContact CG2-CE2 3.22Å; T18-Y20 WeakPolarHBondContact CG2-OH 3.27Å; Y20-M83 HydrophobicContact CD1-CE 3.67Å; Y20-M83 HydrophobicContact CD1-SD 3.77Å; Y20-M83 HydrophobicContact CE1-CE 4.43Å; Y20-M83 HydrophobicContact CG-SD 4.29Å; Y20-I109 HydrophobicContact CD2-CD1 3.79Å; Y20-I109 HydrophobicContact CD2-CG1 3.86Å; Y20-I109 HydrophobicContact CE1-CG2 4.37Å; Y20-I109 HydrophobicContact CE2-CB 4.28Å; Y20-I109 HydrophobicContact CE2-CD1 3.38Å; Y20-I109 HydrophobicContact CE2-CG1 3.48Å; Y20-I109 VanDerWaalsContact CE2-CG1 3.48Å; Y20-I109 HydrophobicContact CE2-CG2 3.8Å; Y20-I109 VanDerWaalsContact CZ-CG2 3.5Å; Y20-I109 WeakPolarHBondContact OH-CG2 3.05Å
21	T	29.1	Very low	31	Very low	85 Å²	85	96.2 Å²	96.2	52%	0.521	54%	0.543	S	S	.	.			trans	-115.3	108.8	164.2	-47.1	0	0	0	0	106	K19 N23 I29	K19-T21 VanDerWaalsContact CE-OG1 3.3Å; K19-T21 WeakPolarHBondContact CE-OG1 3.49Å; K19-T21 PolarHBondContact NZ-OG1 3.08Å; K19-T21 VanDerWaalsContact NZ-OG1 3.11Å; T21-N23 PolarHBondContact O-N 3.33Å; T21-I29 WeakPolarHBondContact O-CD1 3.27Å
22	V	30.2	Very low	31.4	Very low	118 Å²	118	93.7 Å²	93.7	72%	0.715	53%	0.531	S	S	*	.			trans	-86.1	115.9	-176.2	-174.6	0	0	0	0	109.2
23	N	33.8	Very low	31.7	Very low	77 Å²	77	93.8 Å²	93.8	41%	0.412	53%	0.525	S	S	.	.			trans	-87.7	134.9	157.2	-172.2	2.4	0	0	0	107.7	T21 K25 T27	T21-N23 PolarHBondContact O-N 3.33Å; N23-K25 VanDerWaalsContact C-N 3.25Å; N23-K25 PolarHBondContact ND2-O 2.98Å; N23-K25 PolarHBondContact OD1-N 2.82Å; N23-K25 VanDerWaalsContact OD1-N 3.08Å; N23-T27 PolarHBondContact ND2-OG1 2.98Å
24	S	34.9	Very low	32.7	Very low	96 Å²	96	89.3 Å²	89.3	67%	0.671	51%	0.506	S	S	*	.	S	Bend	trans	-73.8	-20.2	173.7	55.1	0	0	0	0	112.4
25	K	36.8	Very low	33.7	Very low	154 Å²	154	91.6 Å²	91.6	67%	0.67	51%	0.506	S	S	*	.	S	Bend	trans	-81.3	133.3	166.4	-56	-173.7	177.7	-171.7	0	108.3	N23 T27	N23-K25 VanDerWaalsContact C-N 3.25Å; N23-K25 PolarHBondContact ND2-O 2.98Å; N23-K25 PolarHBondContact OD1-N 2.82Å; N23-K25 VanDerWaalsContact OD1-N 3.08Å; K25-T27 PolarHBondContact O-N 3.26Å; K25-T27 PolarHBondContact O-OG1 2.94Å
26	G	35.9	Very low	34.7	Very low	37 Å²	37	88.1 Å²	88.1	38%	0.381	50%	0.495	S	S	.	.			trans	-66.6	35.3	-177.1	0	0	0	0	0	116.4	S28	G26-S28 PolarHBondContact O-N 3.3Å
27	T	33.1	Very low	35.7	Very low	83 Å²	83	84.6 Å²	84.6	51%	0.509	47%	0.474	S	S	.	.			trans	-65.1	117.6	170.2	52.4	0	0	0	0	109.5	N23 K25 I29	N23-T27 PolarHBondContact ND2-OG1 2.98Å; K25-T27 PolarHBondContact O-N 3.26Å; K25-T27 PolarHBondContact O-OG1 2.94Å; T27-I29 PolarHBondContact O-N 3.32Å
28	S	33.5	Very low	37.3	Very low	40 Å²	40	86 Å²	86	28%	0.28	48%	0.476	S	S	.	.			trans	-54.5	125.9	166.2	62.9	0	0	0	0	109.4	G26 A30	G26-S28 PolarHBondContact O-N 3.3Å; S28-A30 VanDerWaalsContact C-N 3.34Å; S28-A30 PolarHBondContact O-N 3.45Å
29	I	37	Very low	38.7	Very low	57 Å²	57	90 Å²	90	29%	0.292	49%	0.492	S	S	.	.			trans	-81.5	89.5	175.5	-57.9	176.5	0	0	0	107.6	T21 T27 L31 M83	T21-I29 WeakPolarHBondContact O-CD1 3.27Å; T27-I29 PolarHBondContact O-N 3.32Å; I29-L31 HydrophobicContact CG2-CD2 4.47Å; I29-L31 HydrophobicContact CG2-CG 4.37Å; I29-L31 PolarHBondContact O-N 3.06Å; I29-L31 VanDerWaalsContact O-N 3.15Å; I29-M83 HydrophobicContact CD1-CE 4.15Å; I29-M83 HydrophobicContact CD1-SD 4.18Å
30	A	34	Very low	39.9	Very low	41 Å²	41	89.3 Å²	89.3	34%	0.339	49%	0.491	S	S	.	.			trans	-62.4	112.1	161.2	0	0	0	0	0	107.6	S28 E32	S28-A30 VanDerWaalsContact C-N 3.34Å; S28-A30 PolarHBondContact O-N 3.45Å; A30-E32 HydrophobicContact CB-CG 4.45Å; A30-E32 PolarHBondContact O-N 2.86Å
31	L	38.2	Very low	41.1	Very low	120 Å²	120	87.8 Å²	87.8	63%	0.628	49%	0.487	S	S	*	.			trans	-76.7	39.9	170.9	-77.4	163.1	0	0	0	111.1	I29 A33	I29-L31 HydrophobicContact CG2-CD2 4.47Å; I29-L31 HydrophobicContact CG2-CG 4.37Å; I29-L31 PolarHBondContact O-N 3.06Å; I29-L31 VanDerWaalsContact O-N 3.15Å; L31-A33 PolarHBondContact O-N 3.37Å
32	E	34.9	Very low	42.8	Very low	137 Å²	137	92.5 Å²	92.5	64%	0.64	50%	0.495	S	S	*	.			trans	-78.9	120.1	174.1	-75.4	-173.2	127.3	0	0	110.2	A30 S34	A30-E32 HydrophobicContact CB-CG 4.45Å; A30-E32 PolarHBondContact O-N 2.86Å; E32-S34 PolarHBondContact O-N 3.24Å
33	A	35.4	Very low	44.6	Very low	77 Å²	77	91.2 Å²	91.2	64%	0.636	48%	0.48	S	S	*	.			trans	60.6	30.1	157.4	0	0	0	0	0	119.2	L31	L31-A33 PolarHBondContact O-N 3.37Å
34	S	43.6	Very low	45.9	Very low	51 Å²	51	90.4 Å²	90.4	36%	0.357	48%	0.475	S	S	.	.			trans	-61.6	147.2	158.4	70.5	0	0	0	0	110.9	E32 I36 F37 K38	E32-S34 PolarHBondContact O-N 3.24Å; S34-I36 PolarHBondContact O-N 3.14Å; S34-F37 WeakPolarHBondContact O-CB 3.2Å; S34-F37 PolarHBondContact O-N 3.35Å; S34-F37 PolarHBondContact OG-N 2.79Å; S34-K38 PolarHBondContact O-N 3.28Å
35	E	49.2	Very low	47.4	Very low	162 Å²	162	87.7 Å²	87.7	76%	0.757	45%	0.453	S	S	*	.	H	α-helix	trans	-57.5	-35.4	175.2	-66.6	-173.3	136.7	0	0	111.9	F37 K38 E39	E35-F37 PolarHBondContact O-N 3.08Å; E35-K38 WeakPolarHBondContact O-CA 3.17Å; E35-K38 WeakPolarHBondContact O-CB 3.4Å; E35-K38 PolarHBondContact O-N 2.79Å; E35-E39 PolarHBondContact O-N 2.68Å
36	I	45.8	Very low	49.1	Very low	95 Å²	95	85.2 Å²	85.2	49%	0.487	45%	0.447	S	S	.	.	H	α-helix	trans	-55.3	-39.1	173.3	-56.5	169.6	0	0	0	111.1	S34 K38 E39 L40	S34-I36 PolarHBondContact O-N 3.14Å; I36-K38 VanDerWaalsContact C-N 3.34Å; I36-K38 PolarHBondContact O-N 3.32Å; I36-E39 PolarHBondContact O-N 3.2Å; I36-L40 VanDerWaalsContact O-CB 3.23Å; I36-L40 WeakPolarHBondContact O-CB 3.3Å; I36-L40 PolarHBondContact O-N 3.3Å
37	F	48	Very low	50.8	Low	75 Å²	75	86 Å²	86	33%	0.329	44%	0.441	S	S	.	.	H	α-helix	trans	-67.5	-34.5	176.8	-168.3	-91.2	0	0	0	112.1	S34 E35 T41 Y76	S34-F37 WeakPolarHBondContact O-CB 3.2Å; S34-F37 PolarHBondContact O-N 3.35Å; S34-F37 PolarHBondContact OG-N 2.79Å; E35-F37 PolarHBondContact O-N 3.08Å; F37-T41 WeakPolarHBondContact O-CB 3.36Å; F37-T41 PolarHBondContact O-N 2.76Å; F37-T41 PolarHBondContact O-OG1 2.98Å; F37-Y76 HydrophobicContact CZ-CD1 4.02Å
38	K	57.5	Low	52.2	Low	136 Å²	136	84.3 Å²	84.3	59%	0.591	43%	0.429	S	S	*	.	H	α-helix	trans	-68.2	-44.3	174.8	-61.9	178.3	-179.2	171.5	0	111.2	S34 E35 I36 T41 W42	S34-K38 PolarHBondContact O-N 3.28Å; E35-K38 WeakPolarHBondContact O-CA 3.17Å; E35-K38 WeakPolarHBondContact O-CB 3.4Å; E35-K38 PolarHBondContact O-N 2.79Å; I36-K38 VanDerWaalsContact C-N 3.34Å; I36-K38 PolarHBondContact O-N 3.32Å; K38-T41 PolarHBondContact O-N 3.49Å; K38-W42 PolarHBondContact O-N 2.81Å
39	E	60.2	Low	54.1	Low	131 Å²	131	87.7 Å²	87.7	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-63.8	-46.3	176.9	-173.3	174.1	-170.2	0	0	111.7	E35 I36 T41 W42 K43	E35-E39 PolarHBondContact O-N 2.68Å; I36-E39 PolarHBondContact O-N 3.2Å; E39-T41 VanDerWaalsContact C-N 3.33Å; E39-T41 PolarHBondContact O-N 3.08Å; E39-W42 PolarHBondContact O-N 2.96Å; E39-K43 WeakPolarHBondContact O-CB 3.49Å; E39-K43 PolarHBondContact O-N 3Å
40	L	55.5	Low	55.9	Low	50 Å²	50	88.4 Å²	88.4	26%	0.262	45%	0.453	S	S	.	.	H	α-helix	trans	-58.6	-44.7	173.8	-164.7	85	0	0	0	111.2	Y8 I36 W42 K43 L44	Y8-L40 HydrophobicContact CD1-CD1 4.2Å; Y8-L40 HydrophobicContact CE1-CD1 3.44Å; Y8-L40 VanDerWaalsContact CE1-CD1 3.44Å; Y8-L40 HydrophobicContact CE1-CG 4.5Å; Y8-L40 HydrophobicContact CE2-CD1 4.27Å; Y8-L40 VanDerWaalsContact CZ-CD1 3.48Å; I36-L40 VanDerWaalsContact O-CB 3.23Å; I36-L40 WeakPolarHBondContact O-CB 3.3Å; I36-L40 PolarHBondContact O-N 3.3Å; L40-W42 PolarHBondContact O-N 3.44Å; L40-K43 PolarHBondContact O-N 3.17Å; L40-L44 VanDerWaalsContact O-CB 3.23Å; L40-L44 WeakPolarHBondContact O-CB 3.29Å; L40-L44 PolarHBondContact O-N 3.29Å
41	T	57	Low	57.7	Low	22 Å²	22	90.9 Å²	90.9	14%	0.135	46%	0.456	C	S	.	.	H	α-helix	trans	-61.7	-42.2	176.7	-63.9	0	0	0	0	111.4	F37 K38 E39 N45 M129	F37-T41 WeakPolarHBondContact O-CB 3.36Å; F37-T41 PolarHBondContact O-N 2.76Å; F37-T41 PolarHBondContact O-OG1 2.98Å; K38-T41 PolarHBondContact O-N 3.49Å; E39-T41 VanDerWaalsContact C-N 3.33Å; E39-T41 PolarHBondContact O-N 3.08Å; T41-N45 WeakPolarHBondContact O-CB 3.22Å; T41-N45 PolarHBondContact O-N 3.42Å; T41-N45 PolarHBondContact O-ND2 2.83Å; T41-M129 HydrophobicContact CG2-CE 4.06Å
42	W	64.6	Low	59	Low	184 Å²	184	87.7 Å²	87.7	70%	0.697	44%	0.437	S	S	*	.	H	α-helix	trans	-64.6	-50.6	177.4	175.8	58.4	0	0	0	112	K38 E39 L40 L44 N45 D46	K38-W42 PolarHBondContact O-N 2.81Å; E39-W42 PolarHBondContact O-N 2.96Å; L40-W42 PolarHBondContact O-N 3.44Å; W42-L44 VanDerWaalsContact C-N 3.35Å; W42-L44 PolarHBondContact O-N 3.14Å; W42-N45 WeakPolarHBondContact O-CB 3.04Å; W42-N45 PolarHBondContact O-N 2.94Å; W42-N45 VanDerWaalsContact O-N 3.13Å; W42-D46 PolarHBondContact O-N 3.03Å; W42-D46 VanDerWaalsContact O-N 3.1Å
43	K	66.6	Low	61	Low	91 Å²	91	84.4 Å²	84.4	40%	0.396	43%	0.43	S	S	.	.	H	α-helix	trans	-60.3	-41.9	178	-174.6	176.8	173.6	-172.1	0	112.4	Y8 E39 L40 N45 D46 E47	Y8-K43 HydrophobicContact CE1-CD 4.07Å; Y8-K43 PolarHBondContact OH-NZ 3.38Å; E39-K43 WeakPolarHBondContact O-CB 3.49Å; E39-K43 PolarHBondContact O-N 3Å; L40-K43 PolarHBondContact O-N 3.17Å; K43-N45 VanDerWaalsContact C-N 3.33Å; K43-N45 PolarHBondContact O-N 2.94Å; K43-D46 PolarHBondContact O-N 3.43Å; K43-E47 PolarHBondContact O-N 3.14Å; K43-E47 VanDerWaalsContact O-N 3.09Å
44	L	61.7	Low	62.8	Low	60 Å²	60	88.6 Å²	88.6	31%	0.314	43%	0.43	S	S	.	.	H	α-helix	trans	-64.2	-37.4	176.2	-160.4	97	0	0	0	111.8	L40 W42 L48	L40-L44 VanDerWaalsContact O-CB 3.23Å; L40-L44 WeakPolarHBondContact O-CB 3.29Å; L40-L44 PolarHBondContact O-N 3.29Å; W42-L44 VanDerWaalsContact C-N 3.35Å; W42-L44 PolarHBondContact O-N 3.14Å; L44-L48 VanDerWaalsContact O-CB 3.3Å; L44-L48 WeakPolarHBondContact O-CB 3.1Å; L44-L48 PolarHBondContact O-N 3.38Å
45	N	66.8	Low	64	Low	39 Å²	39	89.8 Å²	89.8	21%	0.209	43%	0.432	C	S	.	.	H	α-helix	trans	-66.5	-37.7	175.9	-79.7	-54.4	0	0	0	112.5	T41 W42 K43 L48 L49 M129	T41-N45 WeakPolarHBondContact O-CB 3.22Å; T41-N45 PolarHBondContact O-N 3.42Å; T41-N45 PolarHBondContact O-ND2 2.83Å; W42-N45 WeakPolarHBondContact O-CB 3.04Å; W42-N45 PolarHBondContact O-N 2.94Å; W42-N45 VanDerWaalsContact O-N 3.13Å; K43-N45 VanDerWaalsContact C-N 3.33Å; K43-N45 PolarHBondContact O-N 2.94Å; N45-L48 WeakPolarHBondContact O-CB 3.24Å; N45-L48 PolarHBondContact O-N 2.93Å; N45-L49 WeakPolarHBondContact O-CG 3.39Å; N45-L49 PolarHBondContact O-N 3.14Å; N45-M129 WeakPolarHBondContact ND2-CE 3.35Å
46	D	72.5	Confident	65	Low	102 Å²	102	83 Å²	83	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.9	-164.4	58.6	0	0	0	111.7	W42 K43 L48 L49 S50	W42-D46 PolarHBondContact O-N 3.03Å; W42-D46 VanDerWaalsContact O-N 3.1Å; K43-D46 PolarHBondContact O-N 3.43Å; D46-L48 VanDerWaalsContact C-N 3.33Å; D46-L48 PolarHBondContact O-N 2.05Å; D46-L49 PolarHBondContact O-N 3.39Å; D46-S50 PolarHBondContact O-N 3.34Å; D46-S50 PolarHBondContact O-OG 2.86Å
47	E	71.1	Confident	66.5	Low	54 Å²	54	83 Å²	83	25%	0.252	40%	0.4	S	S	.	.	H	α-helix	trans	-63.9	-35.3	170.3	-71.8	-173.8	-178.3	0	0	113.1	I10 K43 L49 S50 K51	I10-E47 WeakPolarHBondContact CD1-OE2 3.14Å; K43-E47 PolarHBondContact O-N 3.14Å; K43-E47 VanDerWaalsContact O-N 3.09Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-S50 PolarHBondContact O-OG 3.49Å; E47-K51 WeakPolarHBondContact O-CB 3.4Å; E47-K51 WeakPolarHBondContact O-CG 3.03Å; E47-K51 PolarHBondContact O-N 3.29Å
48	L	64.1	Low	67.6	Low	46 Å²	46	82.4 Å²	82.4	24%	0.241	40%	0.399	C	S	.	.	H	α-helix	trans	-66.1	-38.4	175.7	-154.1	83.9	0	0	0	111.2	L44 N45 D46 K52 I72 P74	L44-L48 VanDerWaalsContact O-CB 3.3Å; L44-L48 WeakPolarHBondContact O-CB 3.1Å; L44-L48 PolarHBondContact O-N 3.38Å; N45-L48 WeakPolarHBondContact O-CB 3.24Å; N45-L48 PolarHBondContact O-N 2.93Å; D46-L48 VanDerWaalsContact C-N 3.33Å; D46-L48 PolarHBondContact O-N 2.05Å; L48-K52 WeakPolarHBondContact O-CB 3.41Å; L48-K52 PolarHBondContact O-N 2.97Å; L48-I72 HydrophobicContact CD1-CG2 3.94Å; L48-I72 HydrophobicContact CD2-CB 4.14Å; L48-I72 HydrophobicContact CD2-CG2 3.9Å; L48-I72 HydrophobicContact CG-CB 4.41Å; L48-I72 HydrophobicContact CG-CG2 4.05Å; L48-P74 HydrophobicContact CD2-CG 4.35Å
49	L	71.5	Confident	68	Low	112 Å²	112	78 Å²	78	59%	0.586	38%	0.382	S	S	*	.	H	α-helix	trans	-66.2	-45.7	176.6	-77.1	165.5	0	0	0	111.7	N45 D46 E47 K52 S53	N45-L49 WeakPolarHBondContact O-CG 3.39Å; N45-L49 PolarHBondContact O-N 3.14Å; D46-L49 PolarHBondContact O-N 3.39Å; E47-L49 VanDerWaalsContact C-N 3.34Å; L49-K52 PolarHBondContact O-N 3.45Å; L49-S53 PolarHBondContact O-N 2.78Å
50	S	75.5	Confident	68.8	Low	72 Å²	72	75.3 Å²	75.3	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-44.9	177.1	61.6	0	0	0	0	112.1	D46 E47 K52 S53 Y54	D46-S50 PolarHBondContact O-N 3.34Å; D46-S50 PolarHBondContact O-OG 2.86Å; E47-S50 PolarHBondContact O-OG 3.49Å; S50-K52 PolarHBondContact O-N 2.64Å; S50-S53 WeakPolarHBondContact O-CB 3.23Å; S50-S53 PolarHBondContact O-N 3.38Å; S50-Y54 PolarHBondContact O-N 2.86Å
51	K	71.6	Confident	69.8	Low	92 Å²	92	80.6 Å²	80.6	40%	0.4	39%	0.392	S	S	.	.	H	α-helix	trans	-62.4	-39.8	173.3	-75.5	174.7	-178.4	164.3	0	113.1	E47 S53 Y54 L55	E47-K51 WeakPolarHBondContact O-CB 3.4Å; E47-K51 WeakPolarHBondContact O-CG 3.03Å; E47-K51 PolarHBondContact O-N 3.29Å; K51-S53 VanDerWaalsContact C-N 3.32Å; K51-S53 PolarHBondContact O-N 3.38Å; K51-Y54 PolarHBondContact O-N 2.65Å; K51-L55 VanDerWaalsContact O-CB 3.32Å; K51-L55 WeakPolarHBondContact O-CB 3.33Å; K51-L55 PolarHBondContact O-N 3.05Å
52	K	66.6	Low	70.5	Confident	53 Å²	53	87.4 Å²	87.4	23%	0.23	42%	0.419	C	S	.	.	H	α-helix	trans	-60.9	-42	174.8	172.4	169.6	161.9	155	0	111.4	L48 L49 S50 T56 V70 I72	L48-K52 WeakPolarHBondContact O-CB 3.41Å; L48-K52 PolarHBondContact O-N 2.97Å; L49-K52 PolarHBondContact O-N 3.45Å; S50-K52 PolarHBondContact O-N 2.64Å; K52-T56 WeakPolarHBondContact O-CB 3.3Å; K52-T56 PolarHBondContact O-N 2.86Å; K52-T56 PolarHBondContact O-OG1 3.36Å; K52-V70 WeakPolarHBondContact CE-O 3.42Å; K52-V70 HydrophobicContact CG-CB 4.33Å; K52-V70 HydrophobicContact CG-CG1 4.21Å; K52-V70 PolarHBondContact NZ-O 2.83Å; K52-I72 HydrophobicContact CB-CD1 3.8Å; K52-I72 HydrophobicContact CB-CG1 4.45Å; K52-I72 HydrophobicContact CG-CD1 4.39Å
53	S	75.4	Confident	70.9	Confident	69 Å²	69	84.9 Å²	84.9	48%	0.483	41%	0.414	S	S	.	.	H	α-helix	trans	-60.9	-53.3	175	-166.4	0	0	0	0	110.8	L49 S50 K51 L55 T56 E57	L49-S53 PolarHBondContact O-N 2.78Å; S50-S53 WeakPolarHBondContact O-CB 3.23Å; S50-S53 PolarHBondContact O-N 3.38Å; K51-S53 VanDerWaalsContact C-N 3.32Å; K51-S53 PolarHBondContact O-N 3.38Å; S53-L55 PolarHBondContact O-N 3.43Å; S53-T56 WeakPolarHBondContact O-CB 3.12Å; S53-T56 PolarHBondContact O-N 3.06Å; S53-E57 PolarHBondContact O-N 3.07Å
54	Y	74.4	Confident	71.4	Confident	164 Å²	164	85.9 Å²	85.9	64%	0.643	43%	0.432	S	S	*	.	H	α-helix	trans	-55.7	-47.4	178	-179.6	-111.5	0	0	0	113.2	S50 K51 T56 E57 I58	S50-Y54 PolarHBondContact O-N 2.86Å; K51-Y54 PolarHBondContact O-N 2.65Å; Y54-T56 VanDerWaalsContact C-N 3.32Å; Y54-T56 PolarHBondContact O-N 3.07Å; Y54-E57 PolarHBondContact O-N 2.9Å; Y54-I58 HydrophobicContact CD1-CD1 3.92Å; Y54-I58 HydrophobicContact CD2-CD1 4.48Å; Y54-I58 HydrophobicContact CE1-CD1 3.4Å; Y54-I58 HydrophobicContact CE2-CD1 4.03Å; Y54-I58 HydrophobicContact CG-CD1 4.44Å; Y54-I58 VanDerWaalsContact CZ-CD1 3.47Å; Y54-I58 PolarHBondContact O-N 3.32Å
55	L	69.1	Low	71.7	Confident	77 Å²	77	85 Å²	85	40%	0.403	43%	0.433	S	S	.	.	H	α-helix	trans	-65.1	-35.4	177.2	-171.6	66.5	0	0	0	112	K51 S53 L59 V70	K51-L55 VanDerWaalsContact O-CB 3.32Å; K51-L55 WeakPolarHBondContact O-CB 3.33Å; K51-L55 PolarHBondContact O-N 3.05Å; S53-L55 PolarHBondContact O-N 3.43Å; L55-L59 HydrophobicContact CG-CD1 4.02Å; L55-L59 HydrophobicContact CG-CG 4.46Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 WeakPolarHBondContact O-CG 3.44Å; L55-L59 PolarHBondContact O-N 3.36Å; L55-V70 HydrophobicContact CD2-CG1 4.09Å
56	T	69.9	Low	71.8	Confident	18 Å²	18	92 Å²	92	11%	0.11	46%	0.461	C	S	.	.	H	α-helix	trans	-64.4	-42.5	176.4	-57.3	0	0	0	0	111.2	K52 S53 Y54 L59 K60 V70	K52-T56 WeakPolarHBondContact O-CB 3.3Å; K52-T56 PolarHBondContact O-N 2.86Å; K52-T56 PolarHBondContact O-OG1 3.36Å; S53-T56 WeakPolarHBondContact O-CB 3.12Å; S53-T56 PolarHBondContact O-N 3.06Å; Y54-T56 VanDerWaalsContact C-N 3.32Å; Y54-T56 PolarHBondContact O-N 3.07Å; T56-L59 PolarHBondContact O-N 2.68Å; T56-K60 HydrophobicContact CG2-CD 4.33Å; T56-K60 VanDerWaalsContact O-CG 3.3Å; T56-K60 WeakPolarHBondContact O-CG 3.24Å; T56-K60 PolarHBondContact O-N 2.86Å; T56-V70 HydrophobicContact CG2-CG2 4.47Å; T56-V70 VanDerWaalsContact OG1-CG2 3.27Å; T56-V70 WeakPolarHBondContact OG1-CG2 3.44Å
57	E	76.9	Confident	71.5	Confident	96 Å²	96	95.4 Å²	95.4	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-67.9	-45.1	177.5	-62.6	-45.9	122.6	0	0	112.3	S53 Y54 L59 K60 E61	S53-E57 PolarHBondContact O-N 3.07Å; Y54-E57 PolarHBondContact O-N 2.9Å; E57-L59 VanDerWaalsContact C-N 3.27Å; E57-L59 PolarHBondContact O-N 3.06Å; E57-K60 PolarHBondContact O-N 3.44Å; E57-K60 VanDerWaalsContact O-N 3.14Å; E57-K60 IonicContact OE1-NZ 3.45Å; E57-K60 PolarHBondContact OE1-NZ 3.4Å; E57-K60 WeakPolarHBondContact OE2-CD 3.44Å; E57-K60 IonicContact OE2-NZ 3.33Å; E57-K60 PolarHBondContact OE2-NZ 2.03Å; E57-E61 WeakPolarHBondContact O-CB 3.3Å; E57-E61 PolarHBondContact O-N 3.02Å
58	I	71.6	Confident	71.1	Confident	62 Å²	62	95 Å²	95	32%	0.318	47%	0.473	S	S	.	.	H	α-helix	trans	-55.5	-43.6	173.8	-73.1	174.5	0	0	0	111.3	Y54 K62	Y54-I58 HydrophobicContact CD1-CD1 3.92Å; Y54-I58 HydrophobicContact CD2-CD1 4.48Å; Y54-I58 HydrophobicContact CE1-CD1 3.4Å; Y54-I58 HydrophobicContact CE2-CD1 4.03Å; Y54-I58 HydrophobicContact CG-CD1 4.44Å; Y54-I58 VanDerWaalsContact CZ-CD1 3.47Å; Y54-I58 PolarHBondContact O-N 3.32Å; I58-K62 VanDerWaalsContact O-CB 3.22Å; I58-K62 WeakPolarHBondContact O-CB 3.22Å; I58-K62 PolarHBondContact O-N 3.04Å
59	L	65.8	Low	71	Confident	45 Å²	45	100.8 Å²	100.8	24%	0.236	50%	0.496	C	S	.	.	H	α-helix	trans	-68.7	-40.2	179.5	-70.6	171.8	0	0	0	111.5	L55 T56 E57 K62 F63 I68 V70	L55-L59 HydrophobicContact CG-CD1 4.02Å; L55-L59 HydrophobicContact CG-CG 4.46Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 WeakPolarHBondContact O-CG 3.44Å; L55-L59 PolarHBondContact O-N 3.36Å; T56-L59 PolarHBondContact O-N 2.68Å; E57-L59 VanDerWaalsContact C-N 3.27Å; E57-L59 PolarHBondContact O-N 3.06Å; L59-K62 PolarHBondContact O-N 3.2Å; L59-F63 HydrophobicContact CB-CD2 4.49Å; L59-F63 HydrophobicContact CD2-CD2 3.97Å; L59-F63 HydrophobicContact CD2-CE2 3.63Å; L59-F63 WeakPolarHBondContact O-CB 2.96Å; L59-F63 WeakPolarHBondContact O-CD2 3.4Å; L59-F63 PolarHBondContact O-N 3.43Å; L59-I68 HydrophobicContact CB-CD1 3.74Å; L59-I68 HydrophobicContact CB-CG2 4.15Å; L59-I68 HydrophobicContact CD1-CG2 4.29Å; L59-I68 WeakPolarHBondContact O-CD1 3.32Å; L59-V70 HydrophobicContact CD1-CG2 3.69Å
60	K	75.6	Confident	70.3	Confident	73 Å²	73	96.3 Å²	96.3	32%	0.317	47%	0.473	S	S	.	.	H	α-helix	trans	-60.7	-46	176.2	-78.1	167.2	174.1	174.2	0	111.3	T56 E57 S64	T56-K60 HydrophobicContact CG2-CD 4.33Å; T56-K60 VanDerWaalsContact O-CG 3.3Å; T56-K60 WeakPolarHBondContact O-CG 3.24Å; T56-K60 PolarHBondContact O-N 2.86Å; E57-K60 PolarHBondContact O-N 3.44Å; E57-K60 VanDerWaalsContact O-N 3.14Å; E57-K60 IonicContact OE1-NZ 3.45Å; E57-K60 PolarHBondContact OE1-NZ 3.4Å; E57-K60 WeakPolarHBondContact OE2-CD 3.44Å; E57-K60 IonicContact OE2-NZ 3.33Å; E57-K60 PolarHBondContact OE2-NZ 2.03Å; K60-S64 WeakPolarHBondContact O-CA 2.98Å; K60-S64 PolarHBondContact O-N 2.87Å
61	E	77.2	Confident	69.1	Low	162 Å²	162	96.1 Å²	96.1	76%	0.757	47%	0.469	S	S	*	.	H	α-helix	trans	-61.1	-50.7	176.8	-175.1	-178.8	-175.2	0	0	110.8	E57 F63	E57-E61 WeakPolarHBondContact O-CB 3.3Å; E57-E61 PolarHBondContact O-N 3.02Å; E61-F63 PolarHBondContact O-N 3.39Å
62	K	72.3	Confident	68.1	Low	164 Å²	164	94.5 Å²	94.5	71%	0.713	47%	0.465	S	S	*	.	H	α-helix	trans	-69.7	-31.4	-174.8	-170.9	169.1	-175.6	174.2	0	114.4	I58 L59	I58-K62 VanDerWaalsContact O-CB 3.22Å; I58-K62 WeakPolarHBondContact O-CB 3.22Å; I58-K62 PolarHBondContact O-N 3.04Å; L59-K62 PolarHBondContact O-N 3.2Å
63	F	73.7	Confident	67.3	Low	132 Å²	132	93.4 Å²	93.4	58%	0.579	46%	0.462	S	S	*	.	H	α-helix	trans	-108.8	-0.6	-176.3	-68.4	-78.7	0	0	0	114.2	L59 E61 A65 I68	L59-F63 HydrophobicContact CB-CD2 4.49Å; L59-F63 HydrophobicContact CD2-CD2 3.97Å; L59-F63 HydrophobicContact CD2-CE2 3.63Å; L59-F63 WeakPolarHBondContact O-CB 2.96Å; L59-F63 WeakPolarHBondContact O-CD2 3.4Å; L59-F63 PolarHBondContact O-N 3.43Å; E61-F63 PolarHBondContact O-N 3.39Å; F63-A65 PolarHBondContact O-N 3.2Å; F63-I68 HydrophobicContact CB-CD1 4.15Å
64	S	77.1	Confident	66.1	Low	112 Å²	112	91.5 Å²	91.5	78%	0.783	45%	0.448	S	S	*	.			trans	52	22	-178.9	-64.8	0	0	0	0	115	K60	K60-S64 WeakPolarHBondContact O-CA 2.98Å; K60-S64 PolarHBondContact O-N 2.87Å
65	A	66.8	Low	64.9	Low	40 Å²	40	88.8 Å²	88.8	33%	0.331	44%	0.438	S	S	.	.			trans	-92.5	123.4	-174.1	0	0	0	0	0	110.9	F63 H67 I68	F63-A65 PolarHBondContact O-N 3.2Å; A65-H67 PolarHBondContact O-N 3.1Å; A65-H67 VanDerWaalsContact O-N 3.08Å; A65-I68 HydrophobicContact CB-CD1 4.05Å; A65-I68 HydrophobicContact CB-CG1 3.79Å
66	K	69.6	Low	64.1	Low	186 Å²	186	87 Å²	87	81%	0.809	43%	0.425	S	S	*	.	S	Bend	trans	-56.1	-28	-179.6	-71.9	-174	176	-178.6	0	114
67	H	65.9	Low	63.1	Low	175 Å²	175	89.6 Å²	89.6	81%	0.81	43%	0.433	S	S	*	.			trans	-137.8	103.3	-177.9	-55.2	105.8	0	0	0	110.4	A65	A65-H67 PolarHBondContact O-N 3.1Å; A65-H67 VanDerWaalsContact O-N 3.08Å
68	I	62.6	Low	61.9	Low	44 Å²	44	88.1 Å²	88.1	23%	0.226	43%	0.434	C	S	.	.			trans	-113.2	124.6	167	-58.9	-175.9	0	0	0	107.6	L59 F63 A65 V70	L59-I68 HydrophobicContact CB-CD1 3.74Å; L59-I68 HydrophobicContact CB-CG2 4.15Å; L59-I68 HydrophobicContact CD1-CG2 4.29Å; L59-I68 WeakPolarHBondContact O-CD1 3.32Å; F63-I68 HydrophobicContact CB-CD1 4.15Å; A65-I68 HydrophobicContact CB-CD1 4.05Å; A65-I68 HydrophobicContact CB-CG1 3.79Å; I68-V70 HydrophobicContact CG2-CG2 4.28Å
69	K	62.9	Low	61	Low	169 Å²	169	88.1 Å²	88.1	74%	0.735	43%	0.434	S	S	*	.			trans	-105.3	96.9	177.3	-176.5	-176.6	174.5	-174	0	109.2	T71	K69-T71 PolarHBondContact O-N 2.9Å
70	V	55.2	Low	60.3	Low	17 Å²	17	87.5 Å²	87.5	10%	0.103	43%	0.429	C	S	.	.			trans	-74.8	123.3	170.7	-179	0	0	0	0	109.3	K52 L55 T56 L59 I68 I72	K52-V70 WeakPolarHBondContact CE-O 3.42Å; K52-V70 HydrophobicContact CG-CB 4.33Å; K52-V70 HydrophobicContact CG-CG1 4.21Å; K52-V70 PolarHBondContact NZ-O 2.83Å; L55-V70 HydrophobicContact CD2-CG1 4.09Å; T56-V70 HydrophobicContact CG2-CG2 4.47Å; T56-V70 VanDerWaalsContact OG1-CG2 3.27Å; T56-V70 WeakPolarHBondContact OG1-CG2 3.44Å; L59-V70 HydrophobicContact CD1-CG2 3.69Å; I68-V70 HydrophobicContact CG2-CG2 4.28Å; V70-I72 HydrophobicContact CG1-CD1 4.27Å; V70-I72 HydrophobicContact CG1-CG1 3.87Å
71	T	50.1	Low	59.4	Low	69 Å²	69	87 Å²	87	42%	0.423	43%	0.426	S	S	.	.			trans	-112.3	123.1	172.2	-57.1	0	0	0	0	107.6	K69	K69-T71 PolarHBondContact O-N 2.9Å
72	I	52.4	Low	58.5	Low	58 Å²	58	80.3 Å²	80.3	30%	0.297	40%	0.397	S	S	.	.			trans	-121.3	115.8	173.8	-46.9	-175.1	0	0	0	106.1	L48 K52 V70	L48-I72 HydrophobicContact CD1-CG2 3.94Å; L48-I72 HydrophobicContact CD2-CB 4.14Å; L48-I72 HydrophobicContact CD2-CG2 3.9Å; L48-I72 HydrophobicContact CG-CB 4.41Å; L48-I72 HydrophobicContact CG-CG2 4.05Å; K52-I72 HydrophobicContact CB-CD1 3.8Å; K52-I72 HydrophobicContact CB-CG1 4.45Å; K52-I72 HydrophobicContact CG-CD1 4.39Å; V70-I72 HydrophobicContact CG1-CD1 4.27Å; V70-I72 HydrophobicContact CG1-CG1 3.87Å
73	T	49	Very low	57.5	Low	30 Å²	30	75.4 Å²	75.4	18%	0.184	38%	0.377	C	S	.	.			trans	-105.8	107.4	-179.1	-55.2	0	0	0	0	108.1	Y75	T73-Y75 HydrophobicContact CG2-CE1 3.97Å; T73-Y75 HydrophobicContact CG2-CE2 4.25Å
74	P	51.2	Low	56.6	Low	28 Å²	28	70 Å²	70	18%	0.182	36%	0.358	C	S	.	.			trans	-72.7	130	173.8	30.1	-32.8	0	0	0	109.6	L48 Y76	L48-P74 HydrophobicContact CD2-CG 4.35Å; P74-Y76 HydrophobicContact CB-CE2 3.84Å; P74-Y76 HydrophobicContact CG-CE2 4.07Å
75	Y	47.2	Very low	55.5	Low	108 Å²	108	65.3 Å²	65.3	42%	0.424	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.9	173.3	-65.7	-71.8	0	0	0	109.5	T73 L121 V130	T73-Y75 HydrophobicContact CG2-CE1 3.97Å; T73-Y75 HydrophobicContact CG2-CE2 4.25Å; Y75-L121 HydrophobicContact CD1-CD2 3.6Å; Y75-L121 HydrophobicContact CE1-CD2 3.46Å; Y75-L121 VanDerWaalsContact CE1-CD2 3.46Å; Y75-L121 HydrophobicContact CE1-CG 4.21Å; Y75-L121 HydrophobicContact CE2-CD2 4.47Å; Y75-L121 HydrophobicContact CG-CD2 4.18Å; Y75-V130 HydrophobicContact CD1-CB 4.34Å; Y75-V130 HydrophobicContact CE1-CB 4.22Å
76	Y	52.7	Low	54.9	Low	38 Å²	38	63.7 Å²	63.7	15%	0.149	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.2	175.4	-58.1	-86.8	0	0	0	108.3	F37 P74 M129	F37-Y76 HydrophobicContact CZ-CD1 4.02Å; P74-Y76 HydrophobicContact CB-CE2 3.84Å; P74-Y76 HydrophobicContact CG-CE2 4.07Å; Y76-M129 HydrophobicContact CE2-CG 4.26Å; Y76-M129 HydrophobicContact CE2-SD 4.43Å
77	R	49.5	Very low	54.2	Low	73 Å²	73	55.5 Å²	55.5	28%	0.275	28%	0.28	S	S	.	.			trans	-128	131	175.3	-178.8	-177	-77.5	179.9	4.4	108.8	I79 S116 I136	R77-I79 HydrophobicContact CG-CG1 4.49Å; R77-S116 PolarHBondContact NH2-O 3.29Å; R77-I136 VanDerWaalsContact NH2-CD1 3.35Å
78	S	51	Low	53.9	Low	65 Å²	65	52.6 Å²	52.6	46%	0.455	27%	0.265	S	S	.	.			trans	-72.3	122.7	165	44.2	0	0	0	0	109.2
79	I	52.9	Low	53.5	Low	62 Å²	62	52.8 Å²	52.8	32%	0.318	27%	0.266	S	S	.	.			trans	-108.6	111.4	173.1	-56.5	178.8	0	0	0	107.1	R77 Y81 P112	R77-I79 HydrophobicContact CG-CG1 4.49Å; I79-Y81 HydrophobicContact CG2-CD1 4.11Å; I79-Y81 WeakPolarHBondContact O-CD1 3.2Å; I79-P112 HydrophobicContact CG2-CB 4.45Å; I79-P112 HydrophobicContact CG2-CG 4.5Å
80	H	51.6	Low	53.3	Low	32 Å²	32	48 Å²	48	15%	0.148	25%	0.248	C	C	.	.			trans	-85.9	124.9	168.8	-63.8	-104.4	0	0	0	108	L89	H80-L89 HydrophobicContact CB-CD2 4.32Å
81	Y	57.4	Low	53.3	Low	64 Å²	64	51.4 Å²	51.4	25%	0.251	27%	0.271	S	S	.	.			trans	-144.8	151.5	175	61.2	-78.5	0	0	0	108.9	I79 M83	I79-Y81 HydrophobicContact CG2-CD1 4.11Å; I79-Y81 WeakPolarHBondContact O-CD1 3.2Å; Y81-M83 HydrophobicContact CD2-CG 4.11Å; Y81-M83 HydrophobicContact CE2-CE 3.49Å; Y81-M83 VanDerWaalsContact CE2-CE 3.49Å; Y81-M83 HydrophobicContact CE2-CG 3.73Å; Y81-M83 HydrophobicContact CE2-SD 4.45Å; Y81-M83 WeakPolarHBondContact OH-CE 3.46Å
82	C	56.9	Low	53.6	Low	21 Å²	21	51.8 Å²	51.8	14%	0.142	28%	0.281	C	S	.	.			trans	-91.7	119	179.3	-59.3	0	0	0	0	109.3	G87 C96	C82-G87 VanDerWaalsContact CB-CA 3.49Å; C82-G87 VanDerWaalsContact CB-O 3.23Å; C82-G87 WeakPolarHBondContact CB-O 3.3Å; C82-C96 HydrophobicContact CB-CB 3.83Å; C82-C96 WeakPolarHBondContact CB-SG 3.36Å; C82-C96 WeakPolarHBondContact SG-CA 3.41Å; C82-C96 WeakPolarHBondContact SG-CB 3.35Å; C82-C96 CovalentContact SG-SG 2.03Å; C82-C96 PolarHBondContact SG-SG 3.48Å
83	M	52.4	Low	53.9	Low	61 Å²	61	55.1 Å²	55.1	30%	0.3	30%	0.295	S	S	.	.			trans	-86.5	136.4	167.9	-62.7	179.9	-162	0	0	109.1	Y20 I29 Y81	Y20-M83 HydrophobicContact CD1-CE 3.67Å; Y20-M83 HydrophobicContact CD1-SD 3.77Å; Y20-M83 HydrophobicContact CE1-CE 4.43Å; Y20-M83 HydrophobicContact CG-SD 4.29Å; I29-M83 HydrophobicContact CD1-CE 4.15Å; I29-M83 HydrophobicContact CD1-SD 4.18Å; Y81-M83 HydrophobicContact CD2-CG 4.11Å; Y81-M83 HydrophobicContact CE2-CE 3.49Å; Y81-M83 VanDerWaalsContact CE2-CE 3.49Å; Y81-M83 HydrophobicContact CE2-CG 3.73Å; Y81-M83 HydrophobicContact CE2-SD 4.45Å; Y81-M83 WeakPolarHBondContact OH-CE 3.46Å
84	G	53.6	Low	54.3	Low	17 Å²	17	56.1 Å²	56.1	18%	0.175	30%	0.303	C	S	.	.	S	Bend	trans	100.9	-153.8	171.4	0	0	0	0	0	114.5	S86	G84-S86 PolarHBondContact O-N 2.87Å; G84-S86 VanDerWaalsContact O-N 3.1Å
85	P	53.9	Low	54.7	Low	14 Å²	14	60.6 Å²	60.6	9%	0.091	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	104.1	-153.5	-27	43.6	0	0	0	114.2	G87 Y105 G163 Q164 S165	P85-G87 PolarHBondContact O-N 3Å; P85-Y105 VanDerWaalsContact CB-O 3.28Å; P85-Y105 WeakPolarHBondContact CB-O 3.33Å; P85-Y105 WeakPolarHBondContact CG-O 3.25Å; P85-G163 VanDerWaalsContact CD-O 3.29Å; P85-G163 WeakPolarHBondContact CD-O 3.24Å; P85-G163 WeakPolarHBondContact CG-O 3.5Å; P85-Q164 WeakPolarHBondContact CB-O 3.21Å; P85-Q164 WeakPolarHBondContact CG-O 3.11Å; P85-S165 VanDerWaalsContact CG-N 3.31Å
86	S	55.5	Low	55.6	Low	6 Å²	6	56.3 Å²	56.3	4%	0.042	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	37	-177.1	-63.5	0	0	0	0	115.6	G84 K88 D97 C99 Y105 I148 C150	G84-S86 PolarHBondContact O-N 2.87Å; G84-S86 VanDerWaalsContact O-N 3.1Å; S86-K88 VanDerWaalsContact C-N 3.31Å; S86-K88 PolarHBondContact O-N 3.02Å; S86-D97 CarbonylContact C-O 3.55Å; S86-C99 WeakPolarHBondContact CB-SG 3.21Å; S86-C99 PolarHBondContact OG-SG 3.44Å; S86-C99 VanDerWaalsContact OG-SG 3.39Å; S86-Y105 WeakPolarHBondContact OG-CB 3.32Å; S86-Y105 WeakPolarHBondContact OG-CD2 3.47Å; S86-I148 WeakPolarHBondContact OG-CG2 3.43Å; S86-C150 WeakPolarHBondContact CB-SG 3.28Å; S86-C150 PolarHBondContact OG-SG 3.46Å; S86-C150 VanDerWaalsContact OG-SG 3.38Å
87	G	53.8	Low	56.3	Low	15 Å²	15	58.4 Å²	58.4	16%	0.155	32%	0.321	C	S	.	.			trans	-60.2	85	170.3	0	0	0	0	0	112.8	C82 P85 L89 D97	C82-G87 VanDerWaalsContact CB-CA 3.49Å; C82-G87 VanDerWaalsContact CB-O 3.23Å; C82-G87 WeakPolarHBondContact CB-O 3.3Å; P85-G87 PolarHBondContact O-N 3Å; G87-L89 PolarHBondContact O-N 3.36Å; G87-D97 WeakPolarHBondContact CA-O 3.39Å
88	K	59.2	Low	57.4	Low	114 Å²	114	57.1 Å²	57.1	50%	0.496	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.7	164.6	-174.1	167.7	-175.6	161.4	0	106.8	S86 L90 D97 D146	S86-K88 VanDerWaalsContact C-N 3.31Å; S86-K88 PolarHBondContact O-N 3.02Å; K88-L90 PolarHBondContact O-N 2.85Å; K88-L90 VanDerWaalsContact O-N 3.14Å; K88-D97 HydrophobicContact CB-CB 4.09Å; K88-D97 PolarHBondContact N-O 3.25Å; K88-D97 VanDerWaalsContact O-CB 3.29Å; K88-D97 WeakPolarHBondContact O-CB 3.12Å; K88-D97 PolarHBondContact O-N 3.01Å; K88-D146 IonicContact NZ-OD1 2.93Å; K88-D146 PolarHBondContact NZ-OD1 3.1Å
89	L	55.4	Low	58.5	Low	48 Å²	48	54 Å²	54	25%	0.251	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	117.1	176.7	-169.6	77.3	0	0	0	108.9	H80 G87 P91 S94	H80-L89 HydrophobicContact CB-CD2 4.32Å; G87-L89 PolarHBondContact O-N 3.36Å; L89-P91 VanDerWaalsContact O-CD 3.27Å; L89-P91 WeakPolarHBondContact O-CD 3.38Å; L89-S94 WeakPolarHBondContact CD1-O 3.39Å
90	L	58.5	Low	59.4	Low	67 Å²	67	54.4 Å²	54.4	35%	0.351	31%	0.306	S	S	.	.			trans	-71.1	115.4	177.3	-74	167.1	0	0	0	108.9	K88 A92 H93 S94 E95 D97	K88-L90 PolarHBondContact O-N 2.85Å; K88-L90 VanDerWaalsContact O-N 3.14Å; L90-A92 PolarHBondContact O-N 2.98Å; L90-H93 PolarHBondContact O-N 3.48Å; L90-S94 PolarHBondContact O-N 3.05Å; L90-E95 PolarHBondContact N-O 3.24Å; L90-D97 HydrophobicContact CD1-CB 4.36Å; L90-D97 HydrophobicContact CD2-CB 4.42Å; L90-D97 HydrophobicContact CG-CB 4.15Å
91	P	54.6	Low	60.4	Low	89 Å²	89	55.3 Å²	55.3	58%	0.578	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-4.8	-170.4	-23.9	34.5	0	0	0	115.9	L89 R137	L89-P91 VanDerWaalsContact O-CD 3.27Å; L89-P91 WeakPolarHBondContact O-CD 3.38Å; P91-R137 PolarHBondContact O-NE 2.88Å; P91-R137 VanDerWaalsContact O-NE 3.11Å; P91-R137 PolarHBondContact O-NH2 3.42Å
92	A	57.8	Low	61	Low	77 Å²	77	53.5 Å²	53.5	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-24	-176.3	0	0	0	0	0	114.1	L90	L90-A92 PolarHBondContact O-N 2.98Å
93	H	57.7	Low	61.9	Low	129 Å²	129	53.3 Å²	53.3	60%	0.597	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	-7.2	-169.7	-61.5	88.7	0	0	0	114.3	L90 E95	L90-H93 PolarHBondContact O-N 3.48Å; H93-E95 HydrophobicContact CB-CB 4.14Å; H93-E95 HydrophobicContact CB-CG 3.95Å; H93-E95 PolarHBondContact O-N 3.27Å; H93-E95 VanDerWaalsContact O-N 3.14Å
94	S	57.4	Low	62.9	Low	51 Å²	51	53.1 Å²	53.1	36%	0.357	31%	0.311	S	S	.	.	S	Bend	trans	58.7	15.3	-168.1	-58.6	0	0	0	0	114.1	L89 L90	L89-S94 WeakPolarHBondContact CD1-O 3.39Å; L90-S94 PolarHBondContact O-N 3.05Å
95	E	59.1	Low	63.8	Low	122 Å²	122	53.3 Å²	53.3	57%	0.57	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-90.8	154.6	176.1	-68.9	178.5	170.2	0	0	111	L90 H93	L90-E95 PolarHBondContact N-O 3.24Å; H93-E95 HydrophobicContact CB-CB 4.14Å; H93-E95 HydrophobicContact CB-CG 3.95Å; H93-E95 PolarHBondContact O-N 3.27Å; H93-E95 VanDerWaalsContact O-N 3.14Å
96	C	66.9	Low	64.5	Low	18 Å²	18	55 Å²	55	12%	0.122	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.1	176.4	-60.8	0	0	0	0	109.7	C82 L98	C82-C96 HydrophobicContact CB-CB 3.83Å; C82-C96 WeakPolarHBondContact CB-SG 3.36Å; C82-C96 WeakPolarHBondContact SG-CA 3.41Å; C82-C96 WeakPolarHBondContact SG-CB 3.35Å; C82-C96 CovalentContact SG-SG 2.03Å; C82-C96 PolarHBondContact SG-SG 3.48Å; C96-L98 HydrophobicContact CB-CD2 4.08Å; C96-L98 PolarHBondContact O-N 3.15Å
97	D	67.6	Low	64.9	Low	81 Å²	81	58.6 Å²	58.6	43%	0.433	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	126.9	160.4	-169.5	10	0	0	0	107.9	S86 G87 K88 L90	S86-D97 CarbonylContact C-O 3.55Å; G87-D97 WeakPolarHBondContact CA-O 3.39Å; K88-D97 HydrophobicContact CB-CB 4.09Å; K88-D97 PolarHBondContact N-O 3.25Å; K88-D97 VanDerWaalsContact O-CB 3.29Å; K88-D97 WeakPolarHBondContact O-CB 3.12Å; K88-D97 PolarHBondContact O-N 3.01Å; L90-D97 HydrophobicContact CD1-CB 4.36Å; L90-D97 HydrophobicContact CD2-CB 4.42Å; L90-D97 HydrophobicContact CG-CB 4.15Å
98	L	72.2	Confident	64.9	Low	47 Å²	47	65.7 Å²	65.7	25%	0.246	37%	0.365	C	S	.	.			trans	-117.8	145.5	-172.6	-66.6	-179.9	0	0	0	110.4	C96 S100 F162	C96-L98 HydrophobicContact CB-CD2 4.08Å; C96-L98 PolarHBondContact O-N 3.15Å; L98-S100 PolarHBondContact O-N 3.24Å; L98-F162 HydrophobicContact CB-CB 4.05Å; L98-F162 HydrophobicContact CD1-CB 4.03Å
99	C	73.5	Confident	64.6	Low	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-52.4	127.8	171.2	-72.8	0	0	0	0	111.6	S86 S103 C150 F162 G163	S86-C99 WeakPolarHBondContact CB-SG 3.21Å; S86-C99 PolarHBondContact OG-SG 3.44Å; S86-C99 VanDerWaalsContact OG-SG 3.39Å; C99-S103 WeakPolarHBondContact CB-OG 3.38Å; C99-C150 WeakPolarHBondContact CA-SG 3.23Å; C99-C150 HydrophobicContact CB-CB 3.94Å; C99-C150 WeakPolarHBondContact CB-SG 3.23Å; C99-C150 WeakPolarHBondContact SG-CB 3.47Å; C99-C150 CovalentContact SG-SG 2.05Å; C99-C150 PolarHBondContact SG-SG 3.42Å; C99-F162 CarbonylContact O-C 3.47Å; C99-F162 VanDerWaalsContact O-CA 3.3Å; C99-F162 WeakPolarHBondContact O-CA 3.22Å; C99-G163 PolarHBondContact O-N 3.29Å
100	S	72.1	Confident	64.4	Low	70 Å²	70	65.5 Å²	65.5	49%	0.49	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-65.7	156.4	175.4	-56.1	0	0	0	0	111.5	L98 S103	L98-S100 PolarHBondContact O-N 3.24Å; S100-S103 PolarHBondContact N-OG 3.1Å; S100-S103 PolarHBondContact O-N 3.33Å; S100-S103 PolarHBondContact O-OG 3.37Å
101	P	73.6	Confident	63.8	Low	50 Å²	50	67.9 Å²	67.9	33%	0.325	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	145.8	171	-29.6	36.4	0	0	0	112.9	S103 S159 F162	P101-S103 PolarHBondContact O-N 3.01Å; P101-S159 CarbonylContact C-O 3.46Å; P101-S159 VanDerWaalsContact CA-O 3.22Å; P101-S159 WeakPolarHBondContact CA-O 3.42Å; P101-S159 WeakPolarHBondContact CB-O 3.41Å; P101-F162 HydrophobicContact CG-CD2 4.33Å; P101-F162 HydrophobicContact CG-CE1 4.45Å; P101-F162 HydrophobicContact CG-CE2 4.05Å; P101-F162 HydrophobicContact CG-CZ 4.11Å
102	G	70.3	Confident	63.6	Low	26 Å²	26	65.9 Å²	65.9	27%	0.268	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-4.7	-171.2	0	0	0	0	0	115.1	C153 S159	G102-C153 PolarHBondContact O-N 3.48Å; G102-C153 PolarHBondContact O-SG 3.22Å; G102-C153 VanDerWaalsContact O-SG 3.39Å; G102-S159 PolarHBondContact N-O 3.46Å
103	S	74.8	Confident	63	Low	18 Å²	18	65.5 Å²	65.5	13%	0.126	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	160.5	172.7	75.6	0	0	0	0	112.2	C99 S100 P101 L151 S159	C99-S103 WeakPolarHBondContact CB-OG 3.38Å; S100-S103 PolarHBondContact N-OG 3.1Å; S100-S103 PolarHBondContact O-N 3.33Å; S100-S103 PolarHBondContact O-OG 3.37Å; P101-S103 PolarHBondContact O-N 3.01Å; S103-L151 CarbonylContact C-O 3.48Å; S103-L151 VanDerWaalsContact CA-O 3.25Å; S103-L151 WeakPolarHBondContact CA-O 2.99Å; S103-L151 WeakPolarHBondContact CB-O 3.21Å; S103-S159 WeakPolarHBondContact O-CB 3.06Å; S103-S159 PolarHBondContact O-OG 3.36Å; S103-S159 VanDerWaalsContact O-OG 3.04Å
104	Y	74.4	Confident	62.2	Low	56 Å²	56	64.9 Å²	64.9	22%	0.22	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	166.9	177.9	80.8	-71.3	0	0	0	110.6	L151 P152 Q164 C167	Y104-L151 HydrophobicContact CD1-CB 4.12Å; Y104-L151 WeakPolarHBondContact CD1-O 3.5Å; Y104-L151 HydrophobicContact CE1-CB 3.76Å; Y104-L151 PolarHBondContact N-O 2.96Å; Y104-L151 PolarHBondContact O-N 2.68Å; Y104-P152 WeakPolarHBondContact CE1-O 3.45Å; Y104-Q164 WeakPolarHBondContact CA-O 3.36Å; Y104-Q164 WeakPolarHBondContact CB-O 3.36Å; Y104-C167 WeakPolarHBondContact CD1-SG 3.02Å
105	Y	72.5	Confident	61.6	Low	22 Å²	22	65.9 Å²	65.9	9%	0.086	37%	0.373	C	S	.	.			trans	-145.3	132.2	166	-173.6	-93.2	0	0	0	109.8	P85 S86 S107 R108 I148 Q164 S165	P85-Y105 VanDerWaalsContact CB-O 3.28Å; P85-Y105 WeakPolarHBondContact CB-O 3.33Å; P85-Y105 WeakPolarHBondContact CG-O 3.25Å; S86-Y105 WeakPolarHBondContact OG-CB 3.32Å; S86-Y105 WeakPolarHBondContact OG-CD2 3.47Å; Y105-S107 PolarHBondContact O-N 3.42Å; Y105-R108 HydrophobicContact CE1-CG 4.35Å; Y105-I148 HydrophobicContact CE2-CG2 4.42Å; Y105-Q164 PolarHBondContact N-O 2.98Å; Y105-S165 WeakPolarHBondContact O-CA 3.46Å
106	P	67.3	Low	60.8	Low	50 Å²	50	63.5 Å²	63.5	33%	0.325	37%	0.37	S	S	.	.			trans	-59.7	129.6	-179.2	25.5	-34.2	0	0	0	109.6	R108	P106-R108 PolarHBondContact O-N 3.09Å
107	S	64.2	Low	59.7	Low	81 Å²	81	69.7 Å²	69.7	57%	0.566	40%	0.401	S	S	*	.			trans	-59.8	104.7	178	54.3	0	0	0	0	110.2	Y105	Y105-S107 PolarHBondContact O-N 3.42Å
108	R	55	Low	58.5	Low	164 Å²	164	68.6 Å²	68.6	62%	0.619	40%	0.395	S	S	*	.			trans	-95.2	136.8	171.5	-67.6	-174	-179.5	-167.1	1.2	109.2	Y105 P106 V110	Y105-R108 HydrophobicContact CE1-CG 4.35Å; P106-R108 PolarHBondContact O-N 3.09Å; R108-V110 PolarHBondContact O-N 3.2Å
109	I	52.8	Low	57.1	Low	113 Å²	113	75.9 Å²	75.9	58%	0.579	43%	0.428	S	S	*	.			trans	-74.2	108.6	158.9	-70.5	157.9	0	0	0	105.5	Y20	Y20-I109 HydrophobicContact CD2-CD1 3.79Å; Y20-I109 HydrophobicContact CD2-CG1 3.86Å; Y20-I109 HydrophobicContact CE1-CG2 4.37Å; Y20-I109 HydrophobicContact CE2-CB 4.28Å; Y20-I109 HydrophobicContact CE2-CD1 3.38Å; Y20-I109 HydrophobicContact CE2-CG1 3.48Å; Y20-I109 VanDerWaalsContact CE2-CG1 3.48Å; Y20-I109 HydrophobicContact CE2-CG2 3.8Å; Y20-I109 VanDerWaalsContact CZ-CG2 3.5Å; Y20-I109 WeakPolarHBondContact OH-CG2 3.05Å
110	V	49.4	Very low	55.6	Low	45 Å²	45	84.5 Å²	84.5	27%	0.273	47%	0.468	S	S	.	.			trans	-93.3	108.6	167.5	165.6	0	0	0	0	106.1	R108 P112 Y145	R108-V110 PolarHBondContact O-N 3.2Å; V110-P112 VanDerWaalsContact O-CD 3.3Å; V110-P112 WeakPolarHBondContact O-CD 3.47Å; V110-Y145 HydrophobicContact CB-CE1 4.42Å; V110-Y145 HydrophobicContact CG1-CE1 3.73Å; V110-Y145 WeakPolarHBondContact CG1-OH 3.13Å; V110-Y145 HydrophobicContact CG2-CE1 3.79Å
111	D	47.3	Very low	54.3	Low	117 Å²	117	84.3 Å²	84.3	63%	0.626	46%	0.461	S	S	*	.			trans	-67.8	115.8	163.3	-76.9	-28.2	0	0	0	106.8
112	P	49.5	Very low	52.8	Low	47 Å²	47	89 Å²	89	31%	0.305	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-62.3	141.6	176	27	-33.3	0	0	0	108.6	I79 V110	I79-P112 HydrophobicContact CG2-CB 4.45Å; I79-P112 HydrophobicContact CG2-CG 4.5Å; V110-P112 VanDerWaalsContact O-CD 3.3Å; V110-P112 WeakPolarHBondContact O-CD 3.47Å
113	P	44.8	Very low	51.4	Low	68 Å²	68	92.8 Å²	92.8	44%	0.442	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-55.5	147.2	172.4	25.3	-33.7	0	0	0	109.5	L140	P113-L140 HydrophobicContact CG-CD1 3.97Å; P113-L140 HydrophobicContact CG-CG 4.45Å
114	P	42.5	Very low	49.9	Very low	117 Å²	117	93.4 Å²	93.4	76%	0.76	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-54.2	141.2	177.4	23.8	-33.6	0	0	0	109.6	S116	P114-S116 PolarHBondContact O-N 3.48Å
115	P	44.3	Very low	48.5	Very low	71 Å²	71	97.3 Å²	97.3	46%	0.461	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-58.3	133.1	-175.5	23.8	-33.7	0	0	0	110.3	I117	P115-I117 PolarHBondContact O-N 2.98Å
116	S	43.1	Very low	47.2	Very low	72 Å²	72	99.6 Å²	99.6	50%	0.503	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-57.8	127	163.3	55.4	0	0	0	0	108.4	R77 P114 D118	R77-S116 PolarHBondContact NH2-O 3.29Å; P114-S116 PolarHBondContact O-N 3.48Å; S116-D118 PolarHBondContact O-N 3.49Å
117	I	43.5	Very low	46	Very low	148 Å²	148	102.4 Å²	102.4	76%	0.759	57%	0.565	S	S	*	*			trans	-73.5	110	163.9	-56.5	171.9	0	0	0	104.7	P115 E119	P115-I117 PolarHBondContact O-N 2.98Å; I117-E119 PolarHBondContact O-N 2.87Å
118	D	42.3	Very low	44.7	Very low	58 Å²	58	107.9 Å²	107.9	31%	0.31	57%	0.573	S	S	.	*			trans	-69.5	124.9	168.1	-59.9	-23.6	0	0	0	106.9	S116 E120 L121 I136	S116-D118 PolarHBondContact O-N 3.49Å; D118-E120 PolarHBondContact O-N 3.4Å; D118-L121 WeakPolarHBondContact O-CB 3.41Å; D118-L121 PolarHBondContact O-N 3.33Å; D118-I136 VanDerWaalsContact OD2-CD1 3.29Å; D118-I136 WeakPolarHBondContact OD2-CD1 3.4Å; D118-I136 WeakPolarHBondContact OD2-CG1 3.39Å; D118-I136 WeakPolarHBondContact OD2-CG2 3.19Å
119	E	42.8	Very low	43.9	Very low	201 Å²	201	103.9 Å²	103.9	94%	0.939	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-15.3	-177.5	-64.8	178.7	129.2	0	0	112.7	I117 L121	I117-E119 PolarHBondContact O-N 2.87Å; E119-L121 PolarHBondContact O-N 2.82Å
120	E	41.2	Very low	43.4	Very low	181 Å²	181	100.6 Å²	100.6	85%	0.846	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-5.6	171.5	-74.2	-170.3	135.3	0	0	114.5	D118 L122	D118-E120 PolarHBondContact O-N 3.4Å; E120-L122 PolarHBondContact O-N 3.43Å
121	L	45.7	Very low	43	Very low	66 Å²	66	104.3 Å²	104.3	35%	0.346	56%	0.561	S	S	.	*			trans	-75.2	69.5	172.4	-149.7	75.2	0	0	0	110.7	Y75 D118 E119	Y75-L121 HydrophobicContact CD1-CD2 3.6Å; Y75-L121 HydrophobicContact CE1-CD2 3.46Å; Y75-L121 VanDerWaalsContact CE1-CD2 3.46Å; Y75-L121 HydrophobicContact CE1-CG 4.21Å; Y75-L121 HydrophobicContact CE2-CD2 4.47Å; Y75-L121 HydrophobicContact CG-CD2 4.18Å; D118-L121 WeakPolarHBondContact O-CB 3.41Å; D118-L121 PolarHBondContact O-N 3.33Å; E119-L121 PolarHBondContact O-N 2.82Å
122	L	41	Very low	42.8	Very low	148 Å²	148	100 Å²	100	78%	0.775	54%	0.541	S	S	*	.			trans	-42.1	125.8	175.2	-95.7	145.2	0	0	0	110.1	E120 S124	E120-L122 PolarHBondContact O-N 3.43Å; L122-S124 PolarHBondContact O-N 2.88Å
123	P	41	Very low	42.3	Very low	105 Å²	105	104.6 Å²	104.6	68%	0.682	56%	0.563	S	S	*	*			trans	-61.4	109.7	-174.8	23.5	-33.5	0	0	0	109.9	T125	P123-T125 PolarHBondContact O-N 3.3Å; P123-T125 VanDerWaalsContact O-N 3.08Å
124	S	43.2	Very low	41.9	Very low	32 Å²	32	103.4 Å²	103.4	22%	0.224	56%	0.563	C	S	.	*			trans	-55.9	119	177.1	176.8	0	0	0	0	109.4	L122 T126	L122-S124 PolarHBondContact O-N 2.88Å; S124-T126 PolarHBondContact O-N 3.43Å; S124-T126 VanDerWaalsContact O-N 3.08Å; S124-T126 PolarHBondContact OG-N 3.26Å; S124-T126 PolarHBondContact OG-O 2.74Å
125	T	46	Very low	41.6	Very low	138 Å²	138	106.2 Å²	106.2	85%	0.847	56%	0.56	S	S	*	*	S	Bend	trans	-69.1	-0.7	175.6	47.3	0	0	0	0	112.9	P123	P123-T125 PolarHBondContact O-N 3.3Å; P123-T125 VanDerWaalsContact O-N 3.08Å
126	T	43.4	Very low	41.2	Very low	69 Å²	69	105 Å²	105	42%	0.423	55%	0.549	S	S	.	.	S	Bend	trans	-109.4	135.7	-178.1	-43.8	0	0	0	0	110.2	S124 R128	S124-T126 PolarHBondContact O-N 3.43Å; S124-T126 VanDerWaalsContact O-N 3.08Å; S124-T126 PolarHBondContact OG-N 3.26Å; S124-T126 PolarHBondContact OG-O 2.74Å; T126-R128 HydrophobicContact CG2-CB 3.84Å; T126-R128 HydrophobicContact CG2-CG 3.77Å; T126-R128 PolarHBondContact O-N 3.15Å
127	N	43	Very low	40.9	Very low	109 Å²	109	109.7 Å²	109.7	58%	0.583	56%	0.556	S	S	*	*	S	Bend	trans	-67.7	28.3	169.2	-68.9	-17.9	0	0	0	113
128	R	37.2	Very low	40.6	Very low	196 Å²	196	105.5 Å²	105.5	74%	0.74	54%	0.539	S	S	*	.	S	Bend	trans	-98.1	140.6	178.4	-84.8	-177.4	161	-179.1	-7.4	109.1	T126 V130	T126-R128 HydrophobicContact CG2-CB 3.84Å; T126-R128 HydrophobicContact CG2-CG 3.77Å; T126-R128 PolarHBondContact O-N 3.15Å; R128-V130 PolarHBondContact O-N 2.92Å
129	M	38.9	Very low	40.1	Very low	80 Å²	80	113.9 Å²	113.9	39%	0.394	57%	0.567	S	S	.	*			trans	-55.1	125.9	171.9	-63.5	168.7	-179	0	0	109.1	T41 N45 Y76 F131	T41-M129 HydrophobicContact CG2-CE 4.06Å; N45-M129 WeakPolarHBondContact ND2-CE 3.35Å; Y76-M129 HydrophobicContact CE2-CG 4.26Å; Y76-M129 HydrophobicContact CE2-SD 4.43Å; M129-F131 HydrophobicContact CB-CE2 4.16Å
130	V	42.1	Very low	40	Very low	45 Å²	45	107.9 Å²	107.9	27%	0.273	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	102.6	168.7	-178.1	0	0	0	0	106.3	Y75 R128 A132	Y75-V130 HydrophobicContact CD1-CB 4.34Å; Y75-V130 HydrophobicContact CE1-CB 4.22Å; R128-V130 PolarHBondContact O-N 2.92Å; V130-A132 PolarHBondContact O-N 2.69Å
131	F	40.3	Very low	39.7	Very low	122 Å²	122	104.1 Å²	104.1	54%	0.535	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	118.8	160.1	-66.8	-82	0	0	0	106.7	M129 D133	M129-F131 HydrophobicContact CB-CE2 4.16Å; F131-D133 VanDerWaalsContact C-N 3.26Å; F131-D133 PolarHBondContact O-N 2.78Å
132	A	43.9	Very low	39.5	Very low	26 Å²	26	105.2 Å²	105.2	22%	0.215	54%	0.544	C	S	.	.			trans	-76.6	85.9	168.3	0	0	0	0	0	107.8	V130 G134 I136	V130-A132 PolarHBondContact O-N 2.69Å; A132-G134 PolarHBondContact O-N 3.38Å; A132-G134 VanDerWaalsContact O-N 3.14Å; A132-I136 HydrophobicContact CB-CD1 4.5Å
133	D	37.5	Very low	39.5	Very low	145 Å²	145	105.1 Å²	105.1	78%	0.775	54%	0.544	S	S	*	.			trans	-63.4	-9.7	168.9	-76.5	-9.4	0	0	0	112	F131 Y135	F131-D133 VanDerWaalsContact C-N 3.26Å; F131-D133 PolarHBondContact O-N 2.78Å; D133-Y135 PolarHBondContact O-N 2.84Å
134	G	37.9	Very low	39.6	Very low	42 Å²	42	107.1 Å²	107.1	43%	0.433	55%	0.549	S	S	.	.	S	Bend	trans	-60.6	107.8	158.4	0	0	0	0	0	109.9	A132 I136	A132-G134 PolarHBondContact O-N 3.38Å; A132-G134 VanDerWaalsContact O-N 3.14Å; G134-I136 PolarHBondContact O-N 3.38Å
135	Y	35.4	Very low	39.6	Very low	177 Å²	177	109.7 Å²	109.7	69%	0.694	56%	0.555	S	S	*	*			trans	-59.1	69.7	154.8	-63.6	-89.6	0	0	0	109.3	D133 R137	D133-Y135 PolarHBondContact O-N 2.84Å; Y135-R137 PolarHBondContact O-N 3.04Å
136	I	36.5	Very low	39.7	Very low	46 Å²	46	107.9 Å²	107.9	24%	0.236	54%	0.54	C	S	.	.			trans	-67.1	93.8	171.2	-66.2	157.6	0	0	0	104	R77 D118 A132 G134 S138	R77-I136 VanDerWaalsContact NH2-CD1 3.35Å; D118-I136 VanDerWaalsContact OD2-CD1 3.29Å; D118-I136 WeakPolarHBondContact OD2-CD1 3.4Å; D118-I136 WeakPolarHBondContact OD2-CG1 3.39Å; D118-I136 WeakPolarHBondContact OD2-CG2 3.19Å; A132-I136 HydrophobicContact CB-CD1 4.5Å; G134-I136 PolarHBondContact O-N 3.38Å; I136-S138 PolarHBondContact O-N 3.48Å
137	R	36.6	Very low	40.1	Very low	169 Å²	169	111.9 Å²	111.9	64%	0.638	56%	0.558	S	S	*	*			trans	-41.4	117.9	169.7	-79.8	178.6	171.6	140.6	-1.6	105.9	P91 Y135 R139	P91-R137 PolarHBondContact O-NE 2.88Å; P91-R137 VanDerWaalsContact O-NE 3.11Å; P91-R137 PolarHBondContact O-NH2 3.42Å; Y135-R137 PolarHBondContact O-N 3.04Å; R137-R139 PolarHBondContact O-N 3.44Å
138	S	36.5	Very low	40.7	Very low	60 Å²	60	109.1 Å²	109.1	42%	0.42	54%	0.542	S	S	.	.			trans	-56.3	93.3	152.8	32.9	0	0	0	0	105.9	I136 L140	I136-S138 PolarHBondContact O-N 3.48Å; S138-L140 PolarHBondContact O-N 3.2Å
139	R	32.9	Very low	42.2	Very low	234 Å²	234	107.5 Å²	107.5	88%	0.883	54%	0.541	S	S	*	.			trans	-59.6	81.9	149.5	-82.3	-175.4	174	171.6	-0.4	104.4	R137 S141	R137-R139 PolarHBondContact O-N 3.44Å; R139-S141 PolarHBondContact O-N 3.43Å
140	L	39.5	Very low	43.9	Very low	76 Å²	76	105.7 Å²	105.7	40%	0.398	54%	0.536	S	S	.	.			trans	-57.5	94.8	154.6	-113.8	69.5	0	0	0	103.8	P113 S138 T142 Y145	P113-L140 HydrophobicContact CG-CD1 3.97Å; P113-L140 HydrophobicContact CG-CG 4.45Å; S138-L140 PolarHBondContact O-N 3.2Å; L140-T142 PolarHBondContact O-N 3.07Å; L140-Y145 HydrophobicContact CD2-CD2 4.03Å; L140-Y145 HydrophobicContact CD2-CE2 4.43Å; L140-Y145 HydrophobicContact CD2-CG 4.24Å
141	S	34.3	Very low	45.7	Very low	102 Å²	102	107.2 Å²	107.2	71%	0.713	54%	0.542	S	S	*	.			trans	-64.6	107.8	176.1	-168.6	0	0	0	0	106.2	R139 D143	R139-S141 PolarHBondContact O-N 3.43Å; S141-D143 PolarHBondContact O-N 3.47Å
142	T	41.7	Very low	47.5	Very low	89 Å²	89	106.3 Å²	106.3	55%	0.546	55%	0.548	S	S	.	.	S	Bend	trans	-5.6	111.7	148.5	49.1	0	0	0	0	113.5	L140	L140-T142 PolarHBondContact O-N 3.07Å
143	D	41.3	Very low	49.1	Very low	146 Å²	146	106.2 Å²	106.2	78%	0.781	55%	0.546	S	S	*	.	S	Bend		-173.2	-35.9	115.8	-87.1	-10.4	0	0	0	111.2	S141	S141-D143 PolarHBondContact O-N 3.47Å
144	D	43	Very low	51	Low	147 Å²	147	102.5 Å²	102.5	79%	0.786	53%	0.53	S	S	*	.	S	Bend	trans	-86.8	-11.3	-177.4	-151.7	24.1	0	0	0	114
145	Y	44.8	Very low	52.6	Low	85 Å²	85	108.6 Å²	108.6	33%	0.333	55%	0.546	S	S	.	.	S	Bend	trans	-100.9	-9.6	-175.4	-78.5	-69.9	0	0	0	115.9	V110 L140 L147 I148	V110-Y145 HydrophobicContact CB-CE1 4.42Å; V110-Y145 HydrophobicContact CG1-CE1 3.73Å; V110-Y145 WeakPolarHBondContact CG1-OH 3.13Å; V110-Y145 HydrophobicContact CG2-CE1 3.79Å; L140-Y145 HydrophobicContact CD2-CD2 4.03Å; L140-Y145 HydrophobicContact CD2-CE2 4.43Å; L140-Y145 HydrophobicContact CD2-CG 4.24Å; Y145-L147 PolarHBondContact O-N 3.3Å; Y145-I148 HydrophobicContact CD1-CD1 3.88Å; Y145-I148 HydrophobicContact CD1-CG1 4.37Å; Y145-I148 WeakPolarHBondContact O-CG1 3.29Å; Y145-I148 PolarHBondContact O-N 3.28Å
146	D	47.4	Very low	54.2	Low	101 Å²	101	101.6 Å²	101.6	54%	0.54	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-3.6	175.7	-86.2	-29.8	0	0	0	113.3	K88	K88-D146 IonicContact NZ-OD1 2.93Å; K88-D146 PolarHBondContact NZ-OD1 3.1Å
147	L	50.5	Low	56.1	Low	152 Å²	152	100.8 Å²	100.8	80%	0.796	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	14.9	169.5	-124.1	77	0	0	0	114.7	Y145 K149	Y145-L147 PolarHBondContact O-N 3.3Å; L147-K149 PolarHBondContact O-N 2.92Å
148	I	57.5	Low	58	Low	51 Å²	51	94.1 Å²	94.1	26%	0.262	49%	0.493	S	S	.	.			trans	-71.8	73.3	158.8	-61.1	-175.5	0	0	0	108.5	S86 Y105 Y145	S86-I148 WeakPolarHBondContact OG-CG2 3.43Å; Y105-I148 HydrophobicContact CE2-CG2 4.42Å; Y145-I148 HydrophobicContact CD1-CD1 3.88Å; Y145-I148 HydrophobicContact CD1-CG1 4.37Å; Y145-I148 WeakPolarHBondContact O-CG1 3.29Å; Y145-I148 PolarHBondContact O-N 3.28Å
149	K	68.5	Low	59.9	Low	163 Å²	163	91.2 Å²	91.2	71%	0.709	47%	0.473	S	S	*	.			trans	-106.8	121.5	174.9	-167.8	171.9	-174.1	175.1	0	108.8	L147 L151	L147-K149 PolarHBondContact O-N 2.92Å; K149-L151 PolarHBondContact O-N 3.13Å
150	C	74.4	Confident	61.8	Low	42 Å²	42	84.7 Å²	84.7	28%	0.284	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-55.1	130.7	174.5	-65.6	0	0	0	0	110.7	S86 C99	S86-C150 WeakPolarHBondContact CB-SG 3.28Å; S86-C150 PolarHBondContact OG-SG 3.46Å; S86-C150 VanDerWaalsContact OG-SG 3.38Å; C99-C150 WeakPolarHBondContact CA-SG 3.23Å; C99-C150 HydrophobicContact CB-CB 3.94Å; C99-C150 WeakPolarHBondContact CB-SG 3.23Å; C99-C150 WeakPolarHBondContact SG-CB 3.47Å; C99-C150 CovalentContact SG-SG 2.05Å; C99-C150 PolarHBondContact SG-SG 3.42Å
151	L	78.6	Confident	63.1	Low	77 Å²	77	86.8 Å²	86.8	40%	0.403	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	138	177.7	-60.8	177	0	0	0	108.6	S103 Y104 K149	S103-L151 CarbonylContact C-O 3.48Å; S103-L151 VanDerWaalsContact CA-O 3.25Å; S103-L151 WeakPolarHBondContact CA-O 2.99Å; S103-L151 WeakPolarHBondContact CB-O 3.21Å; Y104-L151 HydrophobicContact CD1-CB 4.12Å; Y104-L151 WeakPolarHBondContact CD1-O 3.5Å; Y104-L151 HydrophobicContact CE1-CB 3.76Å; Y104-L151 PolarHBondContact N-O 2.96Å; Y104-L151 PolarHBondContact O-N 2.68Å; K149-L151 PolarHBondContact O-N 3.13Å
152	P	79.6	Confident	65	Low	102 Å²	102	88 Å²	88	66%	0.662	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	146.1	170.6	28.6	-34.4	0	0	0	109.6	Y104	Y104-P152 WeakPolarHBondContact CE1-O 3.45Å
153	C	77.5	Confident	66.3	Low	25 Å²	25	84.2 Å²	84.2	17%	0.169	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-58.5	138.1	173.7	-74.9	0	0	0	0	111.6	G102 T157 C167	G102-C153 PolarHBondContact O-N 3.48Å; G102-C153 PolarHBondContact O-SG 3.22Å; G102-C153 VanDerWaalsContact O-SG 3.39Å; C153-T157 WeakPolarHBondContact CB-O 3.2Å; C153-C167 WeakPolarHBondContact CA-SG 3.48Å; C153-C167 HydrophobicContact CB-CB 3.76Å; C153-C167 WeakPolarHBondContact CB-SG 3.33Å; C153-C167 WeakPolarHBondContact SG-CB 3.25Å; C153-C167 CovalentContact SG-SG 2.03Å; C153-C167 PolarHBondContact SG-SG 2.89Å
154	P	76.6	Confident	67.6	Low	67 Å²	67	78.5 Å²	78.5	44%	0.435	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-64.7	157	173.8	25.2	-31.8	0	0	0	111.5	N156 T157	P154-N156 PolarHBondContact O-N 2.03Å; P154-T157 WeakPolarHBondContact CD-OG1 3Å; P154-T157 HydrophobicContact CG-CG2 4.3Å; P154-T157 WeakPolarHBondContact CG-OG1 3.44Å; P154-T157 PolarHBondContact O-N 3.01Å; P154-T157 PolarHBondContact O-OG1 3.09Å
155	H	70.9	Confident	69.1	Low	170 Å²	170	74.2 Å²	74.2	79%	0.787	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	135.5	-177.6	-73.2	-79.4	0	0	0	113.4	T157	H155-T157 PolarHBondContact O-N 3.26Å
156	N	69.3	Low	70.5	Confident	30 Å²	30	73.7 Å²	73.7	16%	0.16	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	23.5	-176.6	-43.8	-68.8	0	0	0	115	P154 C170 G201 L205	P154-N156 PolarHBondContact O-N 2.03Å; N156-C170 VanDerWaalsContact CA-SG 3.56Å; N156-C170 PolarHBondContact O-N 3.1Å; N156-C170 PolarHBondContact O-SG 3.1Å; N156-G201 VanDerWaalsContact OD1-CA 3.24Å; N156-G201 WeakPolarHBondContact OD1-CA 3.22Å; N156-L205 HydrophobicContact CB-CD1 3.61Å; N156-L205 HydrophobicContact CB-CG 4.48Å
157	T	77.5	Confident	72.1	Confident	29 Å²	29	69.9 Å²	69.9	18%	0.178	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	157.2	165.9	71.9	0	0	0	0	110	C153 P154 H155 C167 V168	C153-T157 WeakPolarHBondContact CB-O 3.2Å; P154-T157 WeakPolarHBondContact CD-OG1 3Å; P154-T157 HydrophobicContact CG-CG2 4.3Å; P154-T157 WeakPolarHBondContact CG-OG1 3.44Å; P154-T157 PolarHBondContact O-N 3.01Å; P154-T157 PolarHBondContact O-OG1 3.09Å; H155-T157 PolarHBondContact O-N 3.26Å; T157-C167 WeakPolarHBondContact OG1-CB 3.36Å; T157-V168 CarbonylContact C-O 3.55Å; T157-V168 WeakPolarHBondContact CA-O 3.49Å; T157-V168 VanDerWaalsContact CB-O 3.28Å; T157-V168 WeakPolarHBondContact CB-O 3.2Å
158	Y	76.5	Confident	73.4	Confident	28 Å²	28	65.4 Å²	65.4	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	167.5	-175.7	71.8	-70.4	0	0	0	110.5	E160 C167 V168 P169 W192 L193	Y158-E160 HydrophobicContact CD2-CG 3.72Å; Y158-E160 HydrophobicContact CE2-CG 3.35Å; Y158-E160 WeakPolarHBondContact CE2-OE1 3.39Å; Y158-C167 CarbonylContact O-C 3.57Å; Y158-C167 VanDerWaalsContact O-CA 3.27Å; Y158-C167 WeakPolarHBondContact O-CA 3.36Å; Y158-C167 WeakPolarHBondContact O-CB 3.06Å; Y158-V168 HydrophobicContact CD1-CG2 3.81Å; Y158-V168 VanDerWaalsContact CD1-O 3.23Å; Y158-V168 WeakPolarHBondContact CD1-O 3.46Å; Y158-V168 HydrophobicContact CD2-CG2 4.29Å; Y158-V168 HydrophobicContact CE1-CB 4.3Å; Y158-V168 HydrophobicContact CE1-CG2 3.51Å; Y158-V168 HydrophobicContact CE2-CG2 4.09Å; Y158-V168 HydrophobicContact CG-CG2 4.18Å; Y158-V168 PolarHBondContact N-O 3.02Å; Y158-V168 VanDerWaalsContact O-CG2 3.24Å; Y158-V168 WeakPolarHBondContact O-CG2 3.47Å; Y158-V168 PolarHBondContact O-N 3.46Å; Y158-P169 WeakPolarHBondContact CE1-O 3.07Å; Y158-W192 AromaticContact CD2-CH2 3.7Å; Y158-W192 HydrophobicContact CD2-CH2 3.7Å; Y158-W192 HydrophobicContact CD2-CZ2 4.28Å; Y158-W192 HydrophobicContact CD2-CZ3 4.46Å; Y158-W192 HydrophobicContact CG-CH2 4.36Å; Y158-L193 HydrophobicContact CD1-CD1 3.92Å; Y158-L193 HydrophobicContact CD2-CD1 3.17Å; Y158-L193 HydrophobicContact CE1-CD1 4.24Å; Y158-L193 HydrophobicContact CE2-CD1 3.49Å; Y158-L193 VanDerWaalsContact CE2-CD1 3.49Å; Y158-L193 HydrophobicContact CG-CD1 3.4Å; Y158-L193 VanDerWaalsContact CG-CD1 3.4Å
159	S	75.5	Confident	74.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.364	C	S	.	.			trans	-139.6	111.2	-178.9	165.9	0	0	0	0	108.1	P101 G102 S103 E161 Q164 W192	P101-S159 CarbonylContact C-O 3.46Å; P101-S159 VanDerWaalsContact CA-O 3.22Å; P101-S159 WeakPolarHBondContact CA-O 3.42Å; P101-S159 WeakPolarHBondContact CB-O 3.41Å; G102-S159 PolarHBondContact N-O 3.46Å; S103-S159 WeakPolarHBondContact O-CB 3.06Å; S103-S159 PolarHBondContact O-OG 3.36Å; S103-S159 VanDerWaalsContact O-OG 3.04Å; S159-E161 PolarHBondContact OG-O 2.95Å; S159-Q164 VanDerWaalsContact CA-OE1 3.31Å; S159-Q164 WeakPolarHBondContact OG-CB 3.08Å; S159-Q164 PolarHBondContact OG-OE1 3.23Å; S159-W192 WeakPolarHBondContact O-CH2 3.3Å
160	E	72.9	Confident	74.6	Confident	97 Å²	97	59.6 Å²	59.6	45%	0.453	33%	0.332	S	S	.	.			trans	-86	-34.1	-177.1	-57.8	-175.5	146.7	0	0	112.9	Y158 W192	Y158-E160 HydrophobicContact CD2-CG 3.72Å; Y158-E160 HydrophobicContact CE2-CG 3.35Å; Y158-E160 WeakPolarHBondContact CE2-OE1 3.39Å; E160-W192 HydrophobicContact CB-CZ2 4.32Å; E160-W192 HydrophobicContact CG-CH2 4.49Å; E160-W192 HydrophobicContact CG-CZ2 4.03Å
161	E	67.9	Low	74.3	Confident	120 Å²	120	59.6 Å²	59.6	56%	0.561	33%	0.332	S	S	*	.	S	Bend	trans	-96.4	149.4	-173.6	-57.7	179.9	141.8	0	0	111	S159 G163 Q164	S159-E161 PolarHBondContact OG-O 2.95Å; E161-G163 PolarHBondContact O-N 3.34Å; E161-Q164 HydrophobicContact CB-CG 3.94Å
162	F	72.2	Confident	73.3	Confident	127 Å²	127	61.3 Å²	61.3	56%	0.557	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	130.1	170.8	-70.4	-95	0	0	0	110.1	L98 C99 P101	L98-F162 HydrophobicContact CB-CB 4.05Å; L98-F162 HydrophobicContact CD1-CB 4.03Å; C99-F162 CarbonylContact O-C 3.47Å; C99-F162 VanDerWaalsContact O-CA 3.3Å; C99-F162 WeakPolarHBondContact O-CA 3.22Å; P101-F162 HydrophobicContact CG-CD2 4.33Å; P101-F162 HydrophobicContact CG-CE1 4.45Å; P101-F162 HydrophobicContact CG-CE2 4.05Å; P101-F162 HydrophobicContact CG-CZ 4.11Å
163	G	69	Low	72.2	Confident	9 Å²	9	64.2 Å²	64.2	9%	0.093	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	38.5	175.8	0	0	0	0	0	115	P85 C99 E161	P85-G163 VanDerWaalsContact CD-O 3.29Å; P85-G163 WeakPolarHBondContact CD-O 3.24Å; P85-G163 WeakPolarHBondContact CG-O 3.5Å; C99-G163 PolarHBondContact O-N 3.29Å; E161-G163 PolarHBondContact O-N 3.34Å
164	Q	70.2	Confident	71.2	Confident	27 Å²	27	64.4 Å²	64.4	13%	0.126	34%	0.34	C	S	.	.			trans	-75.3	139.8	169.7	-67.7	-168.8	-2	0	0	113	P85 Y104 Y105 S159 E161	P85-Q164 WeakPolarHBondContact CB-O 3.21Å; P85-Q164 WeakPolarHBondContact CG-O 3.11Å; Y104-Q164 WeakPolarHBondContact CA-O 3.36Å; Y104-Q164 WeakPolarHBondContact CB-O 3.36Å; Y105-Q164 PolarHBondContact N-O 2.98Å; S159-Q164 VanDerWaalsContact CA-OE1 3.31Å; S159-Q164 WeakPolarHBondContact OG-CB 3.08Å; S159-Q164 PolarHBondContact OG-OE1 3.23Å; E161-Q164 HydrophobicContact CB-CG 3.94Å
165	S	73.4	Confident	69.8	Low	56 Å²	56	66.3 Å²	66.3	39%	0.392	35%	0.354	S	S	.	.	S	Bend	trans	-88.4	-13.6	-176.2	56.2	0	0	0	0	113.7	P85 Y105	P85-S165 VanDerWaalsContact CG-N 3.31Å; Y105-S165 WeakPolarHBondContact O-CA 3.46Å
166	S	75.8	Confident	68.8	Low	74 Å²	74	64 Å²	64	52%	0.517	35%	0.346	S	S	.	.	S	Bend	trans	-156	138.5	176.9	58.5	0	0	0	0	108.8
167	C	80	Confident	67.5	Low	22 Å²	22	65.2 Å²	65.2	15%	0.149	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-72.9	142.7	174.1	-54	0	0	0	0	111.4	Y104 C153 T157 Y158	Y104-C167 WeakPolarHBondContact CD1-SG 3.02Å; C153-C167 WeakPolarHBondContact CA-SG 3.48Å; C153-C167 HydrophobicContact CB-CB 3.76Å; C153-C167 WeakPolarHBondContact CB-SG 3.33Å; C153-C167 WeakPolarHBondContact SG-CB 3.25Å; C153-C167 CovalentContact SG-SG 2.03Å; C153-C167 PolarHBondContact SG-SG 2.89Å; T157-C167 WeakPolarHBondContact OG1-CB 3.36Å; Y158-C167 CarbonylContact O-C 3.57Å; Y158-C167 VanDerWaalsContact O-CA 3.27Å; Y158-C167 WeakPolarHBondContact O-CA 3.36Å; Y158-C167 WeakPolarHBondContact O-CB 3.06Å
168	V	78.4	Confident	65.8	Low	57 Å²	57	72.4 Å²	72.4	35%	0.345	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	147.8	175.3	-74.9	0	0	0	0	111.1	T157 Y158	T157-V168 CarbonylContact C-O 3.55Å; T157-V168 WeakPolarHBondContact CA-O 3.49Å; T157-V168 VanDerWaalsContact CB-O 3.28Å; T157-V168 WeakPolarHBondContact CB-O 3.2Å; Y158-V168 HydrophobicContact CD1-CG2 3.81Å; Y158-V168 VanDerWaalsContact CD1-O 3.23Å; Y158-V168 WeakPolarHBondContact CD1-O 3.46Å; Y158-V168 HydrophobicContact CD2-CG2 4.29Å; Y158-V168 HydrophobicContact CE1-CB 4.3Å; Y158-V168 HydrophobicContact CE1-CG2 3.51Å; Y158-V168 HydrophobicContact CE2-CG2 4.09Å; Y158-V168 HydrophobicContact CG-CG2 4.18Å; Y158-V168 PolarHBondContact N-O 3.02Å; Y158-V168 VanDerWaalsContact O-CG2 3.24Å; Y158-V168 WeakPolarHBondContact O-CG2 3.47Å; Y158-V168 PolarHBondContact O-N 3.46Å
169	P	75.8	Confident	64.2	Low	84 Å²	84	72.4 Å²	72.4	55%	0.545	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.4	178.8	29.2	-34.7	0	0	0	111.4	Y158	Y158-P169 WeakPolarHBondContact CE1-O 3.07Å
170	C	75.4	Confident	62.9	Low	8 Å²	8	78.6 Å²	78.6	5%	0.054	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-50.8	137	-179.5	-71.6	0	0	0	0	112.9	N156 C197	N156-C170 VanDerWaalsContact CA-SG 3.56Å; N156-C170 PolarHBondContact O-N 3.1Å; N156-C170 PolarHBondContact O-SG 3.1Å; C170-C197 HydrophobicContact CB-CB 3.77Å; C170-C197 WeakPolarHBondContact CB-SG 3.13Å; C170-C197 VanDerWaalsContact SG-CA 3.6Å; C170-C197 WeakPolarHBondContact SG-CB 3.36Å; C170-C197 CovalentContact SG-SG 2.03Å; C170-C197 PolarHBondContact SG-SG 2.77Å
171	P	68.5	Low	61.8	Low	42 Å²	42	81.1 Å²	81.1	27%	0.273	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-68.7	144.1	179.2	28.9	-35.5	0	0	0	111.6	Q173 H174 L193	P171-Q173 PolarHBondContact O-N 3.48Å; P171-H174 HydrophobicContact CG-CB 4.14Å; P171-L193 HydrophobicContact CG-CD2 3.76Å
172	F	57.7	Low	61	Low	114 Å²	114	78.2 Å²	78.2	50%	0.5	45%	0.45	S	S	.	.	S	Bend	trans	-57.1	-34.8	178.5	172.7	-88.5	0	0	0	112.9	L206	F172-L206 HydrophobicContact CD2-CD2 3.69Å; F172-L206 HydrophobicContact CE2-CD2 3.25Å; F172-L206 HydrophobicContact CZ-CD2 4.12Å
173	Q	55.7	Low	59.9	Low	162 Å²	162	80.4 Å²	80.4	76%	0.757	47%	0.467	S	S	*	.			trans	-122.5	115.1	175.1	-84.7	160.4	-3.5	0	0	109.2	P171	P171-Q173 PolarHBondContact O-N 3.48Å
174	H	56	Low	58.9	Low	30 Å²	30	84.5 Å²	84.5	14%	0.139	49%	0.491	C	S	.	.			trans	-140.5	130.5	158.5	64.6	116.7	0	0	0	107.8	P171 L193 H194 C197 K202	P171-H174 HydrophobicContact CG-CB 4.14Å; H174-L193 HydrophobicContact CB-CD2 3.66Å; H174-H194 AromaticContact CE1-CE1 3.33Å; H174-H194 PolarHBondContact CE1-CE1 3.33Å; H174-H194 AromaticContact CE1-ND1 3.45Å; H174-H194 PolarHBondContact CE1-ND1 2.92Å; H174-H194 AromaticContact CE1-NE2 3.89Å; H174-H194 AromaticContact CG-CE1 3.76Å; H174-H194 AromaticContact ND1-CD2 3.85Å; H174-H194 AromaticContact ND1-CE1 2.87Å; H174-H194 PolarHBondContact ND1-CE1 3.31Å; H174-H194 AromaticContact ND1-ND1 3.44Å; H174-H194 PolarHBondContact ND1-ND1 2.86Å; H174-H194 AromaticContact ND1-NE2 3.1Å; H174-H194 PolarHBondContact ND1-NE2 2.87Å; H174-C197 WeakPolarHBondContact NE2-CB 3.24Å; H174-K202 PolarHBondContact CD2-NZ 2.71Å; H174-K202 WeakPolarHBondContact NE2-CE 3.27Å; H174-K202 PolarHBondContact NE2-NZ 3.33Å
175	S	48	Very low	57.8	Low	106 Å²	106	91.2 Å²	91.2	74%	0.741	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-83.5	119.8	-175	47.3	0	0	0	0	110.3	P177 H194	S175-P177 WeakPolarHBondContact O-CD 3.23Å; S175-P177 VanDerWaalsContact O-N 3.15Å; S175-H194 VanDerWaalsContact C-NE2 3.35Å; S175-H194 PolarHBondContact O-CE1 3.3Å; S175-H194 PolarHBondContact O-NE2 3.39Å
176	I	49.7	Very low	56.6	Low	122 Å²	122	92.3 Å²	92.3	63%	0.626	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-57.2	120.6	169.9	-56.6	159.4	0	0	0	106.4	I178 H194	I176-I178 PolarHBondContact O-N 2.87Å; I176-H194 WeakPolarHBondContact CA-CE1 3.46Å; I176-H194 VanDerWaalsContact CG1-CE1 3.5Å; I176-H194 WeakPolarHBondContact CG1-CE1 3.44Å; I176-H194 WeakPolarHBondContact CG1-ND1 3.03Å; I176-H194 PolarHBondContact N-CE1 2.96Å
177	P	41.7	Very low	55.4	Low	56 Å²	56	95.1 Å²	95.1	36%	0.364	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-56.8	134.1	171.5	23.3	-31	0	0	0	108.1	S175 G179	S175-P177 WeakPolarHBondContact O-CD 3.23Å; S175-P177 VanDerWaalsContact O-N 3.15Å; P177-G179 PolarHBondContact O-N 3.45Å
178	I	41.4	Very low	53.5	Low	179 Å²	179	99.6 Å²	99.6	92%	0.918	56%	0.559	S	S	*	*	S	Bend	trans	-68.3	104.5	-163.3	-61.8	166.5	0	0	0	109.9	I176	I176-I178 PolarHBondContact O-N 2.87Å
179	G	44.2	Very low	52.1	Low	29 Å²	29	99 Å²	99	30%	0.299	56%	0.564	S	S	.	*			trans	134.1	110.8	172	0	0	0	0	0	113.1	P177 D181 S182	P177-G179 PolarHBondContact O-N 3.45Å; G179-D181 PolarHBondContact O-N 3.44Å; G179-S182 PolarHBondContact O-OG 3.08Å
180	P	48.2	Very low	50.9	Low	130 Å²	130	98.2 Å²	98.2	84%	0.844	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-17	166.3	29.9	-34.4	0	0	0	112.7
181	D	49.3	Very low	50	Low	149 Å²	149	100.2 Å²	100.2	80%	0.797	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	12.1	-176.1	-53.1	-42.5	0	0	0	113.5	G179 D183	G179-D181 PolarHBondContact O-N 3.44Å; D181-D183 PolarHBondContact O-N 3.28Å
182	S	49.9	Very low	49.6	Very low	59 Å²	59	100.5 Å²	100.5	41%	0.413	57%	0.566	S	S	.	*			trans	-84.8	103.4	176.5	68.3	0	0	0	0	111	G179 T184	G179-S182 PolarHBondContact O-OG 3.08Å; S182-T184 WeakPolarHBondContact CB-OG1 3.24Å; S182-T184 PolarHBondContact O-N 2.97Å; S182-T184 PolarHBondContact OG-OG1 3.45Å
183	D	49.8	Very low	49.8	Very low	173 Å²	173	95.4 Å²	95.4	93%	0.925	54%	0.544	S	S	*	.			trans	-62.2	6.4	171.7	-81.9	-34.6	0	0	0	114.4	D181 Q185	D181-D183 PolarHBondContact O-N 3.28Å; D183-Q185 PolarHBondContact O-N 3.48Å
184	T	47.9	Very low	50	Low	95 Å²	95	89.5 Å²	89.5	58%	0.583	52%	0.516	S	S	*	.			trans	-62	109.1	168.5	31	0	0	0	0	110.5	S182	S182-T184 WeakPolarHBondContact CB-OG1 3.24Å; S182-T184 PolarHBondContact O-N 2.97Å; S182-T184 PolarHBondContact OG-OG1 3.45Å
185	Q	47.9	Very low	50.4	Low	168 Å²	168	93.9 Å²	93.9	79%	0.785	55%	0.545	S	S	*	.			trans	-46.1	136	158.5	-70.8	-179.6	-17.9	0	0	109.2	D183 I187	D183-Q185 PolarHBondContact O-N 3.48Å; Q185-I187 VanDerWaalsContact O-CG1 3.24Å; Q185-I187 WeakPolarHBondContact O-CG1 3.27Å; Q185-I187 PolarHBondContact O-N 3.28Å
186	P	47.8	Very low	51	Low	80 Å²	80	90.3 Å²	90.3	52%	0.519	52%	0.522	S	S	.	.			trans	-59.9	113.3	-178.3	23.4	-33.2	0	0	0	110.1	D191 W192	P186-D191 HydrophobicContact CB-CB 3.52Å; P186-W192 HydrophobicContact CB-CB 4.04Å; P186-W192 HydrophobicContact CG-CB 4.09Å
187	I	50.5	Low	51.8	Low	133 Å²	133	84.7 Å²	84.7	68%	0.682	49%	0.494	S	S	*	.			trans	-85.5	-32.6	-171.3	-58.1	-175	0	0	0	110.7	Q185 D191	Q185-I187 VanDerWaalsContact O-CG1 3.24Å; Q185-I187 WeakPolarHBondContact O-CG1 3.27Å; Q185-I187 PolarHBondContact O-N 3.28Å; I187-D191 PolarHBondContact N-OD2 2.95Å
188	N	40.5	Very low	52.9	Low	116 Å²	116	84.8 Å²	84.8	62%	0.62	49%	0.494	S	S	*	.	S	Bend	trans	-134.4	166.1	-176.6	-86.5	-51.8	0	0	0	113.9	S190 D191	N188-S190 PolarHBondContact O-N 2.97Å; N188-D191 PolarHBondContact N-OD2 3.25Å; N188-D191 VanDerWaalsContact N-OD2 3.1Å; N188-D191 PolarHBondContact O-N 3.42Å
189	G	48.2	Very low	53.7	Low	44 Å²	44	85 Å²	85	45%	0.454	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-12.3	-162.2	0	0	0	0	0	118	W192	G189-W192 PolarHBondContact O-NE1 2.82Å
190	S	51.9	Low	54.4	Low	68 Å²	68	91.4 Å²	91.4	48%	0.476	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-24.1	174.7	48.5	0	0	0	0	114.5	N188 W192 L193	N188-S190 PolarHBondContact O-N 2.97Å; S190-W192 PolarHBondContact O-N 2.9Å; S190-L193 WeakPolarHBondContact O-CB 2.98Å; S190-L193 PolarHBondContact O-N 2.81Å
191	D	54.7	Low	54.6	Low	50 Å²	50	85.8 Å²	85.8	27%	0.267	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-39.4	-162.2	-57.1	-23.8	0	0	0	111.5	P186 I187 N188 L193	P186-D191 HydrophobicContact CB-CB 3.52Å; I187-D191 PolarHBondContact N-OD2 2.95Å; N188-D191 PolarHBondContact N-OD2 3.25Å; N188-D191 VanDerWaalsContact N-OD2 3.1Å; N188-D191 PolarHBondContact O-N 3.42Å; D191-L193 VanDerWaalsContact C-N 3.27Å; D191-L193 PolarHBondContact O-N 3.48Å
192	W	61.1	Low	54.7	Low	48 Å²	48	81.6 Å²	81.6	18%	0.182	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.6	176.3	65.5	-88.2	0	0	0	113.5	Y158 S159 E160 P186 G189 S190 H194 T195 A196	Y158-W192 AromaticContact CD2-CH2 3.7Å; Y158-W192 HydrophobicContact CD2-CH2 3.7Å; Y158-W192 HydrophobicContact CD2-CZ2 4.28Å; Y158-W192 HydrophobicContact CD2-CZ3 4.46Å; Y158-W192 HydrophobicContact CG-CH2 4.36Å; S159-W192 WeakPolarHBondContact O-CH2 3.3Å; E160-W192 HydrophobicContact CB-CZ2 4.32Å; E160-W192 HydrophobicContact CG-CH2 4.49Å; E160-W192 HydrophobicContact CG-CZ2 4.03Å; P186-W192 HydrophobicContact CB-CB 4.04Å; P186-W192 HydrophobicContact CG-CB 4.09Å; G189-W192 PolarHBondContact O-NE1 2.82Å; S190-W192 PolarHBondContact O-N 2.9Å; W192-H194 PolarHBondContact O-N 3.11Å; W192-H194 VanDerWaalsContact O-N 3.09Å; W192-T195 WeakPolarHBondContact O-CB 3.32Å; W192-T195 PolarHBondContact O-N 3.34Å; W192-A196 HydrophobicContact CE3-CB 4.33Å; W192-A196 HydrophobicContact CZ3-CB 4.04Å; W192-A196 PolarHBondContact O-N 2.03Å
193	L	62	Low	54.9	Low	7 Å²	7	82.2 Å²	82.2	4%	0.037	46%	0.455	C	S	.	.	H	α-helix	trans	-60.5	-24.6	-178.6	-169.1	61.7	0	0	0	111.9	Y158 P171 H174 S190 D191 T195 A196 C197	Y158-L193 HydrophobicContact CD1-CD1 3.92Å; Y158-L193 HydrophobicContact CD2-CD1 3.17Å; Y158-L193 HydrophobicContact CE1-CD1 4.24Å; Y158-L193 HydrophobicContact CE2-CD1 3.49Å; Y158-L193 VanDerWaalsContact CE2-CD1 3.49Å; Y158-L193 HydrophobicContact CG-CD1 3.4Å; Y158-L193 VanDerWaalsContact CG-CD1 3.4Å; P171-L193 HydrophobicContact CG-CD2 3.76Å; H174-L193 HydrophobicContact CB-CD2 3.66Å; S190-L193 WeakPolarHBondContact O-CB 2.98Å; S190-L193 PolarHBondContact O-N 2.81Å; D191-L193 VanDerWaalsContact C-N 3.27Å; D191-L193 PolarHBondContact O-N 3.48Å; L193-T195 VanDerWaalsContact C-N 3.35Å; L193-A196 PolarHBondContact O-N 2.64Å; L193-C197 WeakPolarHBondContact CD1-SG 3.36Å; L193-C197 WeakPolarHBondContact O-CB 3.28Å; L193-C197 PolarHBondContact O-N 3.01Å
194	H	59.9	Low	55.1	Low	37 Å²	37	78.4 Å²	78.4	17%	0.171	43%	0.431	C	S	.	.	H	α-helix	trans	-69.5	-30.9	176.2	-67.8	-74.1	0	0	0	113.6	H174 S175 I176 W192	H174-H194 AromaticContact CE1-CE1 3.33Å; H174-H194 PolarHBondContact CE1-CE1 3.33Å; H174-H194 AromaticContact CE1-ND1 3.45Å; H174-H194 PolarHBondContact CE1-ND1 2.92Å; H174-H194 AromaticContact CE1-NE2 3.89Å; H174-H194 AromaticContact CG-CE1 3.76Å; H174-H194 AromaticContact ND1-CD2 3.85Å; H174-H194 AromaticContact ND1-CE1 2.87Å; H174-H194 PolarHBondContact ND1-CE1 3.31Å; H174-H194 AromaticContact ND1-ND1 3.44Å; H174-H194 PolarHBondContact ND1-ND1 2.86Å; H174-H194 AromaticContact ND1-NE2 3.1Å; H174-H194 PolarHBondContact ND1-NE2 2.87Å; S175-H194 VanDerWaalsContact C-NE2 3.35Å; S175-H194 PolarHBondContact O-CE1 3.3Å; S175-H194 PolarHBondContact O-NE2 3.39Å; I176-H194 WeakPolarHBondContact CA-CE1 3.46Å; I176-H194 VanDerWaalsContact CG1-CE1 3.5Å; I176-H194 WeakPolarHBondContact CG1-CE1 3.44Å; I176-H194 WeakPolarHBondContact CG1-ND1 3.03Å; I176-H194 PolarHBondContact N-CE1 2.96Å; W192-H194 PolarHBondContact O-N 3.11Å; W192-H194 VanDerWaalsContact O-N 3.09Å
195	T	63.6	Low	55.3	Low	122 Å²	122	75.9 Å²	75.9	75%	0.748	41%	0.414	S	S	*	.	H	α-helix	trans	-72.4	-35.1	174.4	-46.7	0	0	0	0	111.2	W192 L193	W192-T195 WeakPolarHBondContact O-CB 3.32Å; W192-T195 PolarHBondContact O-N 3.34Å; L193-T195 VanDerWaalsContact C-N 3.35Å
196	A	61.3	Low	55.7	Low	31 Å²	31	71.2 Å²	71.2	26%	0.256	39%	0.394	S	S	.	.	H	α-helix	trans	-83.5	-36	178.5	0	0	0	0	0	113.9	W192 L193	W192-A196 HydrophobicContact CE3-CB 4.33Å; W192-A196 HydrophobicContact CZ3-CB 4.04Å; W192-A196 PolarHBondContact O-N 2.03Å; L193-A196 PolarHBondContact O-N 2.64Å
197	C	66.6	Low	56.1	Low	4 Å²	4	70.4 Å²	70.4	3%	0.027	38%	0.384	C	S	.	.	S	Bend	trans	-110.3	72.4	-172.4	-58.4	0	0	0	0	111.7	C170 H174 L193	C170-C197 HydrophobicContact CB-CB 3.77Å; C170-C197 WeakPolarHBondContact CB-SG 3.13Å; C170-C197 VanDerWaalsContact SG-CA 3.6Å; C170-C197 WeakPolarHBondContact SG-CB 3.36Å; C170-C197 CovalentContact SG-SG 2.03Å; C170-C197 PolarHBondContact SG-SG 2.77Å; H174-C197 WeakPolarHBondContact NE2-CB 3.24Å; L193-C197 WeakPolarHBondContact CD1-SG 3.36Å; L193-C197 WeakPolarHBondContact O-CB 3.28Å; L193-C197 PolarHBondContact O-N 3.01Å
198	T	63.8	Low	56.6	Low	59 Å²	59	65 Å²	65	36%	0.362	36%	0.356	S	S	.	.			trans	-63.8	157.2	-179.4	67	0	0	0	0	112.7	E200	T198-E200 VanDerWaalsContact C-N 3.28Å; T198-E200 PolarHBondContact O-N 3.48Å
199	K	59.8	Low	57.6	Low	183 Å²	183	62.4 Å²	62.4	80%	0.796	34%	0.34	S	S	*	.	H	α-helix	trans	-64.9	-29.3	-174.9	-171.5	179.5	177.8	-176.1	0	113.5	K202	K199-K202 WeakPolarHBondContact O-CB 3.17Å; K199-K202 PolarHBondContact O-N 3.28Å
200	E	57.2	Low	58.3	Low	164 Å²	164	64.4 Å²	64.4	77%	0.766	34%	0.34	S	S	*	.	H	α-helix	trans	-65.1	-50.8	-170.9	-66.5	168.4	168.6	0	0	111.9	T198 K202 S203	T198-E200 VanDerWaalsContact C-N 3.28Å; T198-E200 PolarHBondContact O-N 3.48Å; E200-K202 PolarHBondContact O-N 3.43Å; E200-S203 PolarHBondContact O-N 3.39Å; E200-S203 PolarHBondContact O-OG 2.81Å
201	G	53	Low	58.7	Low	12 Å²	12	61.7 Å²	61.7	12%	0.124	32%	0.32	C	S	.	.	H	α-helix	trans	-73.6	-10	179.1	0	0	0	0	0	114.9	N156 S203 E204 L205	N156-G201 VanDerWaalsContact OD1-CA 3.24Å; N156-G201 WeakPolarHBondContact OD1-CA 3.22Å; G201-S203 PolarHBondContact O-N 3.24Å; G201-E204 PolarHBondContact O-N 3.26Å; G201-L205 PolarHBondContact O-N 2.93Å
202	K	51.8	Low	59	Low	60 Å²	60	62.7 Å²	62.7	26%	0.261	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-37.9	168.6	-61.4	-173.5	178.1	-172.2	0	111	H174 K199 E200 E204 L205 L206	H174-K202 PolarHBondContact CD2-NZ 2.71Å; H174-K202 WeakPolarHBondContact NE2-CE 3.27Å; H174-K202 PolarHBondContact NE2-NZ 3.33Å; K199-K202 WeakPolarHBondContact O-CB 3.17Å; K199-K202 PolarHBondContact O-N 3.28Å; E200-K202 PolarHBondContact O-N 3.43Å; K202-E204 PolarHBondContact O-N 3.44Å; K202-L205 PolarHBondContact O-N 3.26Å; K202-L206 VanDerWaalsContact O-CB 3.27Å; K202-L206 WeakPolarHBondContact O-CB 3.3Å; K202-L206 WeakPolarHBondContact O-CG 3.11Å; K202-L206 PolarHBondContact O-N 3.07Å
203	S	53	Low	58.9	Low	72 Å²	72	71.4 Å²	71.4	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-41	-177.6	65.6	0	0	0	0	113.5	E200 G201	E200-S203 PolarHBondContact O-N 3.39Å; E200-S203 PolarHBondContact O-OG 2.81Å; G201-S203 PolarHBondContact O-N 3.24Å
204	E	54.6	Low	59.1	Low	93 Å²	93	76.7 Å²	76.7	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-72.9	-44.4	176.4	-64.8	-147.5	109.6	0	0	112.2	G201 K202 L206 M207 I208 R231	G201-E204 PolarHBondContact O-N 3.26Å; K202-E204 PolarHBondContact O-N 3.44Å; E204-L206 VanDerWaalsContact C-N 3.32Å; E204-L206 PolarHBondContact O-N 3.39Å; E204-M207 PolarHBondContact O-N 3.09Å; E204-I208 WeakPolarHBondContact O-CB 3.39Å; E204-I208 WeakPolarHBondContact O-CD1 3.36Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.18Å; E204-I208 PolarHBondContact O-N 3.39Å; E204-I208 VanDerWaalsContact O-N 3.09Å; E204-R231 IonicContact OE1-CZ 2.94Å; E204-R231 IonicContact OE1-NH1 3.97Å; E204-R231 PolarHBondContact OE1-NH1 3.34Å
205	L	52.7	Low	59.4	Low	42 Å²	42	77.4 Å²	77.4	22%	0.22	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-37.3	177.1	-78.2	179.4	0	0	0	112.5	N156 G201 K202 I208 Q209	N156-L205 HydrophobicContact CB-CD1 3.61Å; N156-L205 HydrophobicContact CB-CG 4.48Å; G201-L205 PolarHBondContact O-N 2.93Å; K202-L205 PolarHBondContact O-N 3.26Å; L205-I208 PolarHBondContact O-N 3.09Å; L205-Q209 WeakPolarHBondContact O-CB 3.43Å; L205-Q209 WeakPolarHBondContact O-CG 3.33Å; L205-Q209 PolarHBondContact O-N 3.34Å
206	L	54.8	Low	59.5	Low	71 Å²	71	73 Å²	73	37%	0.372	37%	0.367	S	S	.	.	H	α-helix	trans	-54.5	-54.6	176	-80.9	170.9	0	0	0	111	F172 K202 E204 I210	F172-L206 HydrophobicContact CD2-CD2 3.69Å; F172-L206 HydrophobicContact CE2-CD2 3.25Å; F172-L206 HydrophobicContact CZ-CD2 4.12Å; K202-L206 VanDerWaalsContact O-CB 3.27Å; K202-L206 WeakPolarHBondContact O-CB 3.3Å; K202-L206 WeakPolarHBondContact O-CG 3.11Å; K202-L206 PolarHBondContact O-N 3.07Å; E204-L206 VanDerWaalsContact C-N 3.32Å; E204-L206 PolarHBondContact O-N 3.39Å; L206-I210 WeakPolarHBondContact O-CB 3.28Å; L206-I210 WeakPolarHBondContact O-CD1 3.46Å; L206-I210 WeakPolarHBondContact O-CG1 3.45Å; L206-I210 PolarHBondContact O-N 3.2Å; L206-I210 VanDerWaalsContact O-N 3.15Å
207	M	57.4	Low	59.7	Low	62 Å²	62	79 Å²	79	31%	0.305	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-49.4	176.9	-78.2	-153.1	-74.7	0	0	111.4	E204 Q209 I210 I211 L235	E204-M207 PolarHBondContact O-N 3.09Å; M207-Q209 PolarHBondContact O-N 2.92Å; M207-I210 PolarHBondContact O-N 2.9Å; M207-I211 HydrophobicContact CB-CD1 4.47Å; M207-I211 VanDerWaalsContact O-CB 3.3Å; M207-I211 WeakPolarHBondContact O-CB 3.33Å; M207-I211 VanDerWaalsContact O-CD1 3.31Å; M207-I211 WeakPolarHBondContact O-CD1 3.14Å; M207-I211 WeakPolarHBondContact O-CG1 3.42Å; M207-I211 PolarHBondContact O-N 2.86Å; M207-L235 HydrophobicContact CG-CD1 4.1Å; M207-L235 HydrophobicContact SD-CD1 3.66Å
208	I	60.7	Low	59.7	Low	20 Å²	20	84.6 Å²	84.6	10%	0.103	42%	0.421	C	S	.	.	H	α-helix	trans	-62.5	-42.5	-173.5	-71.3	165.3	0	0	0	112.2	E204 L205 Q212 S220 K224	E204-I208 WeakPolarHBondContact O-CB 3.39Å; E204-I208 WeakPolarHBondContact O-CD1 3.36Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.18Å; E204-I208 PolarHBondContact O-N 3.39Å; E204-I208 VanDerWaalsContact O-N 3.09Å; L205-I208 PolarHBondContact O-N 3.09Å; I208-Q212 WeakPolarHBondContact O-CG 3.35Å; I208-Q212 PolarHBondContact O-N 3.41Å; I208-S220 PolarHBondContact O-OG 3.02Å; I208-K224 HydrophobicContact CD1-CG 3.87Å; I208-K224 HydrophobicContact CG1-CG 4.1Å; I208-K224 HydrophobicContact CG2-CG 4.43Å
209	Q	60.9	Low	59.8	Low	61 Å²	61	85.3 Å²	85.3	29%	0.285	42%	0.422	S	S	.	.	H	α-helix	trans	-73.9	-41	-179.9	-73.4	-175.8	-8.1	0	0	112.7	L205 M207 I211 Q212 R213	L205-Q209 WeakPolarHBondContact O-CB 3.43Å; L205-Q209 WeakPolarHBondContact O-CG 3.33Å; L205-Q209 PolarHBondContact O-N 3.34Å; M207-Q209 PolarHBondContact O-N 2.92Å; Q209-I211 VanDerWaalsContact C-N 3.27Å; Q209-I211 PolarHBondContact O-N 3.27Å; Q209-Q212 PolarHBondContact O-N 3.23Å; Q209-Q212 VanDerWaalsContact O-N 3.16Å; Q209-R213 PolarHBondContact O-N 3.19Å
210	I	63.9	Low	59.8	Low	86 Å²	86	76.7 Å²	76.7	44%	0.441	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-43.8	174.6	-69.1	169.2	0	0	0	109.4	L206 M207 R213 I214	L206-I210 WeakPolarHBondContact O-CB 3.28Å; L206-I210 WeakPolarHBondContact O-CD1 3.46Å; L206-I210 WeakPolarHBondContact O-CG1 3.45Å; L206-I210 PolarHBondContact O-N 3.2Å; L206-I210 VanDerWaalsContact O-N 3.15Å; M207-I210 PolarHBondContact O-N 2.9Å; I210-R213 PolarHBondContact O-N 3.06Å; I210-I214 HydrophobicContact CG2-CD1 3.72Å; I210-I214 WeakPolarHBondContact O-CG1 3.31Å; I210-I214 PolarHBondContact O-N 3.28Å
211	I	58.7	Low	60.3	Low	11 Å²	11	74.6 Å²	74.6	6%	0.056	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-44.3	173.5	-70.2	166.1	0	0	0	111.4	M207 Q209 R213 I214 L215 I223	M207-I211 HydrophobicContact CB-CD1 4.47Å; M207-I211 VanDerWaalsContact O-CB 3.3Å; M207-I211 WeakPolarHBondContact O-CB 3.33Å; M207-I211 VanDerWaalsContact O-CD1 3.31Å; M207-I211 WeakPolarHBondContact O-CD1 3.14Å; M207-I211 WeakPolarHBondContact O-CG1 3.42Å; M207-I211 PolarHBondContact O-N 2.86Å; Q209-I211 VanDerWaalsContact C-N 3.27Å; Q209-I211 PolarHBondContact O-N 3.27Å; I211-R213 VanDerWaalsContact C-N 3.3Å; I211-R213 PolarHBondContact O-N 3.15Å; I211-I214 PolarHBondContact O-N 3.46Å; I211-L215 HydrophobicContact CG2-CB 4.46Å; I211-L215 WeakPolarHBondContact O-CA 3.45Å; I211-L215 WeakPolarHBondContact O-CB 3.3Å; I211-L215 PolarHBondContact O-N 3.43Å; I211-I223 HydrophobicContact CD1-CD1 3.96Å; I211-I223 HydrophobicContact CD1-CG2 3.91Å; I211-I223 HydrophobicContact CG2-CD1 3.86Å
212	Q	62.3	Low	61	Low	72 Å²	72	81 Å²	81	34%	0.336	40%	0.396	S	S	.	.	H	α-helix	trans	-61	-37.6	176.1	-79.1	-170.1	-32.2	0	0	113.1	I208 Q209 G216 S220	I208-Q212 WeakPolarHBondContact O-CG 3.35Å; I208-Q212 PolarHBondContact O-N 3.41Å; Q209-Q212 PolarHBondContact O-N 3.23Å; Q209-Q212 VanDerWaalsContact O-N 3.16Å; Q212-G216 WeakPolarHBondContact O-CA 3.22Å; Q212-G216 PolarHBondContact O-N 2.85Å; Q212-S220 WeakPolarHBondContact CG-OG 3.49Å
213	R	59.5	Low	61.8	Low	230 Å²	230	78.4 Å²	78.4	87%	0.868	39%	0.386	S	S	*	.	H	α-helix	trans	-73.7	-34.5	-179	-177.3	175.5	-82.4	169.3	-6.1	112.6	Q209 I210 I211	Q209-R213 PolarHBondContact O-N 3.19Å; I210-R213 PolarHBondContact O-N 3.06Å; I211-R213 VanDerWaalsContact C-N 3.3Å; I211-R213 PolarHBondContact O-N 3.15Å
214	I	65.4	Low	62.4	Low	119 Å²	119	79.7 Å²	79.7	61%	0.61	38%	0.382	S	S	*	.	H	α-helix	trans	-92.4	-40.3	-176.9	-61.2	171.4	0	0	0	112.2	I210 I211	I210-I214 HydrophobicContact CG2-CD1 3.72Å; I210-I214 WeakPolarHBondContact O-CG1 3.31Å; I210-I214 PolarHBondContact O-N 3.28Å; I211-I214 PolarHBondContact O-N 3.46Å
215	L	65.9	Low	63.4	Low	51 Å²	51	84.4 Å²	84.4	27%	0.267	40%	0.401	S	S	.	.	H	α-helix	trans	-112.1	-2.3	-172.8	-70.3	93.7	0	0	0	114.1	I211 I219 I238	I211-L215 HydrophobicContact CG2-CB 4.46Å; I211-L215 WeakPolarHBondContact O-CA 3.45Å; I211-L215 WeakPolarHBondContact O-CB 3.3Å; I211-L215 PolarHBondContact O-N 3.43Å; L215-I219 HydrophobicContact CB-CB 4Å; L215-I219 HydrophobicContact CB-CD1 4.06Å; L215-I219 HydrophobicContact CB-CG2 4.14Å; L215-I219 HydrophobicContact CD2-CB 4.44Å; L215-I219 HydrophobicContact CD2-CD1 4.04Å; L215-I219 HydrophobicContact CD2-CG2 3.77Å; L215-I238 HydrophobicContact CD1-CD1 3.92Å; L215-I238 HydrophobicContact CD2-CD1 3.61Å; L215-I238 HydrophobicContact CD2-CG1 4.31Å; L215-I238 HydrophobicContact CG-CD1 4.44Å
216	G	64.9	Low	64.5	Low	31 Å²	31	83.1 Å²	83.1	32%	0.32	40%	0.395	S	S	.	.	H	α-helix	trans	79.3	174.1	-179.1	0	0	0	0	0	114.6	Q212 T218	Q212-G216 WeakPolarHBondContact O-CA 3.22Å; Q212-G216 PolarHBondContact O-N 2.85Å; G216-T218 PolarHBondContact O-N 3.41Å
217	K	65.9	Low	65.7	Low	157 Å²	157	84.1 Å²	84.1	68%	0.683	40%	0.404	S	S	*	.	H	α-helix	trans	-61.7	-42.8	-173.2	-68.8	-176.4	177.9	-179.4	0	113.1	I219 S220 E221	K217-I219 PolarHBondContact O-N 3.3Å; K217-S220 WeakPolarHBondContact O-CB 3.47Å; K217-S220 PolarHBondContact O-N 2.94Å; K217-E221 PolarHBondContact O-N 3.31Å
218	T	67.6	Low	66.5	Low	120 Å²	120	87.4 Å²	87.4	74%	0.736	42%	0.422	S	S	*	.	H	α-helix	trans	-61.3	-42.9	-171.8	-28.7	0	0	0	0	112.7	G216 Y222	G216-T218 PolarHBondContact O-N 3.41Å; T218-Y222 PolarHBondContact O-N 2.97Å
219	I	65	Low	67.3	Low	75 Å²	75	93.4 Å²	93.4	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-77.2	-31.6	-177.9	-59.8	177.6	0	0	0	110.9	L215 K217 Y222 I223	L215-I219 HydrophobicContact CB-CB 4Å; L215-I219 HydrophobicContact CB-CD1 4.06Å; L215-I219 HydrophobicContact CB-CG2 4.14Å; L215-I219 HydrophobicContact CD2-CB 4.44Å; L215-I219 HydrophobicContact CD2-CD1 4.04Å; L215-I219 HydrophobicContact CD2-CG2 3.77Å; K217-I219 PolarHBondContact O-N 3.3Å; I219-Y222 PolarHBondContact O-N 3.32Å; I219-I223 HydrophobicContact CG2-CD1 3.78Å; I219-I223 HydrophobicContact CG2-CG1 4.36Å; I219-I223 WeakPolarHBondContact O-CG1 3.3Å; I219-I223 PolarHBondContact O-N 3.48Å
220	S	60.7	Low	68	Low	1 Å²	1	95 Å²	95	1%	0.007	46%	0.461	C	S	.	.	H	α-helix	trans	-62	-41.9	173.3	-176.9	0	0	0	0	113	I208 Q212 K217 Y222 I223 K224	I208-S220 PolarHBondContact O-OG 3.02Å; Q212-S220 WeakPolarHBondContact CG-OG 3.49Å; K217-S220 WeakPolarHBondContact O-CB 3.47Å; K217-S220 PolarHBondContact O-N 2.94Å; S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.15Å; S220-I223 PolarHBondContact O-N 3.31Å; S220-K224 WeakPolarHBondContact O-CG 3.42Å; S220-K224 PolarHBondContact O-N 3.45Å
221	E	66.5	Low	68.4	Low	120 Å²	120	92.4 Å²	92.4	56%	0.561	45%	0.445	S	S	*	.	H	α-helix	trans	-65.7	-33.9	176.5	-73.3	-171.6	-178.3	0	0	113.2	K217	K217-E221 PolarHBondContact O-N 3.31Å
222	Y	68.8	Low	69.3	Low	146 Å²	146	94.3 Å²	94.3	57%	0.573	46%	0.463	S	S	*	.	H	α-helix	trans	-63	-52.7	171.6	-174.3	-95.7	0	0	0	110.7	T218 I219 S220 K224 K225 T226	T218-Y222 PolarHBondContact O-N 2.97Å; I219-Y222 PolarHBondContact O-N 3.32Å; S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.15Å; Y222-K224 VanDerWaalsContact C-N 3.27Å; Y222-K224 PolarHBondContact O-N 3.31Å; Y222-K225 PolarHBondContact O-N 3.19Å; Y222-T226 PolarHBondContact O-OG1 3.4Å; Y222-T226 VanDerWaalsContact O-OG1 3.06Å
223	I	67.4	Low	70.2	Confident	6 Å²	6	92.8 Å²	92.8	3%	0.031	47%	0.467	C	S	.	.	H	α-helix	trans	-65.2	-28	-177.4	-63.7	171.3	0	0	0	112.4	I211 I219 S220 K225 T226 R231 I234	I211-I223 HydrophobicContact CD1-CD1 3.96Å; I211-I223 HydrophobicContact CD1-CG2 3.91Å; I211-I223 HydrophobicContact CG2-CD1 3.86Å; I219-I223 HydrophobicContact CG2-CD1 3.78Å; I219-I223 HydrophobicContact CG2-CG1 4.36Å; I219-I223 WeakPolarHBondContact O-CG1 3.3Å; I219-I223 PolarHBondContact O-N 3.48Å; S220-I223 PolarHBondContact O-N 3.31Å; I223-K225 VanDerWaalsContact C-N 3.31Å; I223-K225 PolarHBondContact O-N 3.27Å; I223-T226 WeakPolarHBondContact O-CB 3.37Å; I223-T226 PolarHBondContact O-N 3.03Å; I223-R231 HydrophobicContact CG2-CB 4.35Å; I223-R231 HydrophobicContact CG2-CG 3.85Å; I223-R231 PolarHBondContact O-NE 2.95Å; I223-R231 VanDerWaalsContact O-NE 3.09Å; I223-I234 HydrophobicContact CD1-CG2 3.82Å; I223-I234 HydrophobicContact CG1-CD1 4.14Å
224	K	67.3	Low	71.2	Confident	99 Å²	99	84 Å²	84	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-57.8	-40.7	170.4	-82.1	-177.7	-179.8	-174.6	0	112.7	I208 S220 Y222 T226 R231	I208-K224 HydrophobicContact CD1-CG 3.87Å; I208-K224 HydrophobicContact CG1-CG 4.1Å; I208-K224 HydrophobicContact CG2-CG 4.43Å; S220-K224 WeakPolarHBondContact O-CG 3.42Å; S220-K224 PolarHBondContact O-N 3.45Å; Y222-K224 VanDerWaalsContact C-N 3.27Å; Y222-K224 PolarHBondContact O-N 3.31Å; K224-T226 PolarHBondContact O-N 3.45Å; K224-R231 PolarHBondContact O-NH2 2.8Å
225	K	74.5	Confident	71.8	Confident	192 Å²	192	81.1 Å²	81.1	84%	0.835	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.3	-178.6	-64.8	178.9	-179.6	176.8	0	113.6	Y222 I223	Y222-K225 PolarHBondContact O-N 3.19Å; I223-K225 VanDerWaalsContact C-N 3.31Å; I223-K225 PolarHBondContact O-N 3.27Å
226	T	76.5	Confident	72.5	Confident	15 Å²	15	82.7 Å²	82.7	9%	0.092	44%	0.436	C	S	.	.	S	Bend	trans	-95.5	148.2	-171.2	-57.7	0	0	0	0	112.8	Y222 I223 K224 Q230 R231	Y222-T226 PolarHBondContact O-OG1 3.4Å; Y222-T226 VanDerWaalsContact O-OG1 3.06Å; I223-T226 WeakPolarHBondContact O-CB 3.37Å; I223-T226 PolarHBondContact O-N 3.03Å; K224-T226 PolarHBondContact O-N 3.45Å; T226-Q230 HydrophobicContact CG2-CB 3.4Å; T226-Q230 VanDerWaalsContact CG2-CB 3.4Å; T226-Q230 VanDerWaalsContact CG2-CD 3.44Å; T226-Q230 HydrophobicContact CG2-CG 3.41Å; T226-Q230 VanDerWaalsContact CG2-CG 3.41Å; T226-R231 HydrophobicContact CG2-CG 4.25Å; T226-R231 PolarHBondContact O-NE 3.37Å
227	T	80	Confident	73.3	Confident	93 Å²	93	88.3 Å²	88.3	57%	0.571	45%	0.452	S	S	*	.			trans	-66.3	152.8	176.3	60.7	0	0	0	0	112.4	I229 Q230 R231	T227-I229 VanDerWaalsContact C-N 3.29Å; T227-I229 PolarHBondContact O-N 3.04Å; T227-Q230 PolarHBondContact O-N 2.94Å; T227-R231 WeakPolarHBondContact O-CG 3.18Å; T227-R231 PolarHBondContact O-N 3.42Å
228	L	73.9	Confident	74.1	Confident	130 Å²	130	83.4 Å²	83.4	68%	0.681	43%	0.433	S	S	*	.	H	α-helix	trans	-51.4	-43.1	-176.8	-75.1	166.4	0	0	0	113.8	R231 A232	L228-R231 PolarHBondContact O-N 3.04Å; L228-A232 PolarHBondContact O-N 3.06Å; L228-A232 VanDerWaalsContact O-N 3.07Å
229	I	76.9	Confident	74.7	Confident	147 Å²	147	83.6 Å²	83.6	75%	0.754	43%	0.429	S	S	*	.	H	α-helix	trans	-63.8	-44.9	179.8	-60.7	171.7	0	0	0	110.9	T227 A232 G233	T227-I229 VanDerWaalsContact C-N 3.29Å; T227-I229 PolarHBondContact O-N 3.04Å; I229-A232 PolarHBondContact O-N 3.43Å; I229-G233 PolarHBondContact O-N 2.9Å
230	Q	76.6	Confident	75.7	Confident	94 Å²	94	82.2 Å²	82.2	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-74.5	-29.6	-179.4	-175.5	-174.7	2	0	0	111.7	T226 T227 G233 I234	T226-Q230 HydrophobicContact CG2-CB 3.4Å; T226-Q230 VanDerWaalsContact CG2-CB 3.4Å; T226-Q230 VanDerWaalsContact CG2-CD 3.44Å; T226-Q230 HydrophobicContact CG2-CG 3.41Å; T226-Q230 VanDerWaalsContact CG2-CG 3.41Å; T227-Q230 PolarHBondContact O-N 2.94Å; Q230-G233 PolarHBondContact O-N 3.49Å; Q230-I234 HydrophobicContact CG-CD1 4.26Å; Q230-I234 VanDerWaalsContact O-CG1 3.3Å; Q230-I234 WeakPolarHBondContact O-CG1 3.43Å; Q230-I234 PolarHBondContact O-N 3.27Å
231	R	72.3	Confident	76.9	Confident	31 Å²	31	86 Å²	86	12%	0.117	45%	0.448	C	S	.	.	H	α-helix	trans	-58.4	-48.6	167.4	-66.4	-172.1	-179.7	165.7	2.8	110.9	E204 I223 K224 T226 T227 L228 I234 L235	E204-R231 IonicContact OE1-CZ 2.94Å; E204-R231 IonicContact OE1-NH1 3.97Å; E204-R231 PolarHBondContact OE1-NH1 3.34Å; I223-R231 HydrophobicContact CG2-CB 4.35Å; I223-R231 HydrophobicContact CG2-CG 3.85Å; I223-R231 PolarHBondContact O-NE 2.95Å; I223-R231 VanDerWaalsContact O-NE 3.09Å; K224-R231 PolarHBondContact O-NH2 2.8Å; T226-R231 HydrophobicContact CG2-CG 4.25Å; T226-R231 PolarHBondContact O-NE 3.37Å; T227-R231 WeakPolarHBondContact O-CG 3.18Å; T227-R231 PolarHBondContact O-N 3.42Å; L228-R231 PolarHBondContact O-N 3.04Å; R231-I234 PolarHBondContact O-N 3.43Å; R231-L235 WeakPolarHBondContact O-CB 3.44Å; R231-L235 PolarHBondContact O-N 3.16Å; R231-L235 VanDerWaalsContact O-N 3.15Å
232	A	77.4	Confident	77.8	Confident	51 Å²	51	83.6 Å²	83.6	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-43.3	177.5	0	0	0	0	0	112.1	L228 I229 I234 L235 C236	L228-A232 PolarHBondContact O-N 3.06Å; L228-A232 VanDerWaalsContact O-N 3.07Å; I229-A232 PolarHBondContact O-N 3.43Å; A232-I234 PolarHBondContact O-N 3.07Å; A232-L235 PolarHBondContact O-N 3.43Å; A232-C236 WeakPolarHBondContact O-CB 3.32Å; A232-C236 PolarHBondContact O-N 2.99Å; A232-C236 PolarHBondContact O-SG 3.41Å
233	G	80.9	Confident	78.8	Confident	41 Å²	41	78.5 Å²	78.5	42%	0.423	44%	0.435	S	S	.	.	H	α-helix	trans	-58.5	-46.4	176.9	0	0	0	0	0	113.4	I229 Q230 L235 C236 F237	I229-G233 PolarHBondContact O-N 2.9Å; Q230-G233 PolarHBondContact O-N 3.49Å; G233-L235 VanDerWaalsContact C-N 3.35Å; G233-L235 PolarHBondContact O-N 3.37Å; G233-C236 PolarHBondContact O-N 3.2Å; G233-F237 PolarHBondContact O-N 2.87Å
234	I	81	Confident	79.8	Confident	46 Å²	46	83.1 Å²	83.1	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-61.8	-43.3	176.6	-67.9	165	0	0	0	110.9	I223 Q230 R231 A232 F237 I238	I223-I234 HydrophobicContact CD1-CG2 3.82Å; I223-I234 HydrophobicContact CG1-CD1 4.14Å; Q230-I234 HydrophobicContact CG-CD1 4.26Å; Q230-I234 VanDerWaalsContact O-CG1 3.3Å; Q230-I234 WeakPolarHBondContact O-CG1 3.43Å; Q230-I234 PolarHBondContact O-N 3.27Å; R231-I234 PolarHBondContact O-N 3.43Å; A232-I234 PolarHBondContact O-N 3.07Å; I234-F237 WeakPolarHBondContact O-CB 3.49Å; I234-F237 PolarHBondContact O-N 3.05Å; I234-I238 HydrophobicContact CG2-CD1 3.69Å; I234-I238 HydrophobicContact CG2-CG1 4.49Å; I234-I238 WeakPolarHBondContact O-CD1 3.21Å; I234-I238 VanDerWaalsContact O-CG1 3.32Å; I234-I238 WeakPolarHBondContact O-CG1 3.45Å; I234-I238 PolarHBondContact O-N 3.45Å
235	L	77	Confident	80.9	Confident	57 Å²	57	82.4 Å²	82.4	30%	0.298	46%	0.459	S	S	.	.	H	α-helix	trans	-68.6	-41.3	-177.7	-152.2	156.5	0	0	0	111.6	M207 R231 A232 G233 F237 I238 L239	M207-L235 HydrophobicContact CG-CD1 4.1Å; M207-L235 HydrophobicContact SD-CD1 3.66Å; R231-L235 WeakPolarHBondContact O-CB 3.44Å; R231-L235 PolarHBondContact O-N 3.16Å; R231-L235 VanDerWaalsContact O-N 3.15Å; A232-L235 PolarHBondContact O-N 3.43Å; G233-L235 VanDerWaalsContact C-N 3.35Å; G233-L235 PolarHBondContact O-N 3.37Å; L235-F237 VanDerWaalsContact C-N 3.32Å; L235-F237 PolarHBondContact O-N 3.47Å; L235-I238 PolarHBondContact O-N 3.25Å; L235-L239 HydrophobicContact CD2-CD1 3.6Å; L235-L239 HydrophobicContact CD2-CG 4.13Å; L235-L239 WeakPolarHBondContact O-CG 3.38Å; L235-L239 PolarHBondContact O-N 3.48Å
236	C	80.4	Confident	81.6	Confident	84 Å²	84	76.9 Å²	76.9	57%	0.568	44%	0.441	S	S	*	.	H	α-helix	trans	-58.5	-41.8	169.1	-74	0	0	0	0	112.1	A232 G233 L239 A240	A232-C236 WeakPolarHBondContact O-CB 3.32Å; A232-C236 PolarHBondContact O-N 2.99Å; A232-C236 PolarHBondContact O-SG 3.41Å; G233-C236 PolarHBondContact O-N 3.2Å; C236-L239 PolarHBondContact O-N 3.38Å; C236-A240 WeakPolarHBondContact O-CB 3.47Å; C236-A240 PolarHBondContact O-N 2.98Å
237	F	82.9	Confident	82.4	Confident	150 Å²	150	80.9 Å²	80.9	66%	0.658	47%	0.465	S	S	*	.	H	α-helix	trans	-63.6	-44.3	178.9	-146	-85.4	0	0	0	111.6	G233 I234 L235 L239 A240 L241	G233-F237 PolarHBondContact O-N 2.87Å; I234-F237 WeakPolarHBondContact O-CB 3.49Å; I234-F237 PolarHBondContact O-N 3.05Å; L235-F237 VanDerWaalsContact C-N 3.32Å; L235-F237 PolarHBondContact O-N 3.47Å; F237-L239 PolarHBondContact O-N 3.47Å; F237-A240 PolarHBondContact O-N 2.96Å; F237-L241 HydrophobicContact CD1-CD1 4.15Å; F237-L241 HydrophobicContact CE1-CD1 4.19Å; F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.38Å
238	I	81.7	Confident	83	Confident	54 Å²	54	81 Å²	81	28%	0.277	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-38.2	177.8	-66.7	158.4	0	0	0	111.8	L215 I234 L235 P242	L215-I238 HydrophobicContact CD1-CD1 3.92Å; L215-I238 HydrophobicContact CD2-CD1 3.61Å; L215-I238 HydrophobicContact CD2-CG1 4.31Å; L215-I238 HydrophobicContact CG-CD1 4.44Å; I234-I238 HydrophobicContact CG2-CD1 3.69Å; I234-I238 HydrophobicContact CG2-CG1 4.49Å; I234-I238 WeakPolarHBondContact O-CD1 3.21Å; I234-I238 VanDerWaalsContact O-CG1 3.32Å; I234-I238 WeakPolarHBondContact O-CG1 3.45Å; I234-I238 PolarHBondContact O-N 3.45Å; L235-I238 PolarHBondContact O-N 3.25Å; I238-P242 WeakPolarHBondContact O-CD 3.44Å
239	L	81.3	Confident	83.9	Confident	123 Å²	123	80 Å²	80	64%	0.644	46%	0.456	S	S	*	.	H	α-helix	trans	-75.8	-34.7	177.2	-70	175.5	0	0	0	112.9	L235 C236 F237 P242	L235-L239 HydrophobicContact CD2-CD1 3.6Å; L235-L239 HydrophobicContact CD2-CG 4.13Å; L235-L239 WeakPolarHBondContact O-CG 3.38Å; L235-L239 PolarHBondContact O-N 3.48Å; C236-L239 PolarHBondContact O-N 3.38Å; F237-L239 PolarHBondContact O-N 3.47Å; L239-P242 WeakPolarHBondContact O-CD 3.05Å; L239-P242 WeakPolarHBondContact O-CG 3.47Å
240	A	84.8	Confident	84.7	Confident	46 Å²	46	78.2 Å²	78.2	38%	0.38	45%	0.447	S	S	.	.	H	α-helix	trans	-75.7	-36.3	179.8	0	0	0	0	0	112.9	C236 F237 G243 I244	C236-A240 WeakPolarHBondContact O-CB 3.47Å; C236-A240 PolarHBondContact O-N 2.98Å; F237-A240 PolarHBondContact O-N 2.96Å; A240-G243 PolarHBondContact O-N 2.87Å; A240-G243 VanDerWaalsContact O-N 3.1Å; A240-I244 HydrophobicContact CB-CD1 4.18Å; A240-I244 WeakPolarHBondContact O-CG1 3.34Å; A240-I244 PolarHBondContact O-N 3.1Å
241	L	86.6	Confident	85.4	Confident	80 Å²	80	79.5 Å²	79.5	42%	0.419	45%	0.452	S	S	.	.	H	α-helix	trans	-49.9	-53.7	-178.4	-129.3	166.4	0	0	0	114.1	F237 G243 I244 I245	F237-L241 HydrophobicContact CD1-CD1 4.15Å; F237-L241 HydrophobicContact CE1-CD1 4.19Å; F237-L241 WeakPolarHBondContact O-CB 3.46Å; F237-L241 PolarHBondContact O-N 3.38Å; L241-G243 VanDerWaalsContact C-N 3.34Å; L241-G243 PolarHBondContact O-N 3.45Å; L241-I244 PolarHBondContact O-N 2.96Å; L241-I245 HydrophobicContact CD2-CD1 3.49Å; L241-I245 VanDerWaalsContact CD2-CD1 3.49Å; L241-I245 HydrophobicContact CD2-CG1 4.08Å; L241-I245 WeakPolarHBondContact O-CG1 3.35Å; L241-I245 PolarHBondContact O-N 3.35Å
242	P	86.7	Confident	86.4	Confident	71 Å²	71	82.4 Å²	82.4	46%	0.461	47%	0.469	S	S	.	.	H	α-helix	trans	-64	-38.6	178.1	24.9	-33.6	0	0	0	112	I238 L239 I245 T246	I238-P242 WeakPolarHBondContact O-CD 3.44Å; L239-P242 WeakPolarHBondContact O-CD 3.05Å; L239-P242 WeakPolarHBondContact O-CG 3.47Å; P242-I245 PolarHBondContact O-N 2.95Å; P242-T246 PolarHBondContact O-N 3.35Å; P242-T246 PolarHBondContact O-OG1 2.85Å
243	G	88.1	Confident	87	Confident	39 Å²	39	82 Å²	82	40%	0.402	47%	0.466	S	S	.	.	H	α-helix	trans	-61.6	-44.1	176	0	0	0	0	0	112.8	A240 L241 T246 V247	A240-G243 PolarHBondContact O-N 2.87Å; A240-G243 VanDerWaalsContact O-N 3.1Å; L241-G243 VanDerWaalsContact C-N 3.34Å; L241-G243 PolarHBondContact O-N 3.45Å; G243-T246 PolarHBondContact O-N 3.32Å; G243-V247 WeakPolarHBondContact O-CG2 3.47Å; G243-V247 PolarHBondContact O-N 3.29Å
244	I	89.5	Confident	87.5	Confident	102 Å²	102	87 Å²	87	52%	0.523	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.3	-66.5	163.8	0	0	0	110.5	A240 L241 V247 L248	A240-I244 HydrophobicContact CB-CD1 4.18Å; A240-I244 WeakPolarHBondContact O-CG1 3.34Å; A240-I244 PolarHBondContact O-N 3.1Å; L241-I244 PolarHBondContact O-N 2.96Å; I244-V247 PolarHBondContact O-N 2.91Å; I244-L248 HydrophobicContact CG2-CD1 4Å; I244-L248 HydrophobicContact CG2-CG 4.48Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 WeakPolarHBondContact O-CG 3.35Å; I244-L248 PolarHBondContact O-N 2.99Å
245	I	90.3	Very high	87.9	Confident	84 Å²	84	88.4 Å²	88.4	43%	0.431	48%	0.48	S	S	.	.	H	α-helix	trans	-60.8	-45.2	175.5	-70.4	168.1	0	0	0	110.9	L241 P242 V247 L248 L249	L241-I245 HydrophobicContact CD2-CD1 3.49Å; L241-I245 VanDerWaalsContact CD2-CD1 3.49Å; L241-I245 HydrophobicContact CD2-CG1 4.08Å; L241-I245 WeakPolarHBondContact O-CG1 3.35Å; L241-I245 PolarHBondContact O-N 3.35Å; P242-I245 PolarHBondContact O-N 2.95Å; I245-V247 PolarHBondContact O-N 2.88Å; I245-L248 PolarHBondContact O-N 3.48Å; I245-L249 HydrophobicContact CG2-CD1 3.96Å; I245-L249 HydrophobicContact CG2-CG 4.38Å; I245-L249 WeakPolarHBondContact O-CG 3.34Å; I245-L249 PolarHBondContact O-N 2.95Å
246	T	89.9	Confident	88.4	Confident	77 Å²	77	91.5 Å²	91.5	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-43.8	177.5	-56.6	0	0	0	0	111.7	P242 G243 L249 I250	P242-T246 PolarHBondContact O-N 3.35Å; P242-T246 PolarHBondContact O-OG1 2.85Å; G243-T246 PolarHBondContact O-N 3.32Å; T246-L249 PolarHBondContact O-N 3.33Å; T246-I250 HydrophobicContact CG2-CD1 3.93Å; T246-I250 VanDerWaalsContact O-CG1 3.29Å; T246-I250 WeakPolarHBondContact O-CG1 3.27Å; T246-I250 PolarHBondContact O-N 3.3Å
247	V	92.1	Very high	88.8	Confident	99 Å²	99	93.3 Å²	93.3	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-42.2	176.1	171.1	0	0	0	0	111.4	G243 I244 I245 I250 F251	G243-V247 WeakPolarHBondContact O-CG2 3.47Å; G243-V247 PolarHBondContact O-N 3.29Å; I244-V247 PolarHBondContact O-N 2.91Å; I245-V247 PolarHBondContact O-N 2.88Å; V247-I250 PolarHBondContact O-N 3.31Å; V247-F251 WeakPolarHBondContact O-CB 3.34Å; V247-F251 PolarHBondContact O-N 2.83Å
248	L	92.8	Very high	89	Confident	94 Å²	94	89.8 Å²	89.8	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-41.6	175.7	-74.5	170.4	0	0	0	112.3	I244 I245 F251 I252	I244-L248 HydrophobicContact CG2-CD1 4Å; I244-L248 HydrophobicContact CG2-CG 4.48Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 WeakPolarHBondContact O-CG 3.35Å; I244-L248 PolarHBondContact O-N 2.99Å; I245-L248 PolarHBondContact O-N 3.48Å; L248-F251 PolarHBondContact O-N 3.34Å; L248-I252 VanDerWaalsContact O-CG1 3.27Å; L248-I252 WeakPolarHBondContact O-CG1 3.29Å; L248-I252 PolarHBondContact O-N 3.36Å
249	L	93.7	Very high	89.3	Confident	109 Å²	109	90.6 Å²	90.6	57%	0.571	49%	0.494	S	S	*	.	H	α-helix	trans	-65.5	-40.2	176.1	-71.3	173	0	0	0	112.1	I245 T246 I252 A253	I245-L249 HydrophobicContact CG2-CD1 3.96Å; I245-L249 HydrophobicContact CG2-CG 4.38Å; I245-L249 WeakPolarHBondContact O-CG 3.34Å; I245-L249 PolarHBondContact O-N 2.95Å; T246-L249 PolarHBondContact O-N 3.33Å; L249-I252 PolarHBondContact O-N 2.91Å; L249-A253 WeakPolarHBondContact O-CB 3.37Å; L249-A253 PolarHBondContact O-N 3.48Å
250	I	93	Very high	89.3	Confident	110 Å²	110	86 Å²	86	56%	0.564	48%	0.477	S	S	*	.	H	α-helix	trans	-63.6	-41.9	173.5	-69.4	166.3	0	0	0	110.7	T246 V247 A253 Y254	T246-I250 HydrophobicContact CG2-CD1 3.93Å; T246-I250 VanDerWaalsContact O-CG1 3.29Å; T246-I250 WeakPolarHBondContact O-CG1 3.27Å; T246-I250 PolarHBondContact O-N 3.3Å; V247-I250 PolarHBondContact O-N 3.31Å; I250-A253 PolarHBondContact O-N 2.9Å; I250-Y254 WeakPolarHBondContact O-CB 3.46Å; I250-Y254 PolarHBondContact O-N 2.98Å
251	F	92.1	Very high	89.2	Confident	121 Å²	121	86.2 Å²	86.2	53%	0.531	48%	0.476	S	S	.	.	H	α-helix	trans	-65.5	-41.8	178.1	-176.1	-107.6	0	0	0	112.5	V247 L248 Y254 I255	V247-F251 WeakPolarHBondContact O-CB 3.34Å; V247-F251 PolarHBondContact O-N 2.83Å; L248-F251 PolarHBondContact O-N 3.34Å; F251-Y254 PolarHBondContact O-N 3.32Å; F251-I255 HydrophobicContact CD1-CD1 3.9Å; F251-I255 HydrophobicContact CE1-CD1 3.43Å; F251-I255 VanDerWaalsContact CE1-CD1 3.43Å; F251-I255 HydrophobicContact CE1-CG1 4.45Å; F251-I255 HydrophobicContact CE2-CD1 4.43Å; F251-I255 HydrophobicContact CZ-CD1 3.73Å; F251-I255 HydrophobicContact CZ-CG1 4.45Å; F251-I255 WeakPolarHBondContact O-CG1 3.47Å; F251-I255 PolarHBondContact O-N 3.45Å
252	I	91.4	Very high	89.1	Confident	92 Å²	92	85.4 Å²	85.4	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-45.1	173.1	-69.1	163.5	0	0	0	110.5	L248 L249 Y254 I255 L256	L248-I252 VanDerWaalsContact O-CG1 3.27Å; L248-I252 WeakPolarHBondContact O-CG1 3.29Å; L248-I252 PolarHBondContact O-N 3.36Å; L249-I252 PolarHBondContact O-N 2.91Å; I252-Y254 VanDerWaalsContact C-N 3.33Å; I252-Y254 PolarHBondContact O-N 3Å; I252-I255 PolarHBondContact O-N 3.33Å; I252-L256 HydrophobicContact CG2-CD1 4.06Å; I252-L256 VanDerWaalsContact O-CG 3.32Å; I252-L256 WeakPolarHBondContact O-CG 3.39Å; I252-L256 PolarHBondContact O-N 2.94Å
253	A	91	Very high	88.9	Confident	44 Å²	44	87.1 Å²	87.1	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-39.9	176.2	0	0	0	0	0	112.2	L249 I250 L256 I257	L249-A253 WeakPolarHBondContact O-CB 3.37Å; L249-A253 PolarHBondContact O-N 3.48Å; I250-A253 PolarHBondContact O-N 2.9Å; A253-L256 PolarHBondContact O-N 2.97Å; A253-I257 VanDerWaalsContact O-CG1 3.29Å; A253-I257 WeakPolarHBondContact O-CG1 3.28Å; A253-I257 PolarHBondContact O-N 3.34Å
254	Y	91.5	Very high	88.7	Confident	144 Å²	144	90.1 Å²	90.1	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-61.2	-48.1	174.7	179.1	-89	0	0	0	111.8	I250 F251 I252 L256 I257 D258	I250-Y254 WeakPolarHBondContact O-CB 3.46Å; I250-Y254 PolarHBondContact O-N 2.98Å; F251-Y254 PolarHBondContact O-N 3.32Å; I252-Y254 VanDerWaalsContact C-N 3.33Å; I252-Y254 PolarHBondContact O-N 3Å; Y254-L256 VanDerWaalsContact C-N 3.32Å; Y254-L256 PolarHBondContact O-N 3.17Å; Y254-I257 PolarHBondContact O-N 3.35Å; Y254-D258 HydrophobicContact CE1-CB 4.41Å; Y254-D258 WeakPolarHBondContact O-CB 3.25Å; Y254-D258 PolarHBondContact O-N 3.31Å
255	I	89.3	Confident	88.5	Confident	76 Å²	76	91.8 Å²	91.8	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-58.9	-43.6	175.8	-71.9	172.1	0	0	0	111	F251 I252 I257 D258 V259	F251-I255 HydrophobicContact CD1-CD1 3.9Å; F251-I255 HydrophobicContact CE1-CD1 3.43Å; F251-I255 VanDerWaalsContact CE1-CD1 3.43Å; F251-I255 HydrophobicContact CE1-CG1 4.45Å; F251-I255 HydrophobicContact CE2-CD1 4.43Å; F251-I255 HydrophobicContact CZ-CD1 3.73Å; F251-I255 HydrophobicContact CZ-CG1 4.45Å; F251-I255 WeakPolarHBondContact O-CG1 3.47Å; F251-I255 PolarHBondContact O-N 3.45Å; I252-I255 PolarHBondContact O-N 3.33Å; I255-I257 VanDerWaalsContact C-N 3.31Å; I255-I257 PolarHBondContact O-N 2.9Å; I255-D258 PolarHBondContact O-N 2.83Å; I255-V259 HydrophobicContact CG2-CG2 4.08Å; I255-V259 VanDerWaalsContact O-CB 3.28Å; I255-V259 WeakPolarHBondContact O-CB 3.32Å; I255-V259 VanDerWaalsContact O-CG2 3.25Å; I255-V259 WeakPolarHBondContact O-CG2 3.29Å; I255-V259 PolarHBondContact O-N 3.41Å
256	L	88.5	Confident	87.9	Confident	122 Å²	122	93.7 Å²	93.7	64%	0.639	50%	0.498	S	S	*	.	H	α-helix	trans	-63.3	-35.9	178.2	-70.2	170.3	0	0	0	112.5	I252 A253 Y254 G260	I252-L256 HydrophobicContact CG2-CD1 4.06Å; I252-L256 VanDerWaalsContact O-CG 3.32Å; I252-L256 WeakPolarHBondContact O-CG 3.39Å; I252-L256 PolarHBondContact O-N 2.94Å; A253-L256 PolarHBondContact O-N 2.97Å; Y254-L256 VanDerWaalsContact C-N 3.32Å; Y254-L256 PolarHBondContact O-N 3.17Å; L256-G260 PolarHBondContact O-N 3.43Å
257	I	87.6	Confident	87.5	Confident	123 Å²	123	93 Å²	93	63%	0.631	50%	0.5	S	S	*	.	H	α-helix	trans	-70.7	-45.2	175.5	-68.9	164.1	0	0	0	111	A253 Y254 I255 G260 S261	A253-I257 VanDerWaalsContact O-CG1 3.29Å; A253-I257 WeakPolarHBondContact O-CG1 3.28Å; A253-I257 PolarHBondContact O-N 3.34Å; Y254-I257 PolarHBondContact O-N 3.35Å; I255-I257 VanDerWaalsContact C-N 3.31Å; I255-I257 PolarHBondContact O-N 2.9Å; I257-G260 PolarHBondContact O-N 3.4Å; I257-S261 WeakPolarHBondContact O-CB 3.37Å; I257-S261 PolarHBondContact O-N 2.9Å
258	D	88.2	Confident	87.1	Confident	75 Å²	75	95.6 Å²	95.6	40%	0.401	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-48	-178.1	-169.8	28.7	0	0	0	111.5	Y254 I255 G260 S261 T262	Y254-D258 HydrophobicContact CE1-CB 4.41Å; Y254-D258 WeakPolarHBondContact O-CB 3.25Å; Y254-D258 PolarHBondContact O-N 3.31Å; I255-D258 PolarHBondContact O-N 2.83Å; D258-G260 VanDerWaalsContact C-N 3.32Å; D258-G260 PolarHBondContact O-N 2.97Å; D258-S261 PolarHBondContact O-N 2.97Å; D258-S261 VanDerWaalsContact O-N 3.16Å; D258-S261 PolarHBondContact O-OG 3.04Å; D258-T262 PolarHBondContact O-N 3.02Å; D258-T262 PolarHBondContact O-OG1 2.89Å
259	V	86.4	Confident	86.5	Confident	71 Å²	71	93.9 Å²	93.9	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-61.3	-39.7	172.3	174.9	0	0	0	0	111.1	I255 T262 I263	I255-V259 HydrophobicContact CG2-CG2 4.08Å; I255-V259 VanDerWaalsContact O-CB 3.28Å; I255-V259 WeakPolarHBondContact O-CB 3.32Å; I255-V259 VanDerWaalsContact O-CG2 3.25Å; I255-V259 WeakPolarHBondContact O-CG2 3.29Å; I255-V259 PolarHBondContact O-N 3.41Å; V259-T262 WeakPolarHBondContact CA-OG1 3.42Å; V259-T262 PolarHBondContact O-OG1 3.16Å; V259-I263 HydrophobicContact CG1-CD1 3.77Å; V259-I263 HydrophobicContact CG1-CG1 4.46Å; V259-I263 WeakPolarHBondContact O-CB 3.42Å; V259-I263 WeakPolarHBondContact O-CD1 3.22Å; V259-I263 WeakPolarHBondContact O-CG1 3.46Å; V259-I263 PolarHBondContact O-N 2.99Å
260	G	82.2	Confident	86	Confident	28 Å²	28	92.9 Å²	92.9	29%	0.289	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-43.4	173.1	0	0	0	0	0	112.8	L256 I257 D258 I264	L256-G260 PolarHBondContact O-N 3.43Å; I257-G260 PolarHBondContact O-N 3.4Å; D258-G260 VanDerWaalsContact C-N 3.32Å; D258-G260 PolarHBondContact O-N 2.97Å; G260-I264 WeakPolarHBondContact O-CD1 3.43Å; G260-I264 VanDerWaalsContact O-CG1 3.25Å; G260-I264 WeakPolarHBondContact O-CG1 3.29Å; G260-I264 PolarHBondContact O-N 2.95Å
261	S	83	Confident	85.4	Confident	50 Å²	50	92.8 Å²	92.8	35%	0.35	49%	0.494	S	S	.	.	H	α-helix	trans	-67.7	-41.3	-178.7	84.7	0	0	0	0	112.5	I257 D258 I264 Q265	I257-S261 WeakPolarHBondContact O-CB 3.37Å; I257-S261 PolarHBondContact O-N 2.9Å; D258-S261 PolarHBondContact O-N 2.97Å; D258-S261 VanDerWaalsContact O-N 3.16Å; D258-S261 PolarHBondContact O-OG 3.04Å; S261-I264 PolarHBondContact O-N 3.44Å; S261-Q265 PolarHBondContact O-N 3.06Å
262	T	83.6	Confident	85.1	Confident	63 Å²	63	90.4 Å²	90.4	39%	0.387	49%	0.491	S	S	.	.	H	α-helix	trans	-69.1	-40.5	178.3	48	0	0	0	0	111.5	D258 V259 I264 Q265 M266	D258-T262 PolarHBondContact O-N 3.02Å; D258-T262 PolarHBondContact O-OG1 2.89Å; V259-T262 WeakPolarHBondContact CA-OG1 3.42Å; V259-T262 PolarHBondContact O-OG1 3.16Å; T262-I264 VanDerWaalsContact C-N 3.33Å; T262-I264 PolarHBondContact O-N 3.3Å; T262-Q265 PolarHBondContact O-N 2.9Å; T262-M266 WeakPolarHBondContact O-CB 3.43Å; T262-M266 VanDerWaalsContact O-CG 3.29Å; T262-M266 WeakPolarHBondContact O-CG 3.25Å; T262-M266 PolarHBondContact O-N 3.29Å
263	I	82.4	Confident	84.7	Confident	106 Å²	106	91 Å²	91	54%	0.544	49%	0.494	S	S	.	.	H	α-helix	trans	-60.1	-42.1	171.6	-70.1	168.6	0	0	0	111.1	V259 M266 A267	V259-I263 HydrophobicContact CG1-CD1 3.77Å; V259-I263 HydrophobicContact CG1-CG1 4.46Å; V259-I263 WeakPolarHBondContact O-CB 3.42Å; V259-I263 WeakPolarHBondContact O-CD1 3.22Å; V259-I263 WeakPolarHBondContact O-CG1 3.46Å; V259-I263 PolarHBondContact O-N 2.99Å; I263-M266 PolarHBondContact O-N 3.1Å; I263-A267 WeakPolarHBondContact O-CB 3.47Å; I263-A267 PolarHBondContact O-N 3.24Å
264	I	83.4	Confident	84.2	Confident	102 Å²	102	94.8 Å²	94.8	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-66.4	-39.6	177.7	-69.9	164.6	0	0	0	111.8	G260 S261 T262 K268	G260-I264 WeakPolarHBondContact O-CD1 3.43Å; G260-I264 VanDerWaalsContact O-CG1 3.25Å; G260-I264 WeakPolarHBondContact O-CG1 3.29Å; G260-I264 PolarHBondContact O-N 2.95Å; S261-I264 PolarHBondContact O-N 3.44Å; T262-I264 VanDerWaalsContact C-N 3.33Å; T262-I264 PolarHBondContact O-N 3.3Å; I264-K268 WeakPolarHBondContact O-CG 3.36Å; I264-K268 PolarHBondContact O-N 3.49Å; I264-K268 VanDerWaalsContact O-N 3.1Å
265	Q	85.5	Confident	83.9	Confident	138 Å²	138	91.7 Å²	91.7	65%	0.645	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-45.7	174.4	-75	-173.6	4	0	0	111.7	S261 T262 A267 K268 A269	S261-Q265 PolarHBondContact O-N 3.06Å; T262-Q265 PolarHBondContact O-N 2.9Å; Q265-A267 PolarHBondContact O-N 3.1Å; Q265-K268 PolarHBondContact O-N 2.87Å; Q265-A269 WeakPolarHBondContact O-CB 3.49Å; Q265-A269 PolarHBondContact O-N 2.85Å
266	M	78.8	Confident	83.7	Confident	124 Å²	124	93.3 Å²	93.3	61%	0.611	50%	0.503	S	S	*	.	H	α-helix	trans	-60	-46	175.7	-71	-66.8	-123.3	0	0	111.3	T262 I263 K268 A269 L270	T262-M266 WeakPolarHBondContact O-CB 3.43Å; T262-M266 VanDerWaalsContact O-CG 3.29Å; T262-M266 WeakPolarHBondContact O-CG 3.25Å; T262-M266 PolarHBondContact O-N 3.29Å; I263-M266 PolarHBondContact O-N 3.1Å; M266-K268 VanDerWaalsContact C-N 3.3Å; M266-K268 PolarHBondContact O-N 3.41Å; M266-A269 PolarHBondContact O-N 3.16Å; M266-A269 VanDerWaalsContact O-N 3.1Å; M266-L270 HydrophobicContact CB-CD1 4.35Å; M266-L270 WeakPolarHBondContact O-CD1 3.41Å; M266-L270 PolarHBondContact O-N 2.94Å
267	A	81.2	Confident	83.5	Confident	61 Å²	61	93.3 Å²	93.3	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-57.9	-41.2	176.6	0	0	0	0	0	112.5	I263 Q265 H271	I263-A267 WeakPolarHBondContact O-CB 3.47Å; I263-A267 PolarHBondContact O-N 3.24Å; Q265-A267 PolarHBondContact O-N 3.1Å; A267-H271 PolarHBondContact O-N 3.33Å; A267-H271 VanDerWaalsContact O-N 3.16Å
268	K	83.1	Confident	83.3	Confident	155 Å²	155	90 Å²	90	67%	0.674	49%	0.494	S	S	*	.	H	α-helix	trans	-67.2	-37.7	174.5	-73.2	179.1	179.3	-177.8	0	113	I264 Q265 M266 P272	I264-K268 WeakPolarHBondContact O-CG 3.36Å; I264-K268 PolarHBondContact O-N 3.49Å; I264-K268 VanDerWaalsContact O-N 3.1Å; Q265-K268 PolarHBondContact O-N 2.87Å; M266-K268 VanDerWaalsContact C-N 3.3Å; M266-K268 PolarHBondContact O-N 3.41Å; K268-P272 VanDerWaalsContact O-CD 3.24Å; K268-P272 WeakPolarHBondContact O-CD 3.49Å
269	A	81.8	Confident	83.3	Confident	57 Å²	57	92.1 Å²	92.1	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-72.6	-34.3	178.5	0	0	0	0	0	113.1	Q265 M266 P272	Q265-A269 WeakPolarHBondContact O-CB 3.49Å; Q265-A269 PolarHBondContact O-N 2.85Å; M266-A269 PolarHBondContact O-N 3.16Å; M266-A269 VanDerWaalsContact O-N 3.1Å; A269-P272 WeakPolarHBondContact O-CD 3.5Å; A269-P272 WeakPolarHBondContact O-CG 3.39Å
270	L	81.8	Confident	83.3	Confident	88 Å²	88	93.3 Å²	93.3	46%	0.461	51%	0.505	S	S	.	.	H	α-helix	trans	-76.5	-22.8	175.3	-85.8	88.9	0	0	0	113.3	M266 L273 Q274	M266-L270 HydrophobicContact CB-CD1 4.35Å; M266-L270 WeakPolarHBondContact O-CD1 3.41Å; M266-L270 PolarHBondContact O-N 2.94Å; L270-L273 WeakPolarHBondContact O-CB 3.08Å; L270-L273 PolarHBondContact O-N 2.95Å; L270-Q274 WeakPolarHBondContact O-CG 3.24Å; L270-Q274 PolarHBondContact O-N 3.18Å
271	H	80.5	Confident	83.6	Confident	109 Å²	109	95.3 Å²	95.3	51%	0.505	51%	0.514	S	S	.	.	H	α-helix	trans	-56.4	-49.7	-178.5	-167.6	24.2	0	0	0	114.6	A267 L273 Q274 I275	A267-H271 PolarHBondContact O-N 3.33Å; A267-H271 VanDerWaalsContact O-N 3.16Å; H271-L273 VanDerWaalsContact C-N 3.33Å; H271-L273 PolarHBondContact O-N 3.26Å; H271-Q274 PolarHBondContact O-N 3.45Å; H271-I275 WeakPolarHBondContact O-CG1 3.43Å; H271-I275 PolarHBondContact O-N 3.17Å
272	P	86.8	Confident	83.8	Confident	71 Å²	71	96.6 Å²	96.6	46%	0.461	52%	0.52	S	S	.	.	H	α-helix	trans	-66.2	-32.8	175.5	26.4	-35.4	0	0	0	113	K268 A269 I275 Q276	K268-P272 VanDerWaalsContact O-CD 3.24Å; K268-P272 WeakPolarHBondContact O-CD 3.49Å; A269-P272 WeakPolarHBondContact O-CD 3.5Å; A269-P272 WeakPolarHBondContact O-CG 3.39Å; P272-I275 PolarHBondContact O-N 3.45Å; P272-Q276 WeakPolarHBondContact O-CG 3.48Å; P272-Q276 PolarHBondContact O-N 2.95Å
273	L	81.8	Confident	84.1	Confident	103 Å²	103	96.1 Å²	96.1	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-39.8	175	-93.8	154.2	0	0	0	112	L270 H271 Q276 L277	L270-L273 WeakPolarHBondContact O-CB 3.08Å; L270-L273 PolarHBondContact O-N 2.95Å; H271-L273 VanDerWaalsContact C-N 3.33Å; H271-L273 PolarHBondContact O-N 3.26Å; L273-Q276 PolarHBondContact O-N 3.23Å; L273-L277 WeakPolarHBondContact O-CB 3.5Å; L273-L277 PolarHBondContact O-N 3.32Å
274	Q	81.8	Confident	84.5	Confident	125 Å²	125	95.3 Å²	95.3	58%	0.584	52%	0.519	S	S	*	.	H	α-helix	trans	-65.6	-37.7	174.4	-72.5	179.1	-14	0	0	112.3	L270 H271 L277 A278	L270-Q274 WeakPolarHBondContact O-CG 3.24Å; L270-Q274 PolarHBondContact O-N 3.18Å; H271-Q274 PolarHBondContact O-N 3.45Å; Q274-L277 PolarHBondContact O-N 2.96Å; Q274-A278 WeakPolarHBondContact O-CB 3.47Å; Q274-A278 PolarHBondContact O-N 2.9Å
275	I	84	Confident	84.8	Confident	79 Å²	79	93.1 Å²	93.1	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-47.4	175.4	-64.5	166.3	0	0	0	110.2	H271 P272 L277 A278 E279	H271-I275 WeakPolarHBondContact O-CG1 3.43Å; H271-I275 PolarHBondContact O-N 3.17Å; P272-I275 PolarHBondContact O-N 3.45Å; I275-L277 PolarHBondContact O-N 3.43Å; I275-A278 WeakPolarHBondContact O-CB 3.26Å; I275-A278 PolarHBondContact O-N 3.04Å; I275-A278 VanDerWaalsContact O-N 3.17Å; I275-E279 WeakPolarHBondContact O-CG 3.46Å; I275-E279 PolarHBondContact O-N 3.49Å
276	Q	85.6	Confident	85	Confident	109 Å²	109	95.1 Å²	95.1	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-39.3	176.9	-73.2	-177.8	-11.8	0	0	112.8	P272 L273 A278 E279 I280	P272-Q276 WeakPolarHBondContact O-CG 3.48Å; P272-Q276 PolarHBondContact O-N 2.95Å; L273-Q276 PolarHBondContact O-N 3.23Å; Q276-A278 VanDerWaalsContact C-N 3.32Å; Q276-A278 PolarHBondContact O-N 2.91Å; Q276-E279 PolarHBondContact O-N 3.39Å; Q276-I280 WeakPolarHBondContact O-CB 3.44Å; Q276-I280 VanDerWaalsContact O-CG1 3.26Å; Q276-I280 WeakPolarHBondContact O-CG1 3.35Å; Q276-I280 PolarHBondContact O-N 3.48Å
277	L	83	Confident	85.6	Confident	123 Å²	123	93.7 Å²	93.7	64%	0.644	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-40	174.8	-126.2	74.5	0	0	0	111.6	L273 Q274 I275 S281	L273-L277 WeakPolarHBondContact O-CB 3.5Å; L273-L277 PolarHBondContact O-N 3.32Å; Q274-L277 PolarHBondContact O-N 2.96Å; I275-L277 PolarHBondContact O-N 3.43Å; L277-S281 WeakPolarHBondContact O-CB 3.5Å; L277-S281 PolarHBondContact O-N 2.95Å; L277-S281 PolarHBondContact O-OG 3.08Å; L277-S281 VanDerWaalsContact O-OG 3.08Å
278	A	84.4	Confident	86.1	Confident	53 Å²	53	95.8 Å²	95.8	44%	0.438	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-48.4	174.3	0	0	0	0	0	111.2	Q274 I275 Q276 I280 S281 T282	Q274-A278 WeakPolarHBondContact O-CB 3.47Å; Q274-A278 PolarHBondContact O-N 2.9Å; I275-A278 WeakPolarHBondContact O-CB 3.26Å; I275-A278 PolarHBondContact O-N 3.04Å; I275-A278 VanDerWaalsContact O-N 3.17Å; Q276-A278 VanDerWaalsContact C-N 3.32Å; Q276-A278 PolarHBondContact O-N 2.91Å; A278-I280 PolarHBondContact O-N 3.46Å; A278-S281 WeakPolarHBondContact CA-OG 3.49Å; A278-S281 PolarHBondContact O-N 3.01Å; A278-S281 PolarHBondContact O-OG 2.79Å; A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.24Å; A278-T282 PolarHBondContact O-OG1 2.89Å
279	E	88	Confident	86.5	Confident	119 Å²	119	92.2 Å²	92.2	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-57.3	-51.1	176.5	-72.3	175	-179.6	0	0	112.1	I275 Q276 S281 T282 A283	I275-E279 WeakPolarHBondContact O-CG 3.46Å; I275-E279 PolarHBondContact O-N 3.49Å; Q276-E279 PolarHBondContact O-N 3.39Å; E279-S281 PolarHBondContact O-N 3.42Å; E279-T282 PolarHBondContact O-N 2.91Å; E279-T282 PolarHBondContact O-OG1 2.81Å; E279-A283 PolarHBondContact O-N 3.36Å
280	I	86.5	Confident	87	Confident	97 Å²	97	95.8 Å²	95.8	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-42.5	178.9	-66.9	165.2	0	0	0	111.3	Q276 A278 T282 A283 N284	Q276-I280 WeakPolarHBondContact O-CB 3.44Å; Q276-I280 VanDerWaalsContact O-CG1 3.26Å; Q276-I280 WeakPolarHBondContact O-CG1 3.35Å; Q276-I280 PolarHBondContact O-N 3.48Å; A278-I280 PolarHBondContact O-N 3.46Å; I280-T282 VanDerWaalsContact C-N 3.35Å; I280-T282 PolarHBondContact O-N 3.48Å; I280-A283 PolarHBondContact O-N 3.18Å; I280-N284 PolarHBondContact O-N 2.97Å
281	S	87.8	Confident	87.5	Confident	70 Å²	70	96.5 Å²	96.5	49%	0.49	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-38.2	176.5	64.8	0	0	0	0	112.6	L277 A278 E279 A285	L277-S281 WeakPolarHBondContact O-CB 3.5Å; L277-S281 PolarHBondContact O-N 2.95Å; L277-S281 PolarHBondContact O-OG 3.08Å; L277-S281 VanDerWaalsContact O-OG 3.08Å; A278-S281 WeakPolarHBondContact CA-OG 3.49Å; A278-S281 PolarHBondContact O-N 3.01Å; A278-S281 PolarHBondContact O-OG 2.79Å; E279-S281 PolarHBondContact O-N 3.42Å; S281-A285 WeakPolarHBondContact O-CB 3.41Å; S281-A285 PolarHBondContact O-N 3.31Å
282	T	88.9	Confident	87.9	Confident	77 Å²	77	94.6 Å²	94.6	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-70.9	-31.1	174.3	62.8	0	0	0	0	113.2	A278 E279 I280 R286	A278-T282 WeakPolarHBondContact O-CG2 3.38Å; A278-T282 PolarHBondContact O-N 3.24Å; A278-T282 PolarHBondContact O-OG1 2.89Å; E279-T282 PolarHBondContact O-N 2.91Å; E279-T282 PolarHBondContact O-OG1 2.81Å; I280-T282 VanDerWaalsContact C-N 3.35Å; I280-T282 PolarHBondContact O-N 3.48Å; T282-R286 WeakPolarHBondContact O-CG 3.35Å; T282-R286 PolarHBondContact O-N 3.47Å
283	A	88.4	Confident	88.1	Confident	53 Å²	53	95.7 Å²	95.7	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-69.1	-47	174.5	0	0	0	0	0	111.4	E279 I280 A285 R286 L287	E279-A283 PolarHBondContact O-N 3.36Å; I280-A283 PolarHBondContact O-N 3.18Å; A283-A285 PolarHBondContact O-N 3.19Å; A283-R286 PolarHBondContact O-N 3.07Å; A283-L287 PolarHBondContact O-N 3.25Å
284	N	91.1	Very high	88.4	Confident	89 Å²	89	92.8 Å²	92.8	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-60.8	-44	175.2	-74.9	6.2	0	0	0	111.6	I280 R286 L287 D288	I280-N284 PolarHBondContact O-N 2.97Å; N284-R286 PolarHBondContact O-N 2.91Å; N284-L287 WeakPolarHBondContact O-CB 3.38Å; N284-L287 PolarHBondContact O-N 3.31Å; N284-L287 VanDerWaalsContact O-N 3.07Å; N284-D288 PolarHBondContact O-N 3.24Å
285	A	89.1	Confident	88.7	Confident	55 Å²	55	89.7 Å²	89.7	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-30.1	177.4	0	0	0	0	0	113.4	S281 A283 V289	S281-A285 WeakPolarHBondContact O-CB 3.41Å; S281-A285 PolarHBondContact O-N 3.31Å; A283-A285 PolarHBondContact O-N 3.19Å; A285-V289 WeakPolarHBondContact O-CG2 3.42Å; A285-V289 PolarHBondContact O-N 3.02Å
286	R	91.4	Very high	89	Confident	181 Å²	181	90.7 Å²	90.7	68%	0.683	50%	0.504	S	S	*	.	H	α-helix	trans	-74.6	-41.9	172	-71.1	173.8	-174.7	-179.9	3.8	111.9	T282 A283 N284 D288 V289 E290	T282-R286 WeakPolarHBondContact O-CG 3.35Å; T282-R286 PolarHBondContact O-N 3.47Å; A283-R286 PolarHBondContact O-N 3.07Å; N284-R286 PolarHBondContact O-N 2.91Å; R286-D288 VanDerWaalsContact C-N 3.33Å; R286-D288 PolarHBondContact O-N 2.86Å; R286-V289 PolarHBondContact O-N 3.49Å; R286-E290 PolarHBondContact O-N 3.38Å
287	L	91.5	Very high	89.2	Confident	94 Å²	94	91.2 Å²	91.2	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-42.6	177.3	-166.1	84.2	0	0	0	111.6	A283 N284 V289 E290 L291	A283-L287 PolarHBondContact O-N 3.25Å; N284-L287 WeakPolarHBondContact O-CB 3.38Å; N284-L287 PolarHBondContact O-N 3.31Å; N284-L287 VanDerWaalsContact O-N 3.07Å; L287-V289 VanDerWaalsContact C-N 3.31Å; L287-V289 PolarHBondContact O-N 2.98Å; L287-E290 PolarHBondContact O-N 2.95Å; L287-L291 HydrophobicContact CD2-CD1 4.24Å; L287-L291 HydrophobicContact CG-CD1 4.14Å; L287-L291 WeakPolarHBondContact O-CB 3.49Å; L287-L291 WeakPolarHBondContact O-CG 3.36Å; L287-L291 PolarHBondContact O-N 3.46Å
288	D	90.7	Very high	89.4	Confident	105 Å²	105	90.2 Å²	90.2	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-38.3	176.9	-72.6	-26.4	0	0	0	111.7	N284 R286 S292	N284-D288 PolarHBondContact O-N 3.24Å; R286-D288 VanDerWaalsContact C-N 3.33Å; R286-D288 PolarHBondContact O-N 2.86Å; D288-S292 WeakPolarHBondContact O-CB 3.45Å; D288-S292 PolarHBondContact O-N 2.9Å; D288-S292 PolarHBondContact O-OG 3.44Å
289	V	91.6	Very high	89.5	Confident	80 Å²	80	94.9 Å²	94.9	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-49.6	173.9	172.5	0	0	0	0	110.9	A285 R286 L287 L291 S292 E293	A285-V289 WeakPolarHBondContact O-CG2 3.42Å; A285-V289 PolarHBondContact O-N 3.02Å; R286-V289 PolarHBondContact O-N 3.49Å; L287-V289 VanDerWaalsContact C-N 3.31Å; L287-V289 PolarHBondContact O-N 2.98Å; V289-L291 VanDerWaalsContact C-N 3.32Å; V289-L291 PolarHBondContact O-N 3.2Å; V289-S292 PolarHBondContact O-N 2.97Å; V289-S292 VanDerWaalsContact O-N 3.13Å; V289-S292 PolarHBondContact O-OG 3.43Å; V289-E293 PolarHBondContact O-N 3.13Å
290	E	91.9	Very high	89.5	Confident	131 Å²	131	95.2 Å²	95.2	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-40.1	177.4	-71.2	-178.8	-173.6	0	0	112.6	R286 L287 E293 A294	R286-E290 PolarHBondContact O-N 3.38Å; L287-E290 PolarHBondContact O-N 2.95Å; E290-E293 PolarHBondContact O-N 2.72Å; E290-A294 WeakPolarHBondContact O-CB 3.48Å; E290-A294 PolarHBondContact O-N 2.93Å
291	L	91.8	Very high	89.4	Confident	103 Å²	103	97.2 Å²	97.2	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-42.9	173.7	-85.6	163.1	0	0	0	111.9	L287 V289 A294 A295	L287-L291 HydrophobicContact CD2-CD1 4.24Å; L287-L291 HydrophobicContact CG-CD1 4.14Å; L287-L291 WeakPolarHBondContact O-CB 3.49Å; L287-L291 WeakPolarHBondContact O-CG 3.36Å; L287-L291 PolarHBondContact O-N 3.46Å; V289-L291 VanDerWaalsContact C-N 3.32Å; V289-L291 PolarHBondContact O-N 3.2Å; L291-A294 PolarHBondContact O-N 3.43Å; L291-A295 WeakPolarHBondContact O-CB 3.35Å; L291-A295 PolarHBondContact O-N 2.94Å
292	S	90	Very high	89.2	Confident	69 Å²	69	99.7 Å²	99.7	48%	0.483	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-40.7	176.8	71.3	0	0	0	0	112.7	D288 V289 A295 E296	D288-S292 WeakPolarHBondContact O-CB 3.45Å; D288-S292 PolarHBondContact O-N 2.9Å; D288-S292 PolarHBondContact O-OG 3.44Å; V289-S292 PolarHBondContact O-N 2.97Å; V289-S292 VanDerWaalsContact O-N 3.13Å; V289-S292 PolarHBondContact O-OG 3.43Å; S292-A295 PolarHBondContact O-N 3.32Å; S292-E296 WeakPolarHBondContact O-CB 3.36Å; S292-E296 PolarHBondContact O-N 3.43Å
293	E	91.3	Very high	88.9	Confident	94 Å²	94	101.5 Å²	101.5	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-40.3	173.4	-78.7	-163.7	-162.6	0	0	112.6	V289 E290 E296 K297	V289-E293 PolarHBondContact O-N 3.13Å; E290-E293 PolarHBondContact O-N 2.72Å; E293-E296 PolarHBondContact O-N 3.36Å; E293-K297 WeakPolarHBondContact O-CD 3.37Å; E293-K297 VanDerWaalsContact O-CG 3.3Å; E293-K297 WeakPolarHBondContact O-CG 3.38Å; E293-K297 PolarHBondContact O-N 3.4Å; E293-K297 IonicContact OE2-NZ 2.64Å; E293-K297 PolarHBondContact OE2-NZ 2.89Å
294	A	87.7	Confident	88.3	Confident	43 Å²	43	103.1 Å²	103.1	36%	0.355	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-43.2	177.7	0	0	0	0	0	111.1	E290 L291 K297 I298	E290-A294 WeakPolarHBondContact O-CB 3.48Å; E290-A294 PolarHBondContact O-N 2.93Å; L291-A294 PolarHBondContact O-N 3.43Å; A294-K297 PolarHBondContact O-N 2.61Å; A294-I298 WeakPolarHBondContact O-CG1 3.49Å; A294-I298 PolarHBondContact O-N 2.93Å
295	A	88.5	Confident	86.7	Confident	59 Å²	59	109.9 Å²	109.9	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-61.2	-42.1	173.5	0	0	0	0	0	111.9	L291 S292 I298 Y299	L291-A295 WeakPolarHBondContact O-CB 3.35Å; L291-A295 PolarHBondContact O-N 2.94Å; S292-A295 PolarHBondContact O-N 3.32Å; A295-I298 PolarHBondContact O-N 3.39Å; A295-Y299 WeakPolarHBondContact O-CB 3.3Å; A295-Y299 PolarHBondContact O-N 3.35Å
296	E	90.3	Very high	86.6	Confident	101 Å²	101	112.7 Å²	112.7	47%	0.472	57%	0.567	S	S	.	*	H	α-helix	trans	-63.9	-40.5	176.4	-163.2	-167.1	166.1	0	0	112.1	S292 E293 Y299 K300	S292-E296 WeakPolarHBondContact O-CB 3.36Å; S292-E296 PolarHBondContact O-N 3.43Å; E293-E296 PolarHBondContact O-N 3.36Å; E296-Y299 PolarHBondContact O-N 2.91Å; E296-K300 HydrophobicContact CG-CD 4.48Å; E296-K300 WeakPolarHBondContact O-CB 3.35Å; E296-K300 WeakPolarHBondContact O-CG 3.06Å; E296-K300 PolarHBondContact O-N 2.98Å; E296-K300 WeakPolarHBondContact OE1-CE 3.5Å; E296-K300 IonicContact OE1-NZ 2.61Å; E296-K300 PolarHBondContact OE1-NZ 3.03Å
297	K	88.6	Confident	86.4	Confident	120 Å²	120	109.1 Å²	109.1	52%	0.522	56%	0.561	S	S	.	*	H	α-helix	trans	-62.5	-43.4	175.2	-73.4	161.6	-170.7	149.9	0	111.8	E293 A294 H301	E293-K297 WeakPolarHBondContact O-CD 3.37Å; E293-K297 VanDerWaalsContact O-CG 3.3Å; E293-K297 WeakPolarHBondContact O-CG 3.38Å; E293-K297 PolarHBondContact O-N 3.4Å; E293-K297 IonicContact OE2-NZ 2.64Å; E293-K297 PolarHBondContact OE2-NZ 2.89Å; A294-K297 PolarHBondContact O-N 2.61Å; K297-H301 PolarHBondContact O-N 3.06Å; K297-H301 VanDerWaalsContact O-N 3.15Å
298	I	87.8	Confident	86.1	Confident	102 Å²	102	109.9 Å²	109.9	52%	0.523	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-44.5	176.1	-66.4	165.9	0	0	0	110.6	A294 A295 K300 H301 M302	A294-I298 WeakPolarHBondContact O-CG1 3.49Å; A294-I298 PolarHBondContact O-N 2.93Å; A295-I298 PolarHBondContact O-N 3.39Å; I298-K300 PolarHBondContact O-N 3.19Å; I298-H301 PolarHBondContact O-N 3.01Å; I298-M302 HydrophobicContact CG2-CE 4.19Å; I298-M302 HydrophobicContact CG2-CG 4.48Å; I298-M302 HydrophobicContact CG2-SD 4.34Å; I298-M302 WeakPolarHBondContact O-CG 3.46Å; I298-M302 PolarHBondContact O-N 3.46Å
299	Y	87.2	Confident	85.8	Confident	150 Å²	150	110.2 Å²	110.2	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-61.8	-43	178.5	-162.9	-81.7	0	0	0	112	A295 E296 H301 M302 N303	A295-Y299 WeakPolarHBondContact O-CB 3.3Å; A295-Y299 PolarHBondContact O-N 3.35Å; E296-Y299 PolarHBondContact O-N 2.91Å; Y299-H301 VanDerWaalsContact C-N 3.31Å; Y299-H301 PolarHBondContact O-N 3.39Å; Y299-M302 HydrophobicContact CD2-CE 4.41Å; Y299-M302 PolarHBondContact O-N 3.15Å; Y299-N303 HydrophobicContact CE1-CB 4.38Å; Y299-N303 VanDerWaalsContact O-CB 3.31Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.42Å
300	K	87.6	Confident	85.5	Confident	126 Å²	126	112.1 Å²	112.1	55%	0.548	57%	0.57	S	S	.	*	H	α-helix	trans	-60.7	-38.1	174.5	-77.2	173.5	-176.9	165.8	0	112.7	E296 I298 S304	E296-K300 HydrophobicContact CG-CD 4.48Å; E296-K300 WeakPolarHBondContact O-CB 3.35Å; E296-K300 WeakPolarHBondContact O-CG 3.06Å; E296-K300 PolarHBondContact O-N 2.98Å; E296-K300 WeakPolarHBondContact OE1-CE 3.5Å; E296-K300 IonicContact OE1-NZ 2.61Å; E296-K300 PolarHBondContact OE1-NZ 3.03Å; I298-K300 PolarHBondContact O-N 3.19Å; K300-S304 WeakPolarHBondContact O-CB 3.31Å; K300-S304 PolarHBondContact O-N 3.43Å; K300-S304 PolarHBondContact O-OG 3.29Å
301	H	83.3	Confident	85	Confident	140 Å²	140	110.8 Å²	110.8	65%	0.648	57%	0.567	S	S	*	*	H	α-helix	trans	-65.5	-52.6	174.9	-101.5	-61.7	0	0	0	112	K297 I298 Y299 N303 S304	K297-H301 PolarHBondContact O-N 3.06Å; K297-H301 VanDerWaalsContact O-N 3.15Å; I298-H301 PolarHBondContact O-N 3.01Å; Y299-H301 VanDerWaalsContact C-N 3.31Å; Y299-H301 PolarHBondContact O-N 3.39Å; H301-N303 PolarHBondContact O-N 3.07Å; H301-S304 PolarHBondContact O-N 3.18Å; H301-S304 PolarHBondContact O-OG 2.75Å
302	M	84.4	Confident	84.6	Confident	121 Å²	121	111.4 Å²	111.4	60%	0.596	57%	0.569	S	S	*	*	H	α-helix	trans	-61.3	-27.3	-179.1	-66.6	-172.2	-55.7	0	0	113.6	I298 Y299 S304	I298-M302 HydrophobicContact CG2-CE 4.19Å; I298-M302 HydrophobicContact CG2-CG 4.48Å; I298-M302 HydrophobicContact CG2-SD 4.34Å; I298-M302 WeakPolarHBondContact O-CG 3.46Å; I298-M302 PolarHBondContact O-N 3.46Å; Y299-M302 HydrophobicContact CD2-CE 4.41Å; Y299-M302 PolarHBondContact O-N 3.15Å; M302-S304 VanDerWaalsContact C-N 3.34Å
303	N	82	Confident	84.1	Confident	115 Å²	115	114.6 Å²	114.6	62%	0.615	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	10.4	-178.6	-143.3	96.2	0	0	0	112.9	Y299 H301	Y299-N303 HydrophobicContact CE1-CB 4.38Å; Y299-N303 VanDerWaalsContact O-CB 3.31Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.42Å; H301-N303 PolarHBondContact O-N 3.07Å
304	S	76.3	Confident	83.5	Confident	88 Å²	88	116.3 Å²	116.3	62%	0.615	59%	0.587	S	S	*	*			trans	-114.7	-4.6	175.5	68.8	0	0	0	0	114.1	K300 H301 M302	K300-S304 WeakPolarHBondContact O-CB 3.31Å; K300-S304 PolarHBondContact O-N 3.43Å; K300-S304 PolarHBondContact O-OG 3.29Å; H301-S304 PolarHBondContact O-N 3.18Å; H301-S304 PolarHBondContact O-OG 2.75Å; M302-S304 VanDerWaalsContact C-N 3.34Å
305	E	58.8	Low	83.2	Confident	231 Å²	231	123 Å²	123	100%	1.079	61%	0.609	S	S	*	*			trans	-94.4	0	163.2	-67	-173	134.9	0	0	110.6

Retrieved 305 of 305 residues in 365.1 ms (Link to these results)

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