A0A077Z859_TRITR Loading...

SprT-like domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z859, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 303 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	49.9	Very low	43.6	Very low	252 Å²	252	154.7 Å²	154.7	100%	1.241	84%	0.837	S	S	*	*				0	128.1	0	-77.9	171.4	165.5	0	0	108.1
2	Q	39.9	Very low	44.1	Very low	188 Å²	188	155.8 Å²	155.8	88%	0.879	83%	0.832	S	S	*	*			trans	-87.3	143.6	-164.9	-69.3	168.2	-10.2	0	0	112.7
3	R	42.2	Very low	44.7	Very low	230 Å²	230	150.7 Å²	150.7	87%	0.868	81%	0.805	S	S	*	*			trans	63.6	154.8	135.8	-90.7	-165.2	168.2	-145.7	-1.1	120.6
4	P	44.1	Very low	44.8	Very low	94 Å²	94	145.9 Å²	145.9	61%	0.61	79%	0.789	S	S	*	*				-143.9	174.3	-53	33.2	-11.8	0	0	0	113.2
5	T	40.4	Very low	45.1	Very low	134 Å²	134	143.2 Å²	143.2	82%	0.822	78%	0.779	S	S	*	*			trans	-63.2	133.8	159.8	49.9	0	0	0	0	111.9
6	N	44.3	Very low	45.5	Very low	168 Å²	168	138.6 Å²	138.6	90%	0.898	76%	0.757	S	S	*	*			trans	-106.2	117.3	158.7	-98.2	-11.7	0	0	0	108.4
7	G	41	Very low	46.4	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	74%	0.737	S	S	*	*			trans	-82	172.9	-172.5	0	0	0	0	0	114.8
8	E	39.7	Very low	47.5	Very low	189 Å²	189	130.2 Å²	130.2	88%	0.883	73%	0.725	S	S	*	*			trans	-58.2	135.5	-175.6	-64.5	147.5	138	0	0	113.5
9	N	40.7	Very low	48.8	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	71%	0.712	S	S	*	*			trans	-161.3	98.5	156.1	-95.6	-22.1	0	0	0	107.1
10	S	47.6	Very low	50	Low	105 Å²	105	124.7 Å²	124.7	73%	0.734	68%	0.683	S	S	*	*			trans	-158.5	2.8	172.3	56.4	0	0	0	0	119.3
11	T	50.2	Low	51.4	Low	116 Å²	116	123.6 Å²	123.6	71%	0.712	67%	0.673	S	S	*	*	S	Bend	trans	-111.9	-31.9	-176.1	48.7	0	0	0	0	115.9
12	E	49.2	Very low	52.7	Low	168 Å²	168	115.4 Å²	115.4	79%	0.785	64%	0.637	S	S	*	*	S	Bend	trans	-78.2	-27.7	-178.7	-68.4	-164.8	156.4	0	0	114	S14	E12-S14 VanDerWaalsContact C-N 3.29Å; E12-S14 PolarHBondContact O-N 3.49Å
13	D	52.5	Low	54.6	Low	89 Å²	89	109.7 Å²	109.7	48%	0.476	62%	0.616	S	S	.	*	H	α-helix	trans	-69.3	-25.9	-179.9	-76.7	-36.5	0	0	0	113.2	V15 A17 K130	D13-V15 PolarHBondContact O-N 3.35Å; D13-A17 PolarHBondContact O-N 3.23Å; D13-K130 IonicContact OD1-NZ 2.66Å; D13-K130 PolarHBondContact OD1-NZ 2.77Å
14	S	46.1	Very low	56.3	Low	84 Å²	84	101 Å²	101	59%	0.587	59%	0.586	S	S	*	*	H	α-helix	trans	-70.8	-31.5	-176.2	-172.4	0	0	0	0	113.2	E12 S18	E12-S14 VanDerWaalsContact C-N 3.29Å; E12-S14 PolarHBondContact O-N 3.49Å; S14-S18 PolarHBondContact O-N 3.47Å
15	V	49	Very low	57.7	Low	105 Å²	105	102.4 Å²	102.4	64%	0.636	60%	0.595	S	S	*	*	H	α-helix	trans	-78.6	-38.5	-175	-176.7	0	0	0	0	110.8	D13 A17 S18	D13-V15 PolarHBondContact O-N 3.35Å; V15-A17 VanDerWaalsContact C-N 3.27Å; V15-A17 PolarHBondContact O-N 3.29Å; V15-S18 PolarHBondContact O-N 3.33Å
16	V	50.7	Low	59.6	Low	70 Å²	70	102.4 Å²	102.4	42%	0.424	59%	0.59	S	S	.	*	H	α-helix	trans	-67.6	-30.7	175.3	-176.9	0	0	0	0	111	W19	V16-W19 PolarHBondContact O-NE1 3.47Å
17	A	61.7	Low	61.5	Low	50 Å²	50	95.6 Å²	95.6	41%	0.413	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-39.9	172.8	0	0	0	0	0	112.1	D13 V15 W19 L20 E21	D13-A17 PolarHBondContact O-N 3.23Å; V15-A17 VanDerWaalsContact C-N 3.27Å; V15-A17 PolarHBondContact O-N 3.29Å; A17-W19 PolarHBondContact O-N 2.66Å; A17-L20 PolarHBondContact O-N 3.37Å; A17-E21 WeakPolarHBondContact O-CG 3.43Å; A17-E21 PolarHBondContact O-N 3.4Å
18	S	65.3	Low	63.9	Low	76 Å²	76	96.4 Å²	96.4	53%	0.531	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-38.1	-171.1	-170.9	0	0	0	0	114.6	S14 V15 E21 T22	S14-S18 PolarHBondContact O-N 3.47Å; V15-S18 PolarHBondContact O-N 3.33Å; S18-E21 PolarHBondContact O-N 3.22Å; S18-T22 PolarHBondContact O-N 3.44Å; S18-T22 PolarHBondContact O-OG1 3.47Å
19	W	72.1	Confident	66.6	Low	123 Å²	123	87.6 Å²	87.6	47%	0.466	50%	0.502	S	S	.	.	H	α-helix	trans	-76.6	-25.8	-179.2	72.6	-80.6	0	0	0	112.5	V16 A17 E21 T22	V16-W19 PolarHBondContact O-NE1 3.47Å; A17-W19 PolarHBondContact O-N 2.66Å; W19-E21 VanDerWaalsContact C-N 3.31Å; W19-T22 PolarHBondContact O-N 3.44Å
20	L	73.9	Confident	69.2	Low	27 Å²	27	85.2 Å²	85.2	14%	0.141	49%	0.486	C	S	.	.	H	α-helix	trans	-70.2	-30.1	173.2	-72.9	174.6	0	0	0	112.2	A17 T22 R86 K87	A17-L20 PolarHBondContact O-N 3.37Å; L20-T22 VanDerWaalsContact C-N 3.3Å; L20-R86 PolarHBondContact O-N 3.02Å; L20-K87 HydrophobicContact CB-CB 4.23Å; L20-K87 PolarHBondContact O-N 3.14Å
21	E	78.6	Confident	71.4	Confident	101 Å²	101	82 Å²	82	47%	0.472	47%	0.465	S	S	.	.	S	Bend	trans	-80.7	-9.4	175.2	-64.1	-59.9	153.9	0	0	113.2	A17 S18 W19 K87	A17-E21 WeakPolarHBondContact O-CG 3.43Å; A17-E21 PolarHBondContact O-N 3.4Å; S18-E21 PolarHBondContact O-N 3.22Å; W19-E21 VanDerWaalsContact C-N 3.31Å; E21-K87 WeakPolarHBondContact OE1-CD 3.28Å; E21-K87 IonicContact OE1-NZ 2.78Å; E21-K87 PolarHBondContact OE1-NZ 3.32Å; E21-K87 IonicContact OE2-NZ 2.73Å; E21-K87 PolarHBondContact OE2-NZ 2.97Å
22	T	78.2	Confident	73.6	Confident	80 Å²	80	76.7 Å²	76.7	49%	0.491	43%	0.432	S	S	.	.	S	Bend	trans	-87.5	143	177.3	-54.2	0	0	0	0	110.8	S18 W19 L20 D24 R86	S18-T22 PolarHBondContact O-N 3.44Å; S18-T22 PolarHBondContact O-OG1 3.47Å; W19-T22 PolarHBondContact O-N 3.44Å; L20-T22 VanDerWaalsContact C-N 3.3Å; T22-D24 PolarHBondContact O-N 3.36Å; T22-R86 WeakPolarHBondContact O-CB 3.46Å; T22-R86 PolarHBondContact O-N 3.36Å
23	V	78.5	Confident	75.9	Confident	69 Å²	69	69.2 Å²	69.2	42%	0.418	40%	0.397	S	S	.	.			trans	-71.9	125.1	171.2	179.6	0	0	0	0	108.9	P25	V23-P25 WeakPolarHBondContact O-CD 3.35Å
24	D	78.7	Confident	77.9	Confident	46 Å²	46	68.9 Å²	68.9	25%	0.246	40%	0.401	C	S	.	.			trans	-83.7	115	167.9	-175.8	-12.4	0	0	0	108.6	T22 N26 P27 R86	T22-D24 PolarHBondContact O-N 3.36Å; D24-N26 PolarHBondContact O-N 3.17Å; D24-N26 VanDerWaalsContact OD1-C 3.3Å; D24-N26 PolarHBondContact OD1-N 3.45Å; D24-P27 HydrophobicContact CB-CB 4.44Å; D24-P27 WeakPolarHBondContact O-CD 3.39Å; D24-P27 WeakPolarHBondContact OD2-CA 3.44Å; D24-R86 IonicContact OD2-CZ 3.63Å; D24-R86 IonicContact OD2-NH1 2.76Å; D24-R86 PolarHBondContact OD2-NH1 3.29Å
25	P	74.3	Confident	80.3	Confident	124 Å²	124	70.5 Å²	70.5	81%	0.805	40%	0.399	S	S	*	.	S	Bend	trans	-69.1	-19.6	-178.6	28.4	-35	0	0	0	113.3	V23	V23-P25 WeakPolarHBondContact O-CD 3.35Å
26	N	79.1	Confident	82.6	Confident	135 Å²	135	66.6 Å²	66.6	72%	0.722	37%	0.374	S	S	*	.	S	Bend	trans	-144.1	69.9	-179.5	-172.2	50.3	0	0	0	111.8	D24 D28	D24-N26 PolarHBondContact O-N 3.17Å; D24-N26 VanDerWaalsContact OD1-C 3.3Å; D24-N26 PolarHBondContact OD1-N 3.45Å; N26-D28 PolarHBondContact O-N 3.32Å
27	P	84.9	Confident	84.9	Confident	24 Å²	24	63.8 Å²	63.8	16%	0.156	36%	0.356	C	S	.	.			trans	-67.4	120.2	-178.3	26.6	-33.8	0	0	0	111.6	D24 I29 W52 L89	D24-P27 HydrophobicContact CB-CB 4.44Å; D24-P27 WeakPolarHBondContact O-CD 3.39Å; D24-P27 WeakPolarHBondContact OD2-CA 3.44Å; P27-I29 PolarHBondContact O-N 2.8Å; P27-I29 VanDerWaalsContact O-N 3.15Å; P27-W52 HydrophobicContact CG-CH2 4.5Å; P27-W52 HydrophobicContact CG-CZ2 3.82Å; P27-L89 HydrophobicContact CB-CD2 3.3Å; P27-L89 HydrophobicContact CG-CD2 3.91Å
28	D	92	Very high	86.6	Confident	88 Å²	88	65 Å²	65	47%	0.471	37%	0.366	S	S	.	.			trans	-80.9	90.9	169.1	-170.6	-15.3	0	0	0	110.4	N26 H30 A31 L32	N26-D28 PolarHBondContact O-N 3.32Å; D28-H30 PolarHBondContact O-N 3.04Å; D28-H30 WeakPolarHBondContact OD1-CB 3.27Å; D28-H30 PolarHBondContact OD1-N 3.02Å; D28-A31 HydrophobicContact CB-CB 3.93Å; D28-A31 VanDerWaalsContact CG-CB 3.46Å; D28-A31 PolarHBondContact O-N 3.46Å; D28-A31 PolarHBondContact OD1-N 3.32Å; D28-A31 WeakPolarHBondContact OD2-CB 3.28Å; D28-L32 WeakPolarHBondContact O-CG 3.26Å; D28-L32 PolarHBondContact O-N 3.36Å; D28-L32 VanDerWaalsContact O-N 3.07Å
29	I	94.5	Very high	88.1	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-26.4	178.6	57.7	167.6	0	0	0	113.1	P27 F33 V50 W52 L76 L89	P27-I29 PolarHBondContact O-N 2.8Å; P27-I29 VanDerWaalsContact O-N 3.15Å; I29-F33 VanDerWaalsContact O-CB 3.23Å; I29-F33 WeakPolarHBondContact O-CB 3.45Å; I29-F33 PolarHBondContact O-N 3.04Å; I29-V50 HydrophobicContact CD1-CG2 4.27Å; I29-W52 VanDerWaalsContact CD1-CD1 3.49Å; I29-W52 HydrophobicContact CD1-CD2 4.1Å; I29-W52 HydrophobicContact CD1-CG 3.87Å; I29-W52 HydrophobicContact CG2-CD2 4.47Å; I29-W52 HydrophobicContact CG2-CH2 4.01Å; I29-W52 HydrophobicContact CG2-CZ2 3.22Å; I29-L76 HydrophobicContact CG2-CD1 4.03Å; I29-L89 HydrophobicContact CG2-CD1 4.19Å; I29-L89 HydrophobicContact CG2-CD2 4.4Å
30	H	95.6	Very high	89.3	Confident	106 Å²	106	60.6 Å²	60.6	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-75.3	-44.5	179.5	-70.5	-74.6	0	0	0	110.1	D28 L32 F33 C34 V50	D28-H30 PolarHBondContact O-N 3.04Å; D28-H30 WeakPolarHBondContact OD1-CB 3.27Å; D28-H30 PolarHBondContact OD1-N 3.02Å; H30-L32 VanDerWaalsContact C-N 3.34Å; H30-L32 PolarHBondContact O-N 3.32Å; H30-F33 PolarHBondContact O-N 3.09Å; H30-C34 PolarHBondContact O-N 2.73Å; H30-C34 PolarHBondContact O-SG 3.44Å; H30-V50 PolarHBondContact CE1-O 3.35Å
31	A	95	Very high	90.4	Very high	36 Å²	36	59.3 Å²	59.3	30%	0.298	35%	0.345	S	S	.	.	H	α-helix	trans	-59.5	-45.8	173.3	0	0	0	0	0	111.4	D28 F33 C34 Q35	D28-A31 HydrophobicContact CB-CB 3.93Å; D28-A31 VanDerWaalsContact CG-CB 3.46Å; D28-A31 PolarHBondContact O-N 3.46Å; D28-A31 PolarHBondContact OD1-N 3.32Å; D28-A31 WeakPolarHBondContact OD2-CB 3.28Å; A31-F33 PolarHBondContact O-N 2.95Å; A31-C34 PolarHBondContact O-N 3.06Å; A31-Q35 WeakPolarHBondContact O-CB 3.41Å; A31-Q35 VanDerWaalsContact O-CG 3.22Å; A31-Q35 WeakPolarHBondContact O-CG 3.2Å; A31-Q35 PolarHBondContact O-N 3.26Å
32	L	95.2	Very high	91.3	Very high	6 Å²	6	61.9 Å²	61.9	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-48.4	175.4	-77.6	176.1	0	0	0	112.2	D28 H30 C34 Q35 F36 L89 L93	D28-L32 WeakPolarHBondContact O-CG 3.26Å; D28-L32 PolarHBondContact O-N 3.36Å; D28-L32 VanDerWaalsContact O-N 3.07Å; H30-L32 VanDerWaalsContact C-N 3.34Å; H30-L32 PolarHBondContact O-N 3.32Å; L32-C34 PolarHBondContact O-N 3.02Å; L32-Q35 PolarHBondContact O-N 2.77Å; L32-F36 HydrophobicContact CB-CE2 4.21Å; L32-F36 HydrophobicContact CD2-CE1 4.37Å; L32-F36 HydrophobicContact CD2-CE2 4.1Å; L32-F36 HydrophobicContact CD2-CZ 3.75Å; L32-F36 WeakPolarHBondContact O-CB 3.48Å; L32-F36 WeakPolarHBondContact O-CD2 3.41Å; L32-F36 WeakPolarHBondContact O-CG 3.26Å; L32-F36 PolarHBondContact O-N 3.07Å; L32-L89 HydrophobicContact CD1-CD2 4.03Å; L32-L89 HydrophobicContact CD1-CG 4.45Å; L32-L93 HydrophobicContact CB-CD2 3.81Å
33	F	97.2	Very high	92.1	Very high	11 Å²	11	60 Å²	60	5%	0.048	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-48.3	178.7	172.5	-96.6	0	0	0	112	I29 H30 A31 Q35 F36 D37 L45 C48 V50 I74 M97	I29-F33 VanDerWaalsContact O-CB 3.23Å; I29-F33 WeakPolarHBondContact O-CB 3.45Å; I29-F33 PolarHBondContact O-N 3.04Å; H30-F33 PolarHBondContact O-N 3.09Å; A31-F33 PolarHBondContact O-N 2.95Å; F33-Q35 PolarHBondContact O-N 2.78Å; F33-F36 PolarHBondContact O-N 2.94Å; F33-D37 WeakPolarHBondContact O-CB 3.42Å; F33-D37 PolarHBondContact O-N 3.25Å; F33-L45 HydrophobicContact CE2-CB 4.17Å; F33-L45 HydrophobicContact CE2-CD1 4.45Å; F33-L45 HydrophobicContact CZ-CB 3.83Å; F33-L45 WeakPolarHBondContact CZ-O 3.46Å; F33-C48 HydrophobicContact CE2-CB 4.44Å; F33-C48 HydrophobicContact CZ-CB 3.97Å; F33-V50 HydrophobicContact CB-CB 4.24Å; F33-V50 HydrophobicContact CB-CG1 3.64Å; F33-V50 HydrophobicContact CD1-CG1 4.27Å; F33-V50 HydrophobicContact CD2-CB 4.17Å; F33-V50 HydrophobicContact CD2-CG1 4.38Å; F33-V50 HydrophobicContact CG-CB 4.14Å; F33-V50 HydrophobicContact CG-CG1 3.84Å; F33-I74 HydrophobicContact CD2-CD1 4.33Å; F33-I74 HydrophobicContact CE2-CD1 3.96Å; F33-M97 HydrophobicContact CD2-CE 3.66Å; F33-M97 HydrophobicContact CD2-CG 4.1Å; F33-M97 HydrophobicContact CD2-SD 3.85Å; F33-M97 HydrophobicContact CE2-CE 3.84Å; F33-M97 HydrophobicContact CE2-CG 4.24Å; F33-M97 HydrophobicContact CE2-SD 4.39Å; F33-M97 HydrophobicContact CG-CE 4.45Å
34	C	96.4	Very high	92.9	Very high	81 Å²	81	64.3 Å²	64.3	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-42.6	178.1	-69.2	0	0	0	0	112.1	H30 A31 L32 A38	H30-C34 PolarHBondContact O-N 2.73Å; H30-C34 PolarHBondContact O-SG 3.44Å; A31-C34 PolarHBondContact O-N 3.06Å; L32-C34 PolarHBondContact O-N 3.02Å; C34-A38 PolarHBondContact O-N 2.93Å
35	Q	96.1	Very high	93.7	Very high	118 Å²	118	62.1 Å²	62.1	55%	0.551	34%	0.344	S	S	*	.	H	α-helix	trans	-62.9	-45.9	177	-73.1	172.3	18.5	0	0	111.5	A31 L32 F33 A38 A39	A31-Q35 WeakPolarHBondContact O-CB 3.41Å; A31-Q35 VanDerWaalsContact O-CG 3.22Å; A31-Q35 WeakPolarHBondContact O-CG 3.2Å; A31-Q35 PolarHBondContact O-N 3.26Å; L32-Q35 PolarHBondContact O-N 2.77Å; F33-Q35 PolarHBondContact O-N 2.78Å; Q35-A38 PolarHBondContact O-N 3.04Å; Q35-A39 VanDerWaalsContact O-CB 3.26Å; Q35-A39 WeakPolarHBondContact O-CB 3.42Å; Q35-A39 PolarHBondContact O-N 3.4Å
36	F	97.8	Very high	94.6	Very high	23 Å²	23	60.1 Å²	60.1	10%	0.101	34%	0.338	C	S	.	.	H	α-helix	trans	-70.7	-35.7	-179.1	-65.2	-19.1	0	0	0	112.9	L32 F33 A39 Y40 F41 V90 L93 L94 M97	L32-F36 HydrophobicContact CB-CE2 4.21Å; L32-F36 HydrophobicContact CD2-CE1 4.37Å; L32-F36 HydrophobicContact CD2-CE2 4.1Å; L32-F36 HydrophobicContact CD2-CZ 3.75Å; L32-F36 WeakPolarHBondContact O-CB 3.48Å; L32-F36 WeakPolarHBondContact O-CD2 3.41Å; L32-F36 WeakPolarHBondContact O-CG 3.26Å; L32-F36 PolarHBondContact O-N 3.07Å; F33-F36 PolarHBondContact O-N 2.94Å; F36-A39 PolarHBondContact O-N 3.33Å; F36-Y40 HydrophobicContact CB-CD2 4.12Å; F36-Y40 HydrophobicContact CD1-CD2 4.12Å; F36-Y40 AromaticContact CD1-CE2 3.74Å; F36-Y40 HydrophobicContact CD1-CE2 3.74Å; F36-Y40 HydrophobicContact CE1-CE2 4.3Å; F36-Y40 HydrophobicContact CG-CD2 4.35Å; F36-Y40 HydrophobicContact CG-CE2 4.39Å; F36-Y40 WeakPolarHBondContact O-CB 3.48Å; F36-Y40 PolarHBondContact O-N 2.88Å; F36-F41 WeakPolarHBondContact O-CD2 3.42Å; F36-V90 HydrophobicContact CE2-CG1 3.97Å; F36-V90 HydrophobicContact CE2-CG2 4.44Å; F36-V90 HydrophobicContact CZ-CB 4.4Å; F36-V90 HydrophobicContact CZ-CG1 3.66Å; F36-V90 HydrophobicContact CZ-CG2 4.11Å; F36-L93 HydrophobicContact CD2-CD2 3.98Å; F36-L93 HydrophobicContact CD2-CG 4.32Å; F36-L93 HydrophobicContact CE2-CD2 4.08Å; F36-L94 HydrophobicContact CB-CD2 3.87Å; F36-L94 HydrophobicContact CD1-CD2 4.37Å; F36-L94 HydrophobicContact CD2-CD2 3.61Å; F36-L94 HydrophobicContact CD2-CG 3.9Å; F36-L94 HydrophobicContact CE2-CD1 4.39Å; F36-L94 HydrophobicContact CE2-CD2 4.21Å; F36-L94 HydrophobicContact CE2-CG 4.03Å; F36-L94 HydrophobicContact CG-CD2 3.71Å; F36-L94 HydrophobicContact CG-CG 4.43Å; F36-M97 HydrophobicContact CB-CE 3.69Å; F36-M97 HydrophobicContact CB-SD 3.78Å; F36-M97 HydrophobicContact CD2-SD 4.16Å
37	D	97.8	Very high	95.1	Very high	11 Å²	11	57.6 Å²	57.6	6%	0.059	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-47.1	174.8	-176.5	30.3	0	0	0	110.7	F33 F41 W42 G43 R44 L45 A46 M97	F33-D37 WeakPolarHBondContact O-CB 3.42Å; F33-D37 PolarHBondContact O-N 3.25Å; D37-F41 CarbonylContact O-C 3.55Å; D37-F41 VanDerWaalsContact O-C 3.23Å; D37-F41 WeakPolarHBondContact O-CA 3.48Å; D37-F41 PolarHBondContact O-N 3.49Å; D37-F41 WeakPolarHBondContact OD1-CB 3.44Å; D37-W42 PolarHBondContact O-N 3.32Å; D37-G43 PolarHBondContact O-N 3.48Å; D37-G43 VanDerWaalsContact O-N 3.12Å; D37-G43 WeakPolarHBondContact OD1-CA 3.19Å; D37-G43 PolarHBondContact OD1-N 3.31Å; D37-G43 WeakPolarHBondContact OD2-CA 3.39Å; D37-R44 PolarHBondContact OD1-N 3.32Å; D37-R44 VanDerWaalsContact OD1-N 3.17Å; D37-L45 HydrophobicContact CB-CB 4.31Å; D37-L45 WeakPolarHBondContact OD1-CB 3.22Å; D37-L45 PolarHBondContact OD1-N 3.06Å; D37-L45 PolarHBondContact OD2-N 3.5Å; D37-A46 PolarHBondContact OD2-N 3.23Å; D37-M97 HydrophobicContact CB-CE 4.1Å
38	A	97.1	Very high	95.6	Very high	75 Å²	75	57 Å²	57	62%	0.62	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-46.6	175.6	0	0	0	0	0	112.2	C34 Q35	C34-A38 PolarHBondContact O-N 2.93Å; Q35-A38 PolarHBondContact O-N 3.04Å
39	A	97	Very high	95.7	Very high	64 Å²	64	57.1 Å²	57.1	53%	0.529	33%	0.329	S	S	.	.	H	α-helix	trans	-73.8	-39.2	-174.3	0	0	0	0	0	113.8	Q35 F36	Q35-A39 VanDerWaalsContact O-CB 3.26Å; Q35-A39 WeakPolarHBondContact O-CB 3.42Å; Q35-A39 PolarHBondContact O-N 3.4Å; F36-A39 PolarHBondContact O-N 3.33Å
40	Y	97.7	Very high	95.8	Very high	43 Å²	43	57 Å²	57	17%	0.169	33%	0.329	C	S	.	.	H	α-helix	trans	-122.5	-15.4	-165.1	-55	-54.5	0	0	0	114.9	F36 L94 R124 I125 A128 A129	F36-Y40 HydrophobicContact CB-CD2 4.12Å; F36-Y40 HydrophobicContact CD1-CD2 4.12Å; F36-Y40 AromaticContact CD1-CE2 3.74Å; F36-Y40 HydrophobicContact CD1-CE2 3.74Å; F36-Y40 HydrophobicContact CE1-CE2 4.3Å; F36-Y40 HydrophobicContact CG-CD2 4.35Å; F36-Y40 HydrophobicContact CG-CE2 4.39Å; F36-Y40 WeakPolarHBondContact O-CB 3.48Å; F36-Y40 PolarHBondContact O-N 2.88Å; Y40-L94 HydrophobicContact CD2-CD2 3.88Å; Y40-L94 HydrophobicContact CE2-CD2 4.35Å; Y40-R124 PolarHBondContact O-NH1 3.42Å; Y40-R124 PolarHBondContact O-NH2 2.92Å; Y40-I125 HydrophobicContact CG-CG1 4.32Å; Y40-I125 HydrophobicContact CG-CG2 4.49Å; Y40-A128 HydrophobicContact CE1-CB 4.03Å; Y40-A129 HydrophobicContact CE1-CB 4.24Å; Y40-A129 HydrophobicContact CE2-CB 4.22Å; Y40-A129 VanDerWaalsContact OH-CB 3.26Å; Y40-A129 WeakPolarHBondContact OH-CB 3.34Å
41	F	97.5	Very high	95.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-127.8	13.2	-174.6	-57.1	-81.5	0	0	0	113.8	F36 D37 G43 R44 L45 L94 M97 I98 Y101 I125	F36-F41 WeakPolarHBondContact O-CD2 3.42Å; D37-F41 CarbonylContact O-C 3.55Å; D37-F41 VanDerWaalsContact O-C 3.23Å; D37-F41 WeakPolarHBondContact O-CA 3.48Å; D37-F41 PolarHBondContact O-N 3.49Å; D37-F41 WeakPolarHBondContact OD1-CB 3.44Å; F41-G43 PolarHBondContact O-N 3.48Å; F41-G43 VanDerWaalsContact O-N 3.17Å; F41-R44 VanDerWaalsContact O-CB 3.23Å; F41-R44 WeakPolarHBondContact O-CB 3.23Å; F41-R44 VanDerWaalsContact O-CG 3.23Å; F41-R44 WeakPolarHBondContact O-CG 3.23Å; F41-R44 PolarHBondContact O-N 3.07Å; F41-L45 HydrophobicContact CB-CD1 3.95Å; F41-L45 HydrophobicContact CB-CG 4.07Å; F41-L45 HydrophobicContact CD1-CD1 4.13Å; F41-L45 HydrophobicContact CD2-CD1 3.82Å; F41-L45 HydrophobicContact CE2-CD1 4.32Å; F41-L45 HydrophobicContact CG-CD1 3.69Å; F41-L45 HydrophobicContact CG-CG 4.32Å; F41-L94 HydrophobicContact CE2-CD2 4.21Å; F41-M97 HydrophobicContact CD2-CB 4.33Å; F41-M97 HydrophobicContact CD2-CE 3.71Å; F41-M97 HydrophobicContact CE1-CB 4.41Å; F41-M97 HydrophobicContact CE2-CB 3.54Å; F41-M97 HydrophobicContact CE2-CE 3.78Å; F41-M97 HydrophobicContact CE2-CG 4.45Å; F41-M97 HydrophobicContact CE2-SD 4.24Å; F41-M97 HydrophobicContact CZ-CB 3.57Å; F41-I98 HydrophobicContact CE1-CG1 4.13Å; F41-I98 HydrophobicContact CZ-CG1 4Å; F41-Y101 HydrophobicContact CB-CD2 4.1Å; F41-Y101 AromaticContact CD1-CD2 3.67Å; F41-Y101 HydrophobicContact CD1-CD2 3.67Å; F41-Y101 HydrophobicContact CD1-CE2 4.48Å; F41-Y101 AromaticContact CD1-CG 3.7Å; F41-Y101 HydrophobicContact CD1-CG 3.7Å; F41-Y101 HydrophobicContact CE1-CG 4.25Å; F41-Y101 HydrophobicContact CG-CD2 4.36Å; F41-I125 HydrophobicContact CE1-CD1 3.98Å; F41-I125 HydrophobicContact CE2-CD1 4.11Å; F41-I125 HydrophobicContact CZ-CD1 3.49Å; F41-I125 VanDerWaalsContact CZ-CD1 3.49Å
42	W	97	Very high	95.8	Very high	156 Å²	156	58.2 Å²	58.2	59%	0.591	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	30.5	173.3	-50.2	-85.7	0	0	0	114.2	D37 R44 Y101	D37-W42 PolarHBondContact O-N 3.32Å; W42-R44 HydrophobicContact CB-CG 4.42Å; W42-R44 PolarHBondContact O-N 2.66Å; W42-Y101 AromaticContact CE3-CE2 3.96Å; W42-Y101 HydrophobicContact CE3-CE2 3.96Å; W42-Y101 HydrophobicContact CZ3-CE2 4.01Å; W42-Y101 AromaticContact CZ3-CZ 3.75Å; W42-Y101 WeakPolarHBondContact CZ3-OH 3.39Å
43	G	95.6	Very high	95.8	Very high	39 Å²	39	58.9 Å²	58.9	40%	0.402	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	15.6	-177.9	0	0	0	0	0	114.2	D37 F41 L45	D37-G43 PolarHBondContact O-N 3.48Å; D37-G43 VanDerWaalsContact O-N 3.12Å; D37-G43 WeakPolarHBondContact OD1-CA 3.19Å; D37-G43 PolarHBondContact OD1-N 3.31Å; D37-G43 WeakPolarHBondContact OD2-CA 3.39Å; F41-G43 PolarHBondContact O-N 3.48Å; F41-G43 VanDerWaalsContact O-N 3.17Å; G43-L45 VanDerWaalsContact C-N 3.27Å; G43-L45 PolarHBondContact O-N 3.4Å
44	R	94.9	Very high	95.5	Very high	161 Å²	161	62.9 Å²	62.9	61%	0.608	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.5	-176.8	-65.6	-67.8	-170.8	165	1.2	112.8	D37 F41 W42 Y101	D37-R44 PolarHBondContact OD1-N 3.32Å; D37-R44 VanDerWaalsContact OD1-N 3.17Å; F41-R44 VanDerWaalsContact O-CB 3.23Å; F41-R44 WeakPolarHBondContact O-CB 3.23Å; F41-R44 VanDerWaalsContact O-CG 3.23Å; F41-R44 WeakPolarHBondContact O-CG 3.23Å; F41-R44 PolarHBondContact O-N 3.07Å; W42-R44 HydrophobicContact CB-CG 4.42Å; W42-R44 PolarHBondContact O-N 2.66Å; R44-Y101 HydrophobicContact CB-CD2 4.12Å; R44-Y101 HydrophobicContact CB-CE2 3.91Å; R44-Y101 HydrophobicContact CG-CE2 4.03Å
45	L	95.5	Very high	95.2	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	5.9	-179.1	-56.3	177.9	0	0	0	113.3	F33 D37 F41 G43 A47 C48 M97 A100	F33-L45 HydrophobicContact CE2-CB 4.17Å; F33-L45 HydrophobicContact CE2-CD1 4.45Å; F33-L45 HydrophobicContact CZ-CB 3.83Å; F33-L45 WeakPolarHBondContact CZ-O 3.46Å; D37-L45 HydrophobicContact CB-CB 4.31Å; D37-L45 WeakPolarHBondContact OD1-CB 3.22Å; D37-L45 PolarHBondContact OD1-N 3.06Å; D37-L45 PolarHBondContact OD2-N 3.5Å; F41-L45 HydrophobicContact CB-CD1 3.95Å; F41-L45 HydrophobicContact CB-CG 4.07Å; F41-L45 HydrophobicContact CD1-CD1 4.13Å; F41-L45 HydrophobicContact CD2-CD1 3.82Å; F41-L45 HydrophobicContact CE2-CD1 4.32Å; F41-L45 HydrophobicContact CG-CD1 3.69Å; F41-L45 HydrophobicContact CG-CG 4.32Å; G43-L45 VanDerWaalsContact C-N 3.27Å; G43-L45 PolarHBondContact O-N 3.4Å; L45-A47 PolarHBondContact O-N 2.96Å; L45-C48 VanDerWaalsContact O-CB 3.29Å; L45-C48 WeakPolarHBondContact O-CB 3.4Å; L45-C48 PolarHBondContact O-N 3.45Å; L45-M97 HydrophobicContact CD1-CB 3.85Å; L45-M97 HydrophobicContact CD1-CE 3.62Å; L45-M97 HydrophobicContact CD1-CG 4.15Å; L45-A100 HydrophobicContact CD2-CB 3.94Å
46	A	92.9	Very high	95	Very high	82 Å²	82	65 Å²	65	68%	0.678	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-24.8	-178.9	0	0	0	0	0	115.3	D37	D37-A46 PolarHBondContact OD2-N 3.23Å
47	A	90.8	Very high	94.5	Very high	81 Å²	81	65 Å²	65	67%	0.669	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.9	176.2	0	0	0	0	0	114.2	L45	L45-A47 PolarHBondContact O-N 2.96Å
48	C	94	Very high	93.9	Very high	13 Å²	13	70 Å²	70	9%	0.088	37%	0.374	C	S	.	.			trans	-88.6	150.5	177.4	-52.2	0	0	0	0	110.5	F33 L45 C72	F33-C48 HydrophobicContact CE2-CB 4.44Å; F33-C48 HydrophobicContact CZ-CB 3.97Å; L45-C48 VanDerWaalsContact O-CB 3.29Å; L45-C48 WeakPolarHBondContact O-CB 3.4Å; L45-C48 PolarHBondContact O-N 3.45Å; C48-C72 CarbonylContact C-O 3.52Å; C48-C72 WeakPolarHBondContact CA-O 3.38Å; C48-C72 HydrophobicContact CB-CB 4.26Å; C48-C72 WeakPolarHBondContact CB-O 3.18Å
49	E	94.8	Very high	93.5	Very high	89 Å²	89	68.5 Å²	68.5	42%	0.416	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.5	167.6	65.2	169.7	-156.8	0	0	110.6	R51 C72 S73 I74	E49-R51 IonicContact OE1-CZ 2.86Å; E49-R51 IonicContact OE1-NE 3.66Å; E49-R51 PolarHBondContact OE1-NE 3.43Å; E49-R51 IonicContact OE1-NH2 2.73Å; E49-R51 PolarHBondContact OE1-NH2 3.24Å; E49-C72 PolarHBondContact N-O 2.81Å; E49-S73 WeakPolarHBondContact CG-OG 3.41Å; E49-S73 WeakPolarHBondContact OE1-CB 3.37Å; E49-S73 PolarHBondContact OE1-OG 2.92Å; E49-I74 PolarHBondContact O-N 3.32Å
50	V	96.5	Very high	93.2	Very high	3 Å²	3	65.5 Å²	65.5	2%	0.018	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137.9	167	67.6	0	0	0	0	108.9	I29 H30 F33 I74 L76 L93	I29-V50 HydrophobicContact CD1-CG2 4.27Å; H30-V50 PolarHBondContact CE1-O 3.35Å; F33-V50 HydrophobicContact CB-CB 4.24Å; F33-V50 HydrophobicContact CB-CG1 3.64Å; F33-V50 HydrophobicContact CD1-CG1 4.27Å; F33-V50 HydrophobicContact CD2-CB 4.17Å; F33-V50 HydrophobicContact CD2-CG1 4.38Å; F33-V50 HydrophobicContact CG-CB 4.14Å; F33-V50 HydrophobicContact CG-CG1 3.84Å; V50-I74 CarbonylContact C-O 3.23Å; V50-I74 WeakPolarHBondContact CA-O 3.34Å; V50-I74 HydrophobicContact CB-CB 4.44Å; V50-I74 HydrophobicContact CG2-CB 4.23Å; V50-I74 HydrophobicContact CG2-CG2 4.11Å; V50-L76 HydrophobicContact CG2-CD1 4.4Å; V50-L93 HydrophobicContact CG2-CD1 3.88Å
51	R	95.8	Very high	92.9	Very high	92 Å²	92	63.8 Å²	63.8	35%	0.347	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	156.6	176.7	57.7	172.9	162.6	-173.7	-20.4	113.7	E49 S73 I74 R75 L76	E49-R51 IonicContact OE1-CZ 2.86Å; E49-R51 IonicContact OE1-NE 3.66Å; E49-R51 PolarHBondContact OE1-NE 3.43Å; E49-R51 IonicContact OE1-NH2 2.73Å; E49-R51 PolarHBondContact OE1-NH2 3.24Å; R51-S73 PolarHBondContact NE-OG 3.15Å; R51-S73 PolarHBondContact NH2-OG 2.87Å; R51-I74 PolarHBondContact N-O 2.93Å; R51-R75 HydrophobicContact CG-CG 4.14Å; R51-R75 WeakPolarHBondContact O-CA 3.33Å; R51-L76 PolarHBondContact O-N 2.92Å
52	W	95.3	Very high	92.7	Very high	75 Å²	75	68 Å²	68	28%	0.284	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136.7	167.3	-71.3	115.1	0	0	0	111.9	P27 I29 L76 K78 L81 L89	P27-W52 HydrophobicContact CG-CH2 4.5Å; P27-W52 HydrophobicContact CG-CZ2 3.82Å; I29-W52 VanDerWaalsContact CD1-CD1 3.49Å; I29-W52 HydrophobicContact CD1-CD2 4.1Å; I29-W52 HydrophobicContact CD1-CG 3.87Å; I29-W52 HydrophobicContact CG2-CD2 4.47Å; I29-W52 HydrophobicContact CG2-CH2 4.01Å; I29-W52 HydrophobicContact CG2-CZ2 3.22Å; W52-L76 HydrophobicContact CE3-CB 3.77Å; W52-L76 HydrophobicContact CH2-CB 4.46Å; W52-L76 HydrophobicContact CZ3-CB 3.67Å; W52-K78 HydrophobicContact CE3-CB 4.03Å; W52-L81 HydrophobicContact CH2-CB 4.24Å; W52-L81 HydrophobicContact CZ3-CB 4.11Å; W52-L81 HydrophobicContact CZ3-CD1 4.17Å; W52-L89 HydrophobicContact CH2-CD1 3.61Å; W52-L89 HydrophobicContact CH2-CD2 4.49Å; W52-L89 HydrophobicContact CZ2-CD1 4.23Å; W52-L89 HydrophobicContact CZ3-CD1 4.41Å
53	S	94.3	Very high	92.4	Very high	19 Å²	19	61 Å²	61	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.1	168.8	-177.6	0	0	0	0	109.9	R55 M56 L76 K78	S53-R55 VanDerWaalsContact C-N 3.26Å; S53-R55 PolarHBondContact O-N 2.97Å; S53-M56 VanDerWaalsContact OG-CB 3.31Å; S53-M56 WeakPolarHBondContact OG-CB 3.42Å; S53-M56 PolarHBondContact OG-N 3.01Å; S53-L76 PolarHBondContact N-O 2.77Å; S53-K78 PolarHBondContact O-N 2.84Å; S53-K78 VanDerWaalsContact O-N 3.08Å
54	P	91.5	Very high	92	Very high	96 Å²	96	62.1 Å²	62.1	62%	0.623	32%	0.319	S	S	*	.	S	Bend	trans	-76.7	-11.9	178.6	30.1	-34.4	0	0	0	113.3
55	R	90.2	Very high	91.6	Very high	223 Å²	223	55.9 Å²	55.9	84%	0.842	30%	0.295	S	S	*	.	S	Bend	trans	-110.9	-11.5	-175	-61.2	-165.6	-61.9	169.5	-0.1	114.1	S53 T57	S53-R55 VanDerWaalsContact C-N 3.26Å; S53-R55 PolarHBondContact O-N 2.97Å; R55-T57 PolarHBondContact O-N 3.4Å
56	M	90.2	Very high	90.9	Very high	21 Å²	21	59.3 Å²	59.3	10%	0.103	31%	0.311	C	S	.	.			trans	-76.7	120	-177.1	-171	165.5	75.4	0	0	110.1	S53 C59 A60 Q62 R75 S77	S53-M56 VanDerWaalsContact OG-CB 3.31Å; S53-M56 WeakPolarHBondContact OG-CB 3.42Å; S53-M56 PolarHBondContact OG-N 3.01Å; M56-C59 WeakPolarHBondContact CG-O 3.35Å; M56-A60 WeakPolarHBondContact CE-O 3.46Å; M56-Q62 HydrophobicContact SD-CB 3.83Å; M56-R75 WeakPolarHBondContact CE-O 3.39Å; M56-S77 WeakPolarHBondContact O-CB 3.33Å; M56-S77 PolarHBondContact O-OG 2.83Å
57	T	88.5	Confident	89.7	Confident	23 Å²	23	64.3 Å²	64.3	14%	0.141	31%	0.314	C	S	.	.			trans	-137.1	-1.8	-175.6	49.9	0	0	0	0	113.2	R55 Y146 A170	R55-T57 PolarHBondContact O-N 3.4Å; T57-Y146 HydrophobicContact CG2-CD1 3.75Å; T57-Y146 HydrophobicContact CG2-CD2 3.95Å; T57-Y146 HydrophobicContact CG2-CE1 4.14Å; T57-Y146 HydrophobicContact CG2-CE2 4.35Å; T57-Y146 HydrophobicContact CG2-CG 3.67Å; T57-A170 WeakPolarHBondContact OG1-CB 2.98Å
58	L	85.6	Confident	88.8	Confident	115 Å²	115	65.4 Å²	65.4	60%	0.602	31%	0.314	S	S	*	.	S	Bend	trans	-89.6	-27.6	178.6	-68.3	176.7	0	0	0	113
59	C	87.4	Confident	87.7	Confident	44 Å²	44	72.4 Å²	72.4	30%	0.297	34%	0.343	S	S	.	.			trans	-149.7	156.5	-179.8	57.5	0	0	0	0	108.9	M56 G61 L80	M56-C59 WeakPolarHBondContact CG-O 3.35Å; C59-G61 PolarHBondContact SG-O 3.47Å; C59-L80 VanDerWaalsContact O-CD1 3.29Å; C59-L80 WeakPolarHBondContact O-CD1 3.09Å
60	A	91.1	Very high	86.7	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.008	35%	0.345	C	S	.	.	S	Bend	trans	-82.2	-24.8	-178.9	0	0	0	0	0	113.8	M56 L76 S77 L80 L81 T92 F139	M56-A60 WeakPolarHBondContact CE-O 3.46Å; A60-L76 CarbonylContact O-C 3.59Å; A60-L76 WeakPolarHBondContact O-CA 3.36Å; A60-S77 PolarHBondContact O-N 3.39Å; A60-L80 HydrophobicContact CB-CB 4.37Å; A60-L80 HydrophobicContact CB-CD1 4.34Å; A60-L81 HydrophobicContact CB-CD1 4.25Å; A60-L81 HydrophobicContact CB-CD2 4.03Å; A60-L81 HydrophobicContact CB-CG 4.07Å; A60-T92 HydrophobicContact CB-CG2 3.84Å; A60-F139 HydrophobicContact CB-CD1 4.37Å; A60-F139 HydrophobicContact CB-CD2 3.51Å; A60-F139 HydrophobicContact CB-CE1 4.02Å; A60-F139 HydrophobicContact CB-CE2 3.06Å; A60-F139 HydrophobicContact CB-CG 4.15Å; A60-F139 HydrophobicContact CB-CZ 3.38Å
61	G	92.5	Very high	86.1	Confident	7 Å²	7	74 Å²	74	7%	0.072	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	153.1	177.4	0	0	0	0	0	111.1	C59 R75 E96	C59-G61 PolarHBondContact SG-O 3.47Å; G61-R75 CarbonylContact C-O 3.44Å; G61-R75 WeakPolarHBondContact CA-O 3.44Å; G61-E96 VanDerWaalsContact C-CD 3.43Å; G61-E96 WeakPolarHBondContact CA-OE1 3.39Å
62	Q	91.5	Very high	85.9	Confident	87 Å²	87	69.7 Å²	69.7	41%	0.407	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	133.6	167.5	-179.8	169.4	79.7	0	0	111.7	M56 R75 E96	M56-Q62 HydrophobicContact SD-CB 3.83Å; Q62-R75 PolarHBondContact N-O 2.86Å; Q62-R75 PolarHBondContact O-N 3.13Å; Q62-E96 VanDerWaalsContact CA-OE2 3.27Å; Q62-E96 WeakPolarHBondContact CA-OE2 3.41Å; Q62-E96 PolarHBondContact N-OE1 2.92Å; Q62-E96 PolarHBondContact N-OE2 3.34Å
63	C	91.3	Very high	85.8	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.061	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	131.7	165.8	-67.5	0	0	0	0	112.6	Y65 S73 E96	C63-Y65 HydrophobicContact CB-CE1 4.13Å; C63-Y65 HydrophobicContact CB-CE2 3.76Å; C63-Y65 VanDerWaalsContact CB-CZ 3.49Å; C63-Y65 WeakPolarHBondContact CB-OH 3.06Å; C63-S73 CarbonylContact C-O 3.53Å; C63-S73 WeakPolarHBondContact CA-O 3.44Å; C63-E96 PolarHBondContact N-OE2 3.45Å; C63-E96 PolarHBondContact SG-O 3.26Å; C63-E96 PolarHBondContact SG-OE2 3.49Å
64	H	88.3	Confident	85.8	Confident	64 Å²	64	65.4 Å²	65.4	30%	0.296	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.1	171.1	-177	-85.1	0	0	0	110.2	S73	H64-S73 PolarHBondContact N-O 3.16Å; H64-S73 PolarHBondContact O-N 2.97Å
65	Y	86	Confident	86	Confident	30 Å²	30	64.1 Å²	64.1	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120	-180	-52.1	-73.8	0	0	0	109.9	C63 L71 C72 H99 F103	C63-Y65 HydrophobicContact CB-CE1 4.13Å; C63-Y65 HydrophobicContact CB-CE2 3.76Å; C63-Y65 VanDerWaalsContact CB-CZ 3.49Å; C63-Y65 WeakPolarHBondContact CB-OH 3.06Å; Y65-L71 WeakPolarHBondContact CA-O 3.27Å; Y65-C72 HydrophobicContact CD1-CB 3.81Å; Y65-C72 HydrophobicContact CE1-CB 3.97Å; Y65-C72 WeakPolarHBondContact CE1-SG 3.48Å; Y65-H99 PolarHBondContact OH-O 3.48Å; Y65-F103 HydrophobicContact CD1-CB 3.92Å; Y65-F103 AromaticContact CD1-CD1 3.24Å; Y65-F103 HydrophobicContact CD1-CD1 3.24Å; Y65-F103 AromaticContact CD1-CD2 3.45Å; Y65-F103 HydrophobicContact CD1-CD2 3.45Å; Y65-F103 VanDerWaalsContact CD1-CD2 3.45Å; Y65-F103 AromaticContact CD1-CE1 3.47Å; Y65-F103 HydrophobicContact CD1-CE1 3.47Å; Y65-F103 VanDerWaalsContact CD1-CE1 3.47Å; Y65-F103 AromaticContact CD1-CE2 3.67Å; Y65-F103 HydrophobicContact CD1-CE2 3.67Å; Y65-F103 AromaticContact CD1-CG 3.22Å; Y65-F103 HydrophobicContact CD1-CG 3.22Å; Y65-F103 AromaticContact CD1-CZ 3.68Å; Y65-F103 HydrophobicContact CD1-CZ 3.68Å; Y65-F103 HydrophobicContact CD2-CD2 4.18Å; Y65-F103 HydrophobicContact CD2-CE2 4.4Å; Y65-F103 HydrophobicContact CE1-CB 3.26Å; Y65-F103 AromaticContact CE1-CD1 3.44Å; Y65-F103 HydrophobicContact CE1-CD1 3.44Å; Y65-F103 VanDerWaalsContact CE1-CD1 3.44Å; Y65-F103 AromaticContact CE1-CD2 3.68Å; Y65-F103 HydrophobicContact CE1-CD2 3.68Å; Y65-F103 HydrophobicContact CE1-CE1 4.16Å; Y65-F103 HydrophobicContact CE1-CE2 4.36Å; Y65-F103 AromaticContact CE1-CG 3.15Å; Y65-F103 HydrophobicContact CE1-CG 3.15Å; Y65-F103 HydrophobicContact CE2-CD2 4.4Å; Y65-F103 HydrophobicContact CG-CD1 4.22Å; Y65-F103 AromaticContact CG-CD2 3.69Å; Y65-F103 HydrophobicContact CG-CD2 3.69Å; Y65-F103 HydrophobicContact CG-CE1 4.2Å; Y65-F103 AromaticContact CG-CE2 3.66Å; Y65-F103 HydrophobicContact CG-CE2 3.66Å; Y65-F103 AromaticContact CG-CG 3.98Å; Y65-F103 HydrophobicContact CG-CG 3.98Å; Y65-F103 AromaticContact CG-CZ 3.92Å; Y65-F103 HydrophobicContact CG-CZ 3.92Å; Y65-F103 AromaticContact CZ-CG 3.88Å
66	E	81	Confident	86.3	Confident	72 Å²	72	53.5 Å²	53.5	34%	0.336	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.8	174.4	-67.3	-173	-172.6	0	0	110.5	K69 G70 L71	E66-K69 PolarHBondContact O-N 3.12Å; E66-G70 WeakPolarHBondContact O-CA 3.17Å; E66-G70 PolarHBondContact O-N 3.49Å; E66-L71 HydrophobicContact CB-CB 4.24Å; E66-L71 PolarHBondContact N-O 3.31Å
67	Y	68.2	Low	86.4	Confident	187 Å²	187	52.5 Å²	52.5	73%	0.733	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	138.7	169	-167.9	-93.1	0	0	0	109.4
68	P	71	Confident	86.6	Confident	103 Å²	103	56.3 Å²	56.3	67%	0.669	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.4	-2.7	5.8	35.4	-35.8	0	0	0	115	G70	P68-G70 PolarHBondContact O-N 3.24Å; P68-G70 VanDerWaalsContact O-N 3.15Å
69	K	71.9	Confident	86.7	Confident	161 Å²	161	52 Å²	52	70%	0.7	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-17.2	-169.9	-64.4	-178.5	-179.7	176.1	0	114.2	E66 L71	E66-K69 PolarHBondContact O-N 3.12Å; K69-L71 HydrophobicContact CB-CD1 4.31Å; K69-L71 HydrophobicContact CB-CG 4.11Å; K69-L71 HydrophobicContact CD-CD1 4.45Å; K69-L71 PolarHBondContact O-N 2.79Å
70	G	73	Confident	86.8	Confident	43 Å²	43	50.1 Å²	50.1	44%	0.443	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	13.6	178.7	0	0	0	0	0	113.7	E66 P68	E66-G70 WeakPolarHBondContact O-CA 3.17Å; E66-G70 PolarHBondContact O-N 3.49Å; P68-G70 PolarHBondContact O-N 3.24Å; P68-G70 VanDerWaalsContact O-N 3.15Å
71	L	84.7	Confident	86.7	Confident	81 Å²	81	50.4 Å²	50.4	42%	0.424	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.8	178.9	-59.9	174.9	0	0	0	109.5	Y65 E66 K69	Y65-L71 WeakPolarHBondContact CA-O 3.27Å; E66-L71 HydrophobicContact CB-CB 4.24Å; E66-L71 PolarHBondContact N-O 3.31Å; K69-L71 HydrophobicContact CB-CD1 4.31Å; K69-L71 HydrophobicContact CB-CG 4.11Å; K69-L71 HydrophobicContact CD-CD1 4.45Å; K69-L71 PolarHBondContact O-N 2.79Å
72	C	90.5	Very high	86.2	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.02	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.5	174.4	174.6	0	0	0	0	109.6	C48 E49 Y65 A100 F103	C48-C72 CarbonylContact C-O 3.52Å; C48-C72 WeakPolarHBondContact CA-O 3.38Å; C48-C72 HydrophobicContact CB-CB 4.26Å; C48-C72 WeakPolarHBondContact CB-O 3.18Å; E49-C72 PolarHBondContact N-O 2.81Å; Y65-C72 HydrophobicContact CD1-CB 3.81Å; Y65-C72 HydrophobicContact CE1-CB 3.97Å; Y65-C72 WeakPolarHBondContact CE1-SG 3.48Å; C72-A100 VanDerWaalsContact SG-CB 3.55Å; C72-F103 HydrophobicContact CB-CD1 4.29Å; C72-F103 HydrophobicContact CB-CE1 4.49Å
73	S	93.5	Very high	85.6	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	110.5	180	178	0	0	0	0	109.7	E49 R51 C63 H64	E49-S73 WeakPolarHBondContact CG-OG 3.41Å; E49-S73 WeakPolarHBondContact OE1-CB 3.37Å; E49-S73 PolarHBondContact OE1-OG 2.92Å; R51-S73 PolarHBondContact NE-OG 3.15Å; R51-S73 PolarHBondContact NH2-OG 2.87Å; C63-S73 CarbonylContact C-O 3.53Å; C63-S73 WeakPolarHBondContact CA-O 3.44Å; H64-S73 PolarHBondContact N-O 3.16Å; H64-S73 PolarHBondContact O-N 2.97Å
74	I	95.3	Very high	85.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.7	171.9	-59.7	175.6	0	0	0	108.1	F33 E49 V50 R51 L76 L93 E96 M97 A100	F33-I74 HydrophobicContact CD2-CD1 4.33Å; F33-I74 HydrophobicContact CE2-CD1 3.96Å; E49-I74 PolarHBondContact O-N 3.32Å; V50-I74 CarbonylContact C-O 3.23Å; V50-I74 WeakPolarHBondContact CA-O 3.34Å; V50-I74 HydrophobicContact CB-CB 4.44Å; V50-I74 HydrophobicContact CG2-CB 4.23Å; V50-I74 HydrophobicContact CG2-CG2 4.11Å; R51-I74 PolarHBondContact N-O 2.93Å; I74-L76 HydrophobicContact CG2-CD2 4.48Å; I74-L93 HydrophobicContact CG2-CD1 4.2Å; I74-E96 HydrophobicContact CD1-CB 4.47Å; I74-E96 HydrophobicContact CG1-CB 4.43Å; I74-E96 HydrophobicContact CG2-CB 3.56Å; I74-E96 HydrophobicContact CG2-CG 4.12Å; I74-M97 HydrophobicContact CD1-CB 4.4Å; I74-M97 HydrophobicContact CD1-CG 3.64Å; I74-A100 HydrophobicContact CD1-CB 3.95Å; I74-A100 HydrophobicContact CG1-CB 4.25Å
75	R	95.4	Very high	85.2	Confident	70 Å²	70	58.1 Å²	58.1	26%	0.264	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.8	177.3	-59.8	-173.6	-179.1	-176.1	2	109.5	R51 M56 G61 Q62	R51-R75 HydrophobicContact CG-CG 4.14Å; R51-R75 WeakPolarHBondContact O-CA 3.33Å; M56-R75 WeakPolarHBondContact CE-O 3.39Å; G61-R75 CarbonylContact C-O 3.44Å; G61-R75 WeakPolarHBondContact CA-O 3.44Å; Q62-R75 PolarHBondContact N-O 2.86Å; Q62-R75 PolarHBondContact O-N 3.13Å
76	L	95.1	Very high	85.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.3	175.6	-62.7	177.9	0	0	0	110.4	I29 V50 R51 W52 S53 A60 I74 K78 L81 L89 T92 L93 E96	I29-L76 HydrophobicContact CG2-CD1 4.03Å; V50-L76 HydrophobicContact CG2-CD1 4.4Å; R51-L76 PolarHBondContact O-N 2.92Å; W52-L76 HydrophobicContact CE3-CB 3.77Å; W52-L76 HydrophobicContact CH2-CB 4.46Å; W52-L76 HydrophobicContact CZ3-CB 3.67Å; S53-L76 PolarHBondContact N-O 2.77Å; A60-L76 CarbonylContact O-C 3.59Å; A60-L76 WeakPolarHBondContact O-CA 3.36Å; I74-L76 HydrophobicContact CG2-CD2 4.48Å; L76-K78 PolarHBondContact O-N 2.67Å; L76-L81 HydrophobicContact CB-CD1 4.05Å; L76-L81 HydrophobicContact CD2-CD1 4.3Å; L76-L89 HydrophobicContact CD1-CD1 3.68Å; L76-T92 HydrophobicContact CD2-CG2 3.92Å; L76-L93 HydrophobicContact CD1-CB 4.26Å; L76-L93 HydrophobicContact CD1-CD1 4.2Å; L76-E96 HydrophobicContact CD2-CG 4.49Å
77	S	94	Very high	85.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	113.6	-179.5	174	0	0	0	0	109	M56 A60 S79 L80 L81	M56-S77 WeakPolarHBondContact O-CB 3.33Å; M56-S77 PolarHBondContact O-OG 2.83Å; A60-S77 PolarHBondContact O-N 3.39Å; S77-S79 VanDerWaalsContact C-N 3.28Å; S77-S79 PolarHBondContact O-N 3.17Å; S77-S79 PolarHBondContact OG-N 3.03Å; S77-L80 WeakPolarHBondContact OG-CB 3.45Å; S77-L80 WeakPolarHBondContact OG-CG 3.23Å; S77-L80 PolarHBondContact OG-N 2.98Å; S77-L81 WeakPolarHBondContact O-CB 3.11Å; S77-L81 PolarHBondContact O-N 3.35Å; S77-L81 VanDerWaalsContact O-N 3.11Å
78	K	92.1	Very high	87	Confident	102 Å²	102	50.1 Å²	50.1	44%	0.443	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-43.6	171.8	-178.8	165.6	-176.3	171.8	0	110.3	W52 S53 L76 L80 Q82	W52-K78 HydrophobicContact CE3-CB 4.03Å; S53-K78 PolarHBondContact O-N 2.84Å; S53-K78 VanDerWaalsContact O-N 3.08Å; L76-K78 PolarHBondContact O-N 2.67Å; K78-L80 PolarHBondContact O-N 2.91Å; K78-Q82 VanDerWaalsContact CE-OE1 3.29Å; K78-Q82 HydrophobicContact CG-CB 4.43Å; K78-Q82 WeakPolarHBondContact O-CB 3.44Å; K78-Q82 WeakPolarHBondContact O-CG 3.49Å; K78-Q82 PolarHBondContact O-N 2.89Å
79	S	87.6	Confident	88	Confident	26 Å²	26	45.5 Å²	45.5	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-38.7	-177.9	-62.2	0	0	0	0	114.3	S77 Y146	S77-S79 VanDerWaalsContact C-N 3.28Å; S77-S79 PolarHBondContact O-N 3.17Å; S77-S79 PolarHBondContact OG-N 3.03Å; S79-Y146 WeakPolarHBondContact CB-OH 3.18Å; S79-Y146 PolarHBondContact O-OH 2.65Å
80	L	88.6	Confident	89.1	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-89.1	-28.1	-176.8	-60.9	175.1	0	0	0	113	C59 A60 S77 K78 R84 E142 V143 Y146	C59-L80 VanDerWaalsContact O-CD1 3.29Å; C59-L80 WeakPolarHBondContact O-CD1 3.09Å; A60-L80 HydrophobicContact CB-CB 4.37Å; A60-L80 HydrophobicContact CB-CD1 4.34Å; S77-L80 WeakPolarHBondContact OG-CB 3.45Å; S77-L80 WeakPolarHBondContact OG-CG 3.23Å; S77-L80 PolarHBondContact OG-N 2.98Å; K78-L80 PolarHBondContact O-N 2.91Å; L80-R84 WeakPolarHBondContact O-CG 3.34Å; L80-E142 HydrophobicContact CD2-CB 3.44Å; L80-E142 VanDerWaalsContact CD2-CB 3.44Å; L80-E142 HydrophobicContact CD2-CG 4.5Å; L80-V143 HydrophobicContact CD1-CG2 4.1Å; L80-V143 HydrophobicContact CD2-CG2 4.3Å; L80-Y146 HydrophobicContact CD2-CD2 3.9Å; L80-Y146 HydrophobicContact CD2-CE2 3.91Å
81	L	89.4	Confident	90.1	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-103.2	-22.8	-172.5	-65.2	169.2	0	0	0	114.5	W52 A60 L76 S77 Y83 R84 D88 L89 T92 F139	W52-L81 HydrophobicContact CH2-CB 4.24Å; W52-L81 HydrophobicContact CZ3-CB 4.11Å; W52-L81 HydrophobicContact CZ3-CD1 4.17Å; A60-L81 HydrophobicContact CB-CD1 4.25Å; A60-L81 HydrophobicContact CB-CD2 4.03Å; A60-L81 HydrophobicContact CB-CG 4.07Å; L76-L81 HydrophobicContact CB-CD1 4.05Å; L76-L81 HydrophobicContact CD2-CD1 4.3Å; S77-L81 WeakPolarHBondContact O-CB 3.11Å; S77-L81 PolarHBondContact O-N 3.35Å; S77-L81 VanDerWaalsContact O-N 3.11Å; L81-Y83 PolarHBondContact O-N 3.19Å; L81-Y83 VanDerWaalsContact O-N 3.07Å; L81-R84 PolarHBondContact O-N 2.86Å; L81-R84 VanDerWaalsContact O-N 3.14Å; L81-D88 HydrophobicContact CD2-CB 4.22Å; L81-L89 HydrophobicContact CD1-CD1 4.02Å; L81-T92 HydrophobicContact CD1-CG2 4.23Å; L81-F139 HydrophobicContact CD2-CE1 4.06Å; L81-F139 HydrophobicContact CD2-CZ 3.94Å
82	Q	81.6	Confident	90.6	Very high	59 Å²	59	33.9 Å²	33.9	28%	0.276	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.2	-170	70.6	-176.3	13.3	0	0	115.4	K78	K78-Q82 VanDerWaalsContact CE-OE1 3.29Å; K78-Q82 HydrophobicContact CG-CB 4.43Å; K78-Q82 WeakPolarHBondContact O-CB 3.44Å; K78-Q82 WeakPolarHBondContact O-CG 3.49Å; K78-Q82 PolarHBondContact O-N 2.89Å
83	Y	79.1	Confident	90.9	Very high	180 Å²	180	33.8 Å²	33.8	71%	0.706	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.6	9.5	179.5	-57	-51	0	0	0	112.8	L81	L81-Y83 PolarHBondContact O-N 3.19Å; L81-Y83 VanDerWaalsContact O-N 3.07Å
84	R	85	Confident	91	Very high	60 Å²	60	33.6 Å²	33.6	23%	0.226	15%	0.148	C	C	.	.	S	Bend	trans	-92.3	158.3	178.1	-66.1	-70.6	-66.9	-141.6	-9.2	109.6	L80 L81 D88 E142	L80-R84 WeakPolarHBondContact O-CG 3.34Å; L81-R84 PolarHBondContact O-N 2.86Å; L81-R84 VanDerWaalsContact O-N 3.14Å; R84-D88 HydrophobicContact CB-CB 4.02Å; R84-D88 WeakPolarHBondContact CB-OD2 3.25Å; R84-D88 IonicContact CZ-OD2 2.77Å; R84-D88 IonicContact NE-OD2 3.85Å; R84-D88 PolarHBondContact NE-OD2 2.97Å; R84-D88 IonicContact NH2-OD2 3.91Å; R84-D88 PolarHBondContact NH2-OD2 3.43Å; R84-E142 IonicContact CZ-OE1 2.66Å; R84-E142 VanDerWaalsContact NH1-CD 3.33Å; R84-E142 IonicContact NH1-OE1 3.65Å; R84-E142 PolarHBondContact NH1-OE1 3.49Å; R84-E142 IonicContact NH1-OE2 3.57Å
85	P	87.2	Confident	91.1	Very high	30 Å²	30	34 Å²	34	20%	0.195	15%	0.149	C	C	.	.			trans	-55.3	150.7	171.6	-23.2	34.1	0	0	0	111	K87 D88	P85-K87 HydrophobicContact CB-CD 4.3Å; P85-K87 HydrophobicContact CB-CG 4.17Å; P85-K87 PolarHBondContact O-N 3.12Å; P85-D88 PolarHBondContact O-N 3.17Å
86	R	89.2	Confident	91.1	Very high	44 Å²	44	31.3 Å²	31.3	17%	0.166	14%	0.14	C	C	.	.	H	α-helix	trans	-55.2	-30.8	-177.7	-178.9	172.5	172.9	110.5	-11	113.2	L20 T22 D24 D88 L89 V90	L20-R86 PolarHBondContact O-N 3.02Å; T22-R86 WeakPolarHBondContact O-CB 3.46Å; T22-R86 PolarHBondContact O-N 3.36Å; D24-R86 IonicContact OD2-CZ 3.63Å; D24-R86 IonicContact OD2-NH1 2.76Å; D24-R86 PolarHBondContact OD2-NH1 3.29Å; R86-D88 VanDerWaalsContact C-N 3.28Å; R86-D88 PolarHBondContact O-N 2.96Å; R86-L89 WeakPolarHBondContact O-CB 3.35Å; R86-L89 PolarHBondContact O-N 3.17Å; R86-V90 HydrophobicContact CG-CG2 4.25Å; R86-V90 WeakPolarHBondContact O-CG2 3.46Å; R86-V90 PolarHBondContact O-N 3.31Å
87	K	91.2	Very high	91.2	Very high	61 Å²	61	31.3 Å²	31.3	27%	0.265	14%	0.14	S	C	.	.	H	α-helix	trans	-53.2	-42.7	175.7	79.7	-163.4	-173.1	-174.1	0	113	L20 E21 P85 L89 V90 E91	L20-K87 HydrophobicContact CB-CB 4.23Å; L20-K87 PolarHBondContact O-N 3.14Å; E21-K87 WeakPolarHBondContact OE1-CD 3.28Å; E21-K87 IonicContact OE1-NZ 2.78Å; E21-K87 PolarHBondContact OE1-NZ 3.32Å; E21-K87 IonicContact OE2-NZ 2.73Å; E21-K87 PolarHBondContact OE2-NZ 2.97Å; P85-K87 HydrophobicContact CB-CD 4.3Å; P85-K87 HydrophobicContact CB-CG 4.17Å; P85-K87 PolarHBondContact O-N 3.12Å; K87-L89 VanDerWaalsContact C-N 3.31Å; K87-L89 PolarHBondContact O-N 3.07Å; K87-V90 PolarHBondContact O-N 3.06Å; K87-V90 VanDerWaalsContact O-N 3.17Å; K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 WeakPolarHBondContact O-CG 3.31Å; K87-E91 PolarHBondContact O-N 2.95Å
88	D	91.4	Very high	91.3	Very high	16 Å²	16	31.3 Å²	31.3	9%	0.086	14%	0.14	C	C	.	.	H	α-helix	trans	-68.6	-36.9	-175.1	-68.3	-13.7	0	0	0	110.6	L81 R84 P85 R86 T92	L81-D88 HydrophobicContact CD2-CB 4.22Å; R84-D88 HydrophobicContact CB-CB 4.02Å; R84-D88 WeakPolarHBondContact CB-OD2 3.25Å; R84-D88 IonicContact CZ-OD2 2.77Å; R84-D88 IonicContact NE-OD2 3.85Å; R84-D88 PolarHBondContact NE-OD2 2.97Å; R84-D88 IonicContact NH2-OD2 3.91Å; R84-D88 PolarHBondContact NH2-OD2 3.43Å; P85-D88 PolarHBondContact O-N 3.17Å; R86-D88 VanDerWaalsContact C-N 3.28Å; R86-D88 PolarHBondContact O-N 2.96Å; D88-T92 WeakPolarHBondContact O-CB 3.41Å; D88-T92 PolarHBondContact O-N 3.22Å; D88-T92 PolarHBondContact O-OG1 3.32Å
89	L	92.7	Very high	91.4	Very high	7 Å²	7	27 Å²	27	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-62.7	-49.3	172.6	172.9	61.7	0	0	0	111.2	P27 I29 L32 W52 L76 L81 R86 K87 L93	P27-L89 HydrophobicContact CB-CD2 3.3Å; P27-L89 HydrophobicContact CG-CD2 3.91Å; I29-L89 HydrophobicContact CG2-CD1 4.19Å; I29-L89 HydrophobicContact CG2-CD2 4.4Å; L32-L89 HydrophobicContact CD1-CD2 4.03Å; L32-L89 HydrophobicContact CD1-CG 4.45Å; W52-L89 HydrophobicContact CH2-CD1 3.61Å; W52-L89 HydrophobicContact CH2-CD2 4.49Å; W52-L89 HydrophobicContact CZ2-CD1 4.23Å; W52-L89 HydrophobicContact CZ3-CD1 4.41Å; L76-L89 HydrophobicContact CD1-CD1 3.68Å; L81-L89 HydrophobicContact CD1-CD1 4.02Å; R86-L89 WeakPolarHBondContact O-CB 3.35Å; R86-L89 PolarHBondContact O-N 3.17Å; K87-L89 VanDerWaalsContact C-N 3.31Å; K87-L89 PolarHBondContact O-N 3.07Å; L89-L93 VanDerWaalsContact O-CB 3.27Å; L89-L93 WeakPolarHBondContact O-CB 3.4Å; L89-L93 PolarHBondContact O-N 2.85Å
90	V	93.8	Very high	91.7	Very high	9 Å²	9	25.8 Å²	25.8	6%	0.055	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-48.6	-178.1	167.3	0	0	0	0	110.9	F36 R86 K87 L93 L94 T131	F36-V90 HydrophobicContact CE2-CG1 3.97Å; F36-V90 HydrophobicContact CE2-CG2 4.44Å; F36-V90 HydrophobicContact CZ-CB 4.4Å; F36-V90 HydrophobicContact CZ-CG1 3.66Å; F36-V90 HydrophobicContact CZ-CG2 4.11Å; R86-V90 HydrophobicContact CG-CG2 4.25Å; R86-V90 WeakPolarHBondContact O-CG2 3.46Å; R86-V90 PolarHBondContact O-N 3.31Å; K87-V90 PolarHBondContact O-N 3.06Å; K87-V90 VanDerWaalsContact O-N 3.17Å; V90-L93 PolarHBondContact O-N 3.32Å; V90-L94 HydrophobicContact CG1-CD1 3.79Å; V90-L94 WeakPolarHBondContact O-CB 3.33Å; V90-L94 WeakPolarHBondContact O-CG 3.49Å; V90-L94 PolarHBondContact O-N 3.47Å; V90-T131 HydrophobicContact CG1-CG2 4.13Å
91	E	94.7	Very high	92	Very high	32 Å²	32	27.1 Å²	27.1	15%	0.15	12%	0.118	C	C	.	.	H	α-helix	trans	-65.9	-42	-179.2	-71	175.8	167.2	0	0	111.8	K87 L94 H95 N132 I133	K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 WeakPolarHBondContact O-CG 3.31Å; K87-E91 PolarHBondContact O-N 2.95Å; E91-L94 PolarHBondContact O-N 2.91Å; E91-H95 WeakPolarHBondContact O-CB 3.31Å; E91-H95 PolarHBondContact O-N 3.31Å; E91-N132 WeakPolarHBondContact OE1-CA 3.46Å; E91-N132 PolarHBondContact OE1-N 3.33Å; E91-I133 HydrophobicContact CB-CG1 4.45Å; E91-I133 HydrophobicContact CG-CG1 4.46Å
92	T	95.1	Very high	92.1	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-44.6	174.6	-56	0	0	0	0	111	A60 L76 L81 D88 H95 E96	A60-T92 HydrophobicContact CB-CG2 3.84Å; L76-T92 HydrophobicContact CD2-CG2 3.92Å; L81-T92 HydrophobicContact CD1-CG2 4.23Å; D88-T92 WeakPolarHBondContact O-CB 3.41Å; D88-T92 PolarHBondContact O-N 3.22Å; D88-T92 PolarHBondContact O-OG1 3.32Å; T92-H95 WeakPolarHBondContact O-CB 3.44Å; T92-H95 PolarHBondContact O-N 2.69Å; T92-E96 WeakPolarHBondContact O-CG 3.34Å; T92-E96 PolarHBondContact O-N 2.87Å; T92-E96 VanDerWaalsContact O-N 3.08Å
93	L	96.1	Very high	92.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-46.5	178.5	175.8	56.6	0	0	0	111.3	L32 F36 V50 I74 L76 L89 V90 H95 E96 M97	L32-L93 HydrophobicContact CB-CD2 3.81Å; F36-L93 HydrophobicContact CD2-CD2 3.98Å; F36-L93 HydrophobicContact CD2-CG 4.32Å; F36-L93 HydrophobicContact CE2-CD2 4.08Å; V50-L93 HydrophobicContact CG2-CD1 3.88Å; I74-L93 HydrophobicContact CG2-CD1 4.2Å; L76-L93 HydrophobicContact CD1-CB 4.26Å; L76-L93 HydrophobicContact CD1-CD1 4.2Å; L89-L93 VanDerWaalsContact O-CB 3.27Å; L89-L93 WeakPolarHBondContact O-CB 3.4Å; L89-L93 PolarHBondContact O-N 2.85Å; V90-L93 PolarHBondContact O-N 3.32Å; L93-H95 VanDerWaalsContact C-N 3.33Å; L93-H95 PolarHBondContact O-N 3.42Å; L93-E96 PolarHBondContact O-N 3.25Å; L93-M97 HydrophobicContact CD1-CG 4.03Å; L93-M97 HydrophobicContact CD1-SD 3.99Å; L93-M97 HydrophobicContact CD2-SD 4.5Å; L93-M97 HydrophobicContact CG-CG 4.39Å; L93-M97 HydrophobicContact CG-SD 3.87Å; L93-M97 VanDerWaalsContact O-CG 3.24Å; L93-M97 WeakPolarHBondContact O-CG 3.24Å; L93-M97 PolarHBondContact O-N 3Å
94	L	97	Very high	92.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.5	-38.4	178	-71.9	167.2	0	0	0	111.9	F36 Y40 F41 V90 E91 M97 I98 I125 T131 I133	F36-L94 HydrophobicContact CB-CD2 3.87Å; F36-L94 HydrophobicContact CD1-CD2 4.37Å; F36-L94 HydrophobicContact CD2-CD2 3.61Å; F36-L94 HydrophobicContact CD2-CG 3.9Å; F36-L94 HydrophobicContact CE2-CD1 4.39Å; F36-L94 HydrophobicContact CE2-CD2 4.21Å; F36-L94 HydrophobicContact CE2-CG 4.03Å; F36-L94 HydrophobicContact CG-CD2 3.71Å; F36-L94 HydrophobicContact CG-CG 4.43Å; Y40-L94 HydrophobicContact CD2-CD2 3.88Å; Y40-L94 HydrophobicContact CE2-CD2 4.35Å; F41-L94 HydrophobicContact CE2-CD2 4.21Å; V90-L94 HydrophobicContact CG1-CD1 3.79Å; V90-L94 WeakPolarHBondContact O-CB 3.33Å; V90-L94 WeakPolarHBondContact O-CG 3.49Å; V90-L94 PolarHBondContact O-N 3.47Å; E91-L94 PolarHBondContact O-N 2.91Å; L94-M97 PolarHBondContact O-N 3.49Å; L94-I98 WeakPolarHBondContact O-CG1 3.23Å; L94-I98 PolarHBondContact O-N 3.25Å; L94-I125 HydrophobicContact CD1-CG2 3.92Å; L94-I125 HydrophobicContact CD2-CG2 4.21Å; L94-I125 HydrophobicContact CG-CG2 4.49Å; L94-T131 HydrophobicContact CD1-CG2 4.22Å; L94-I133 HydrophobicContact CB-CD1 3.46Å; L94-I133 VanDerWaalsContact CB-CD1 3.46Å; L94-I133 HydrophobicContact CB-CG1 4.08Å; L94-I133 HydrophobicContact CD1-CD1 4Å; L94-I133 HydrophobicContact CG-CD1 4.33Å
95	H	96.1	Very high	93	Very high	8 Å²	8	20 Å²	20	4%	0.037	10%	0.102	C	C	.	.	H	α-helix	trans	-54.6	-52.4	172.6	-177.6	107	0	0	0	111.1	E91 T92 L93 M97 I98 H99 H114 F118 I133 T134 I135 H137	E91-H95 WeakPolarHBondContact O-CB 3.31Å; E91-H95 PolarHBondContact O-N 3.31Å; T92-H95 WeakPolarHBondContact O-CB 3.44Å; T92-H95 PolarHBondContact O-N 2.69Å; L93-H95 VanDerWaalsContact C-N 3.33Å; L93-H95 PolarHBondContact O-N 3.42Å; H95-M97 VanDerWaalsContact C-N 3.34Å; H95-M97 PolarHBondContact O-N 2.93Å; H95-I98 WeakPolarHBondContact O-CB 3.23Å; H95-I98 PolarHBondContact O-N 2.61Å; H95-H99 AromaticContact CD2-CD2 3.62Å; H95-H99 AromaticContact CD2-NE2 3.78Å; H95-H99 AromaticContact NE2-CD2 3.6Å; H95-H99 AromaticContact NE2-NE2 3.23Å; H95-H99 PolarHBondContact NE2-NE2 3.41Å; H95-H99 PolarHBondContact O-N 2.86Å; H95-H114 AromaticContact CE1-CD2 3.68Å; H95-H114 AromaticContact CE1-NE2 3.24Å; H95-H114 PolarHBondContact CE1-NE2 3.43Å; H95-H114 AromaticContact NE2-CD2 3.96Å; H95-H114 AromaticContact NE2-NE2 3.22Å; H95-H114 PolarHBondContact NE2-NE2 2.96Å; H95-F118 AromaticContact CE1-CZ 3.6Å; H95-F118 AromaticContact CG-CZ 3.94Å; H95-F118 AromaticContact ND1-CZ 3.54Å; H95-I133 HydrophobicContact CB-CG2 3.99Å; H95-T134 PolarHBondContact CE1-O 3.48Å; H95-T134 PolarHBondContact ND1-O 2.82Å; H95-I135 PolarHBondContact CE1-O 3.4Å; H95-H137 AromaticContact CD2-NE2 3.99Å; H95-H137 AromaticContact CG-NE2 3.51Å; H95-H137 AromaticContact ND1-NE2 3.63Å
96	E	95.8	Very high	92.8	Very high	13 Å²	13	22.2 Å²	22.2	6%	0.061	12%	0.117	C	C	.	.	H	α-helix	trans	-65.2	-36.4	178.3	-62.7	-54.4	144.8	0	0	112.4	G61 Q62 C63 I74 L76 T92 L93 I98 H99 A100	G61-E96 VanDerWaalsContact C-CD 3.43Å; G61-E96 WeakPolarHBondContact CA-OE1 3.39Å; Q62-E96 VanDerWaalsContact CA-OE2 3.27Å; Q62-E96 WeakPolarHBondContact CA-OE2 3.41Å; Q62-E96 PolarHBondContact N-OE1 2.92Å; Q62-E96 PolarHBondContact N-OE2 3.34Å; C63-E96 PolarHBondContact N-OE2 3.45Å; C63-E96 PolarHBondContact SG-O 3.26Å; C63-E96 PolarHBondContact SG-OE2 3.49Å; I74-E96 HydrophobicContact CD1-CB 4.47Å; I74-E96 HydrophobicContact CG1-CB 4.43Å; I74-E96 HydrophobicContact CG2-CB 3.56Å; I74-E96 HydrophobicContact CG2-CG 4.12Å; L76-E96 HydrophobicContact CD2-CG 4.49Å; T92-E96 WeakPolarHBondContact O-CG 3.34Å; T92-E96 PolarHBondContact O-N 2.87Å; T92-E96 VanDerWaalsContact O-N 3.08Å; L93-E96 PolarHBondContact O-N 3.25Å; E96-I98 VanDerWaalsContact C-N 3.28Å; E96-I98 PolarHBondContact O-N 3.08Å; E96-H99 WeakPolarHBondContact O-CB 3.47Å; E96-H99 PolarHBondContact O-N 3.44Å; E96-A100 PolarHBondContact O-N 3.11Å
97	M	96.8	Very high	92.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-30.8	176.3	-70.6	176	77.1	0	0	112.6	F33 F36 D37 F41 L45 I74 L93 L94 H95 A100 Y101	F33-M97 HydrophobicContact CD2-CE 3.66Å; F33-M97 HydrophobicContact CD2-CG 4.1Å; F33-M97 HydrophobicContact CD2-SD 3.85Å; F33-M97 HydrophobicContact CE2-CE 3.84Å; F33-M97 HydrophobicContact CE2-CG 4.24Å; F33-M97 HydrophobicContact CE2-SD 4.39Å; F33-M97 HydrophobicContact CG-CE 4.45Å; F36-M97 HydrophobicContact CB-CE 3.69Å; F36-M97 HydrophobicContact CB-SD 3.78Å; F36-M97 HydrophobicContact CD2-SD 4.16Å; D37-M97 HydrophobicContact CB-CE 4.1Å; F41-M97 HydrophobicContact CD2-CB 4.33Å; F41-M97 HydrophobicContact CD2-CE 3.71Å; F41-M97 HydrophobicContact CE1-CB 4.41Å; F41-M97 HydrophobicContact CE2-CB 3.54Å; F41-M97 HydrophobicContact CE2-CE 3.78Å; F41-M97 HydrophobicContact CE2-CG 4.45Å; F41-M97 HydrophobicContact CE2-SD 4.24Å; F41-M97 HydrophobicContact CZ-CB 3.57Å; L45-M97 HydrophobicContact CD1-CB 3.85Å; L45-M97 HydrophobicContact CD1-CE 3.62Å; L45-M97 HydrophobicContact CD1-CG 4.15Å; I74-M97 HydrophobicContact CD1-CB 4.4Å; I74-M97 HydrophobicContact CD1-CG 3.64Å; L93-M97 HydrophobicContact CD1-CG 4.03Å; L93-M97 HydrophobicContact CD1-SD 3.99Å; L93-M97 HydrophobicContact CD2-SD 4.5Å; L93-M97 HydrophobicContact CG-CG 4.39Å; L93-M97 HydrophobicContact CG-SD 3.87Å; L93-M97 VanDerWaalsContact O-CG 3.24Å; L93-M97 WeakPolarHBondContact O-CG 3.24Å; L93-M97 PolarHBondContact O-N 3Å; L94-M97 PolarHBondContact O-N 3.49Å; H95-M97 VanDerWaalsContact C-N 3.34Å; H95-M97 PolarHBondContact O-N 2.93Å; M97-A100 PolarHBondContact O-N 3.22Å; M97-Y101 VanDerWaalsContact O-CB 3.31Å; M97-Y101 WeakPolarHBondContact O-CB 3.29Å; M97-Y101 PolarHBondContact O-N 3.38Å
98	I	96.1	Very high	91.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-47.2	171.3	-63.8	164.2	0	0	0	110.1	F41 L94 H95 E96 A100 Y101 L102 F118 H121 M122 I125 I133	F41-I98 HydrophobicContact CE1-CG1 4.13Å; F41-I98 HydrophobicContact CZ-CG1 4Å; L94-I98 WeakPolarHBondContact O-CG1 3.23Å; L94-I98 PolarHBondContact O-N 3.25Å; H95-I98 WeakPolarHBondContact O-CB 3.23Å; H95-I98 PolarHBondContact O-N 2.61Å; E96-I98 VanDerWaalsContact C-N 3.28Å; E96-I98 PolarHBondContact O-N 3.08Å; I98-A100 VanDerWaalsContact C-N 3.33Å; I98-A100 PolarHBondContact O-N 3.27Å; I98-Y101 PolarHBondContact O-N 2.88Å; I98-L102 HydrophobicContact CG2-CD1 4.1Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; I98-L102 WeakPolarHBondContact O-CG 3.41Å; I98-L102 PolarHBondContact O-N 3.47Å; I98-F118 HydrophobicContact CB-CD2 4.06Å; I98-F118 HydrophobicContact CB-CE2 3.71Å; I98-F118 HydrophobicContact CB-CZ 4.25Å; I98-F118 HydrophobicContact CD1-CE1 4.47Å; I98-F118 HydrophobicContact CD1-CE2 4.43Å; I98-F118 HydrophobicContact CD1-CZ 4.12Å; I98-F118 HydrophobicContact CG2-CB 4.4Å; I98-F118 HydrophobicContact CG2-CD2 3.34Å; I98-F118 HydrophobicContact CG2-CE2 3.54Å; I98-F118 HydrophobicContact CG2-CG 3.88Å; I98-F118 HydrophobicContact CG2-CZ 4.23Å; I98-H121 HydrophobicContact CD1-CB 4.3Å; I98-H121 HydrophobicContact CG1-CB 4.03Å; I98-H121 HydrophobicContact CG2-CB 3.8Å; I98-M122 HydrophobicContact CD1-CB 4.09Å; I98-I125 HydrophobicContact CD1-CD1 4.17Å; I98-I125 HydrophobicContact CG1-CD1 3.95Å; I98-I133 HydrophobicContact CD1-CD1 4.46Å; I98-I133 HydrophobicContact CD1-CG2 4.5Å
99	H	94.2	Very high	90.6	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-58.1	-46.1	174.6	-77.6	-63	0	0	0	111.6	Y65 H95 E96 Y101 L102 F103 R111 H114 F118	Y65-H99 PolarHBondContact OH-O 3.48Å; H95-H99 AromaticContact CD2-CD2 3.62Å; H95-H99 AromaticContact CD2-NE2 3.78Å; H95-H99 AromaticContact NE2-CD2 3.6Å; H95-H99 AromaticContact NE2-NE2 3.23Å; H95-H99 PolarHBondContact NE2-NE2 3.41Å; H95-H99 PolarHBondContact O-N 2.86Å; E96-H99 WeakPolarHBondContact O-CB 3.47Å; E96-H99 PolarHBondContact O-N 3.44Å; H99-Y101 VanDerWaalsContact C-N 3.32Å; H99-Y101 PolarHBondContact O-N 3.49Å; H99-L102 PolarHBondContact O-N 2.75Å; H99-F103 WeakPolarHBondContact O-CB 3.35Å; H99-F103 PolarHBondContact O-N 2.79Å; H99-R111 PolarHBondContact CE1-O 3.14Å; H99-H114 AromaticContact CE1-CD2 3.77Å; H99-H114 AromaticContact CE1-NE2 3.57Å; H99-H114 AromaticContact NE2-CD2 3.61Å; H99-H114 AromaticContact NE2-NE2 3.14Å; H99-H114 PolarHBondContact NE2-NE2 3.41Å; H99-H114 VanDerWaalsContact NE2-NE2 3.14Å; H99-F118 AromaticContact CD2-CE2 3.67Å; H99-F118 AromaticContact CE1-CD2 3.77Å; H99-F118 AromaticContact CE1-CE2 3.72Å; H99-F118 AromaticContact ND1-CD2 3.98Å; H99-F118 AromaticContact NE2-CE2 3.46Å; H99-F118 WeakPolarHBondContact NE2-CE2 3.43Å
100	A	94.2	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-43.9	175.7	0	0	0	0	0	111.9	L45 C72 I74 E96 M97 I98 F103 V104	L45-A100 HydrophobicContact CD2-CB 3.94Å; C72-A100 VanDerWaalsContact SG-CB 3.55Å; I74-A100 HydrophobicContact CD1-CB 3.95Å; I74-A100 HydrophobicContact CG1-CB 4.25Å; E96-A100 PolarHBondContact O-N 3.11Å; M97-A100 PolarHBondContact O-N 3.22Å; I98-A100 VanDerWaalsContact C-N 3.33Å; I98-A100 PolarHBondContact O-N 3.27Å; A100-F103 WeakPolarHBondContact O-CB 3.39Å; A100-F103 PolarHBondContact O-N 2.96Å; A100-V104 VanDerWaalsContact O-CG2 3.29Å; A100-V104 WeakPolarHBondContact O-CG2 3.43Å; A100-V104 PolarHBondContact O-N 3.02Å
101	Y	94.7	Very high	88.3	Confident	32 Å²	32	40.4 Å²	40.4	13%	0.125	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-45.3	180	-179.3	-94.1	0	0	0	112.4	F41 W42 R44 M97 I98 H99 F103 V104 T105 H121	F41-Y101 HydrophobicContact CB-CD2 4.1Å; F41-Y101 AromaticContact CD1-CD2 3.67Å; F41-Y101 HydrophobicContact CD1-CD2 3.67Å; F41-Y101 HydrophobicContact CD1-CE2 4.48Å; F41-Y101 AromaticContact CD1-CG 3.7Å; F41-Y101 HydrophobicContact CD1-CG 3.7Å; F41-Y101 HydrophobicContact CE1-CG 4.25Å; F41-Y101 HydrophobicContact CG-CD2 4.36Å; W42-Y101 AromaticContact CE3-CE2 3.96Å; W42-Y101 HydrophobicContact CE3-CE2 3.96Å; W42-Y101 HydrophobicContact CZ3-CE2 4.01Å; W42-Y101 AromaticContact CZ3-CZ 3.75Å; W42-Y101 WeakPolarHBondContact CZ3-OH 3.39Å; R44-Y101 HydrophobicContact CB-CD2 4.12Å; R44-Y101 HydrophobicContact CB-CE2 3.91Å; R44-Y101 HydrophobicContact CG-CE2 4.03Å; M97-Y101 VanDerWaalsContact O-CB 3.31Å; M97-Y101 WeakPolarHBondContact O-CB 3.29Å; M97-Y101 PolarHBondContact O-N 3.38Å; I98-Y101 PolarHBondContact O-N 2.88Å; H99-Y101 VanDerWaalsContact C-N 3.32Å; H99-Y101 PolarHBondContact O-N 3.49Å; Y101-F103 VanDerWaalsContact C-N 3.3Å; Y101-F103 PolarHBondContact O-N 3.11Å; Y101-V104 PolarHBondContact O-N 2.98Å; Y101-T105 HydrophobicContact CD1-CG2 4.44Å; Y101-T105 HydrophobicContact CD2-CG2 4.03Å; Y101-T105 HydrophobicContact CE1-CG2 4.06Å; Y101-T105 HydrophobicContact CE2-CG2 3.66Å; Y101-T105 HydrophobicContact CG-CG2 4.41Å; Y101-T105 WeakPolarHBondContact O-CB 3.49Å; Y101-T105 WeakPolarHBondContact O-CG2 3.46Å; Y101-T105 PolarHBondContact O-N 3.42Å; Y101-T105 PolarHBondContact O-OG1 3.08Å; Y101-H121 AromaticContact CD1-CE1 3.72Å; Y101-H121 AromaticContact CD1-NE2 3.64Å; Y101-H121 AromaticContact CE1-CE1 3.31Å; Y101-H121 WeakPolarHBondContact CE1-CE1 3.49Å; Y101-H121 AromaticContact CE1-NE2 3.32Å; Y101-H121 VanDerWaalsContact CE1-NE2 3.32Å; Y101-H121 WeakPolarHBondContact CE1-NE2 3.29Å
102	L	92.9	Very high	87.1	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-65.3	-36.4	178.1	-67	177.7	0	0	0	111.8	I98 H99 S106 N107 N108 E117 F118	I98-L102 HydrophobicContact CG2-CD1 4.1Å; I98-L102 HydrophobicContact CG2-CG 4.38Å; I98-L102 WeakPolarHBondContact O-CG 3.41Å; I98-L102 PolarHBondContact O-N 3.47Å; H99-L102 PolarHBondContact O-N 2.75Å; L102-S106 CarbonylContact O-C 3.58Å; L102-S106 WeakPolarHBondContact O-CA 3.35Å; L102-S106 VanDerWaalsContact O-CB 3.29Å; L102-S106 WeakPolarHBondContact O-CB 3.46Å; L102-S106 PolarHBondContact O-N 2.74Å; L102-N107 PolarHBondContact O-N 2.97Å; L102-N108 HydrophobicContact CB-CB 4.16Å; L102-N108 PolarHBondContact O-N 3.02Å; L102-E117 HydrophobicContact CD1-CB 4.49Å; L102-E117 HydrophobicContact CD2-CB 3.82Å; L102-F118 HydrophobicContact CD1-CB 3.9Å; L102-F118 HydrophobicContact CD1-CD2 4.26Å
103	F	88.3	Confident	86.4	Confident	29 Å²	29	45.7 Å²	45.7	13%	0.127	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-52.5	172.4	174.6	-96.7	0	0	0	111.6	Y65 C72 H99 A100 Y101 T105 N107 N108 R109	Y65-F103 HydrophobicContact CD1-CB 3.92Å; Y65-F103 AromaticContact CD1-CD1 3.24Å; Y65-F103 HydrophobicContact CD1-CD1 3.24Å; Y65-F103 AromaticContact CD1-CD2 3.45Å; Y65-F103 HydrophobicContact CD1-CD2 3.45Å; Y65-F103 VanDerWaalsContact CD1-CD2 3.45Å; Y65-F103 AromaticContact CD1-CE1 3.47Å; Y65-F103 HydrophobicContact CD1-CE1 3.47Å; Y65-F103 VanDerWaalsContact CD1-CE1 3.47Å; Y65-F103 AromaticContact CD1-CE2 3.67Å; Y65-F103 HydrophobicContact CD1-CE2 3.67Å; Y65-F103 AromaticContact CD1-CG 3.22Å; Y65-F103 HydrophobicContact CD1-CG 3.22Å; Y65-F103 AromaticContact CD1-CZ 3.68Å; Y65-F103 HydrophobicContact CD1-CZ 3.68Å; Y65-F103 HydrophobicContact CD2-CD2 4.18Å; Y65-F103 HydrophobicContact CD2-CE2 4.4Å; Y65-F103 HydrophobicContact CE1-CB 3.26Å; Y65-F103 AromaticContact CE1-CD1 3.44Å; Y65-F103 HydrophobicContact CE1-CD1 3.44Å; Y65-F103 VanDerWaalsContact CE1-CD1 3.44Å; Y65-F103 AromaticContact CE1-CD2 3.68Å; Y65-F103 HydrophobicContact CE1-CD2 3.68Å; Y65-F103 HydrophobicContact CE1-CE1 4.16Å; Y65-F103 HydrophobicContact CE1-CE2 4.36Å; Y65-F103 AromaticContact CE1-CG 3.15Å; Y65-F103 HydrophobicContact CE1-CG 3.15Å; Y65-F103 HydrophobicContact CE2-CD2 4.4Å; Y65-F103 HydrophobicContact CG-CD1 4.22Å; Y65-F103 AromaticContact CG-CD2 3.69Å; Y65-F103 HydrophobicContact CG-CD2 3.69Å; Y65-F103 HydrophobicContact CG-CE1 4.2Å; Y65-F103 AromaticContact CG-CE2 3.66Å; Y65-F103 HydrophobicContact CG-CE2 3.66Å; Y65-F103 AromaticContact CG-CG 3.98Å; Y65-F103 HydrophobicContact CG-CG 3.98Å; Y65-F103 AromaticContact CG-CZ 3.92Å; Y65-F103 HydrophobicContact CG-CZ 3.92Å; Y65-F103 AromaticContact CZ-CG 3.88Å; C72-F103 HydrophobicContact CB-CD1 4.29Å; C72-F103 HydrophobicContact CB-CE1 4.49Å; H99-F103 WeakPolarHBondContact O-CB 3.35Å; H99-F103 PolarHBondContact O-N 2.79Å; A100-F103 WeakPolarHBondContact O-CB 3.39Å; A100-F103 PolarHBondContact O-N 2.96Å; Y101-F103 VanDerWaalsContact C-N 3.3Å; Y101-F103 PolarHBondContact O-N 3.11Å; F103-T105 PolarHBondContact O-N 3.25Å; F103-N107 VanDerWaalsContact O-CA 3.23Å; F103-N107 WeakPolarHBondContact O-CA 3.42Å; F103-N107 PolarHBondContact O-N 2.92Å; F103-N108 WeakPolarHBondContact CA-O 3.4Å; F103-R109 HydrophobicContact CE2-CG 4.44Å
104	V	88.2	Confident	86.1	Confident	65 Å²	65	47.2 Å²	47.2	39%	0.394	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-41.1	-175.7	170.6	0	0	0	0	112	A100 Y101	A100-V104 VanDerWaalsContact O-CG2 3.29Å; A100-V104 WeakPolarHBondContact O-CG2 3.43Å; A100-V104 PolarHBondContact O-N 3.02Å; Y101-V104 PolarHBondContact O-N 2.98Å
105	T	87.9	Confident	85.8	Confident	59 Å²	59	48.7 Å²	48.7	36%	0.362	25%	0.253	S	S	.	.	H	α-helix	trans	-93.1	-31.4	-171.5	59	0	0	0	0	114.1	Y101 F103	Y101-T105 HydrophobicContact CD1-CG2 4.44Å; Y101-T105 HydrophobicContact CD2-CG2 4.03Å; Y101-T105 HydrophobicContact CE1-CG2 4.06Å; Y101-T105 HydrophobicContact CE2-CG2 3.66Å; Y101-T105 HydrophobicContact CG-CG2 4.41Å; Y101-T105 WeakPolarHBondContact O-CB 3.49Å; Y101-T105 WeakPolarHBondContact O-CG2 3.46Å; Y101-T105 PolarHBondContact O-N 3.42Å; Y101-T105 PolarHBondContact O-OG1 3.08Å; F103-T105 PolarHBondContact O-N 3.25Å
106	S	83.1	Confident	85.6	Confident	75 Å²	75	53.3 Å²	53.3	52%	0.524	28%	0.284	S	S	.	.	H	α-helix	trans	-119.7	-0.4	-170.6	-53.3	0	0	0	0	112.7	L102 N108	L102-S106 CarbonylContact O-C 3.58Å; L102-S106 WeakPolarHBondContact O-CA 3.35Å; L102-S106 VanDerWaalsContact O-CB 3.29Å; L102-S106 WeakPolarHBondContact O-CB 3.46Å; L102-S106 PolarHBondContact O-N 2.74Å; S106-N108 PolarHBondContact O-N 2.99Å; S106-N108 VanDerWaalsContact O-N 3.08Å
107	N	78.1	Confident	85.5	Confident	93 Å²	93	57.2 Å²	57.2	50%	0.497	30%	0.302	S	S	.	.			trans	49.8	32.2	-171	-174	48.1	0	0	0	111.2	L102 F103 R109	L102-N107 PolarHBondContact O-N 2.97Å; F103-N107 VanDerWaalsContact O-CA 3.23Å; F103-N107 WeakPolarHBondContact O-CA 3.42Å; F103-N107 PolarHBondContact O-N 2.92Å; N107-R109 PolarHBondContact O-N 3.14Å; N107-R109 PolarHBondContact OD1-NE 3.41Å; N107-R109 PolarHBondContact OD1-NH2 3.4Å
108	N	77.3	Confident	85.4	Confident	57 Å²	57	57.2 Å²	57.2	31%	0.305	30%	0.302	S	S	.	.			trans	-74.1	112.1	173.9	-174.9	-5	0	0	0	107.8	L102 F103 S106 D110	L102-N108 HydrophobicContact CB-CB 4.16Å; L102-N108 PolarHBondContact O-N 3.02Å; F103-N108 WeakPolarHBondContact CA-O 3.4Å; S106-N108 PolarHBondContact O-N 2.99Å; S106-N108 VanDerWaalsContact O-N 3.08Å; N108-D110 WeakPolarHBondContact OD1-CB 3.24Å; N108-D110 PolarHBondContact OD1-N 3.41Å
109	R	69.7	Low	85.4	Confident	141 Å²	141	60.7 Å²	60.7	53%	0.532	32%	0.319	S	S	.	.			trans	-100.7	0.3	-175.6	-62.6	177	-174.3	-173.1	-0.9	112.7	F103 N107 R111	F103-R109 HydrophobicContact CE2-CG 4.44Å; N107-R109 PolarHBondContact O-N 3.14Å; N107-R109 PolarHBondContact OD1-NE 3.41Å; N107-R109 PolarHBondContact OD1-NH2 3.4Å; R109-R111 PolarHBondContact O-N 3.28Å; R109-R111 VanDerWaalsContact O-N 3.1Å
110	D	72.4	Confident	85.4	Confident	94 Å²	94	66.4 Å²	66.4	50%	0.503	34%	0.343	S	S	.	.			trans	-71.5	106.9	177.7	-168.9	-1.1	0	0	0	109.1	N108 D112 G113	N108-D110 WeakPolarHBondContact OD1-CB 3.24Å; N108-D110 PolarHBondContact OD1-N 3.41Å; D110-D112 VanDerWaalsContact C-N 3.29Å; D110-D112 PolarHBondContact OD1-N 3.22Å; D110-G113 VanDerWaalsContact CG-N 3.31Å; D110-G113 PolarHBondContact O-N 3.23Å; D110-G113 PolarHBondContact OD1-N 3.31Å; D110-G113 WeakPolarHBondContact OD2-CA 3.24Å
111	R	65.2	Low	85.6	Confident	135 Å²	135	67.2 Å²	67.2	51%	0.509	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-30.5	-177	-69.9	-175.7	171.8	-175.8	-3.1	112	H99 R109	H99-R111 PolarHBondContact CE1-O 3.14Å; R109-R111 PolarHBondContact O-N 3.28Å; R109-R111 VanDerWaalsContact O-N 3.1Å
112	D	70.7	Confident	85.7	Confident	135 Å²	135	66.3 Å²	66.3	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	12	178.7	-57.5	-41.4	0	0	0	110.3	D110 H114	D110-D112 VanDerWaalsContact C-N 3.29Å; D110-D112 PolarHBondContact OD1-N 3.22Å; D112-H114 PolarHBondContact O-N 3.24Å; D112-H114 PolarHBondContact O-ND1 3.18Å
113	G	79	Confident	85.9	Confident	7 Å²	7	71.4 Å²	71.4	7%	0.072	37%	0.367	C	S	.	.			trans	-80	82.2	-173.1	0	0	0	0	0	112.5	D110 G115	D110-G113 VanDerWaalsContact CG-N 3.31Å; D110-G113 PolarHBondContact O-N 3.23Å; D110-G113 PolarHBondContact OD1-N 3.31Å; D110-G113 WeakPolarHBondContact OD2-CA 3.24Å; G113-G115 PolarHBondContact O-N 3.19Å; G113-G115 VanDerWaalsContact O-N 3.17Å
114	H	90.7	Very high	86.4	Confident	32 Å²	32	73.9 Å²	73.9	15%	0.148	38%	0.376	C	S	.	.			trans	-86.4	41.5	169.6	-51.8	101.7	0	0	0	112.2	H95 H99 D112 F118 Q119 I135	H95-H114 AromaticContact CE1-CD2 3.68Å; H95-H114 AromaticContact CE1-NE2 3.24Å; H95-H114 PolarHBondContact CE1-NE2 3.43Å; H95-H114 AromaticContact NE2-CD2 3.96Å; H95-H114 AromaticContact NE2-NE2 3.22Å; H95-H114 PolarHBondContact NE2-NE2 2.96Å; H99-H114 AromaticContact CE1-CD2 3.77Å; H99-H114 AromaticContact CE1-NE2 3.57Å; H99-H114 AromaticContact NE2-CD2 3.61Å; H99-H114 AromaticContact NE2-NE2 3.14Å; H99-H114 PolarHBondContact NE2-NE2 3.41Å; H99-H114 VanDerWaalsContact NE2-NE2 3.14Å; D112-H114 PolarHBondContact O-N 3.24Å; D112-H114 PolarHBondContact O-ND1 3.18Å; H114-F118 HydrophobicContact CB-CD1 4.12Å; H114-F118 HydrophobicContact CB-CG 4.33Å; H114-F118 AromaticContact CD2-CD1 3.86Å; H114-F118 AromaticContact CD2-CD2 3.96Å; H114-F118 AromaticContact CD2-CE1 3.7Å; H114-F118 AromaticContact CD2-CE2 3.79Å; H114-F118 AromaticContact CD2-CZ 3.68Å; H114-Q119 PolarHBondContact O-NE2 3.29Å; H114-I135 HydrophobicContact CB-CB 4.36Å; H114-I135 HydrophobicContact CB-CD1 4.13Å; H114-I135 HydrophobicContact CB-CG1 3.97Å; H114-I135 HydrophobicContact CB-CG2 3.7Å
115	G	89.8	Confident	86.8	Confident	31 Å²	31	70.8 Å²	70.8	32%	0.32	36%	0.357	S	S	.	.			trans	-67.5	-174.7	-177.9	0	0	0	0	0	113.8	G113 E117 F118 Q119	G113-G115 PolarHBondContact O-N 3.19Å; G113-G115 VanDerWaalsContact O-N 3.17Å; G115-E117 VanDerWaalsContact C-N 3.26Å; G115-E117 PolarHBondContact O-N 3.44Å; G115-E117 VanDerWaalsContact O-N 3.14Å; G115-F118 WeakPolarHBondContact O-CB 3.09Å; G115-F118 PolarHBondContact O-N 2.7Å; G115-Q119 PolarHBondContact O-N 2.91Å
116	P	92.7	Very high	87.2	Confident	106 Å²	106	69.1 Å²	69.1	69%	0.688	35%	0.346	S	S	*	.	H	α-helix	trans	-53.5	-38.4	-176.3	-28.8	35.9	0	0	0	114.4	Q119 K120	P116-Q119 PolarHBondContact O-N 3.32Å; P116-K120 WeakPolarHBondContact O-CB 3.33Å; P116-K120 PolarHBondContact O-N 3.36Å
117	E	93	Very high	87.9	Confident	94 Å²	94	74.5 Å²	74.5	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-67.5	-38.8	177.6	-66.6	-53.7	125	0	0	112.4	L102 G115 K120 H121	L102-E117 HydrophobicContact CD1-CB 4.49Å; L102-E117 HydrophobicContact CD2-CB 3.82Å; G115-E117 VanDerWaalsContact C-N 3.26Å; G115-E117 PolarHBondContact O-N 3.44Å; G115-E117 VanDerWaalsContact O-N 3.14Å; E117-K120 PolarHBondContact O-N 2.83Å; E117-H121 PolarHBondContact O-CD2 3.45Å; E117-H121 VanDerWaalsContact O-CD2 3.25Å; E117-H121 PolarHBondContact O-N 3.45Å
118	F	94.9	Very high	88.7	Confident	1 Å²	1	73.3 Å²	73.3	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-50.9	173.5	-176.6	-79	0	0	0	110.3	H95 I98 H99 L102 H114 G115 K120 H121 M122	H95-F118 AromaticContact CE1-CZ 3.6Å; H95-F118 AromaticContact CG-CZ 3.94Å; H95-F118 AromaticContact ND1-CZ 3.54Å; I98-F118 HydrophobicContact CB-CD2 4.06Å; I98-F118 HydrophobicContact CB-CE2 3.71Å; I98-F118 HydrophobicContact CB-CZ 4.25Å; I98-F118 HydrophobicContact CD1-CE1 4.47Å; I98-F118 HydrophobicContact CD1-CE2 4.43Å; I98-F118 HydrophobicContact CD1-CZ 4.12Å; I98-F118 HydrophobicContact CG2-CB 4.4Å; I98-F118 HydrophobicContact CG2-CD2 3.34Å; I98-F118 HydrophobicContact CG2-CE2 3.54Å; I98-F118 HydrophobicContact CG2-CG 3.88Å; I98-F118 HydrophobicContact CG2-CZ 4.23Å; H99-F118 AromaticContact CD2-CE2 3.67Å; H99-F118 AromaticContact CE1-CD2 3.77Å; H99-F118 AromaticContact CE1-CE2 3.72Å; H99-F118 AromaticContact ND1-CD2 3.98Å; H99-F118 AromaticContact NE2-CE2 3.46Å; H99-F118 WeakPolarHBondContact NE2-CE2 3.43Å; L102-F118 HydrophobicContact CD1-CB 3.9Å; L102-F118 HydrophobicContact CD1-CD2 4.26Å; H114-F118 HydrophobicContact CB-CD1 4.12Å; H114-F118 HydrophobicContact CB-CG 4.33Å; H114-F118 AromaticContact CD2-CD1 3.86Å; H114-F118 AromaticContact CD2-CD2 3.96Å; H114-F118 AromaticContact CD2-CE1 3.7Å; H114-F118 AromaticContact CD2-CE2 3.79Å; H114-F118 AromaticContact CD2-CZ 3.68Å; G115-F118 WeakPolarHBondContact O-CB 3.09Å; G115-F118 PolarHBondContact O-N 2.7Å; F118-K120 VanDerWaalsContact C-N 3.27Å; F118-K120 PolarHBondContact O-N 3.46Å; F118-H121 PolarHBondContact O-N 2.89Å; F118-H121 VanDerWaalsContact O-N 3.11Å; F118-M122 HydrophobicContact CD1-CB 4.29Å; F118-M122 HydrophobicContact CD1-SD 4.5Å; F118-M122 HydrophobicContact CE1-CB 4.07Å; F118-M122 HydrophobicContact CE1-CG 4.37Å; F118-M122 HydrophobicContact CE1-SD 4.01Å; F118-M122 WeakPolarHBondContact O-CB 3.43Å; F118-M122 PolarHBondContact O-N 3.14Å
119	Q	95.8	Very high	89.4	Confident	73 Å²	73	71.8 Å²	71.8	34%	0.341	36%	0.358	S	S	.	.	H	α-helix	trans	-60.3	-38.3	-178.3	-67.4	176.2	40.5	0	0	111.7	H114 G115 P116 H121 M122 H123 I135	H114-Q119 PolarHBondContact O-NE2 3.29Å; G115-Q119 PolarHBondContact O-N 2.91Å; P116-Q119 PolarHBondContact O-N 3.32Å; Q119-H121 PolarHBondContact O-N 3.46Å; Q119-M122 HydrophobicContact CB-CE 4.45Å; Q119-M122 HydrophobicContact CG-CE 4.35Å; Q119-M122 WeakPolarHBondContact O-CB 3.36Å; Q119-M122 PolarHBondContact O-N 2.81Å; Q119-H123 WeakPolarHBondContact O-CB 3.38Å; Q119-H123 PolarHBondContact O-CD2 3.19Å; Q119-H123 VanDerWaalsContact O-CG 3.32Å; Q119-H123 PolarHBondContact O-N 2.95Å; Q119-I135 HydrophobicContact CG-CD1 4.21Å
120	K	95.6	Very high	90.5	Very high	132 Å²	132	71.7 Å²	71.7	57%	0.574	36%	0.362	S	S	*	.	H	α-helix	trans	-58.5	-47	174.3	-179.4	-178.6	175	-173.8	0	112.4	P116 E117 F118 R124	P116-K120 WeakPolarHBondContact O-CB 3.33Å; P116-K120 PolarHBondContact O-N 3.36Å; E117-K120 PolarHBondContact O-N 2.83Å; F118-K120 VanDerWaalsContact C-N 3.27Å; F118-K120 PolarHBondContact O-N 3.46Å; K120-R124 WeakPolarHBondContact O-CB 3.27Å; K120-R124 PolarHBondContact O-N 3.45Å; K120-R124 VanDerWaalsContact O-N 3.12Å
121	H	97.1	Very high	91.5	Very high	16 Å²	16	68.1 Å²	68.1	7%	0.074	34%	0.343	C	S	.	.	H	α-helix	trans	-69.1	-40.8	176.7	-76.3	-77.4	0	0	0	112.2	I98 Y101 E117 F118 Q119 R124 I125	I98-H121 HydrophobicContact CD1-CB 4.3Å; I98-H121 HydrophobicContact CG1-CB 4.03Å; I98-H121 HydrophobicContact CG2-CB 3.8Å; Y101-H121 AromaticContact CD1-CE1 3.72Å; Y101-H121 AromaticContact CD1-NE2 3.64Å; Y101-H121 AromaticContact CE1-CE1 3.31Å; Y101-H121 WeakPolarHBondContact CE1-CE1 3.49Å; Y101-H121 AromaticContact CE1-NE2 3.32Å; Y101-H121 VanDerWaalsContact CE1-NE2 3.32Å; Y101-H121 WeakPolarHBondContact CE1-NE2 3.29Å; E117-H121 PolarHBondContact O-CD2 3.45Å; E117-H121 VanDerWaalsContact O-CD2 3.25Å; E117-H121 PolarHBondContact O-N 3.45Å; F118-H121 PolarHBondContact O-N 2.89Å; F118-H121 VanDerWaalsContact O-N 3.11Å; Q119-H121 PolarHBondContact O-N 3.46Å; H121-R124 PolarHBondContact ND1-NH2 3.03Å; H121-R124 VanDerWaalsContact ND1-NH2 3.13Å; H121-R124 PolarHBondContact O-N 3.19Å; H121-I125 WeakPolarHBondContact O-CB 3.14Å; H121-I125 VanDerWaalsContact O-CG1 3.25Å; H121-I125 WeakPolarHBondContact O-CG1 3.46Å; H121-I125 PolarHBondContact O-N 3.47Å
122	M	97.3	Very high	92.9	Very high	14 Å²	14	66.8 Å²	66.8	7%	0.069	35%	0.346	C	S	.	.	H	α-helix	trans	-55.8	-53.6	175.4	-179.3	-173.7	75.6	0	0	111.3	I98 F118 Q119 R124 I125 N126 I133 I135	I98-M122 HydrophobicContact CD1-CB 4.09Å; F118-M122 HydrophobicContact CD1-CB 4.29Å; F118-M122 HydrophobicContact CD1-SD 4.5Å; F118-M122 HydrophobicContact CE1-CB 4.07Å; F118-M122 HydrophobicContact CE1-CG 4.37Å; F118-M122 HydrophobicContact CE1-SD 4.01Å; F118-M122 WeakPolarHBondContact O-CB 3.43Å; F118-M122 PolarHBondContact O-N 3.14Å; Q119-M122 HydrophobicContact CB-CE 4.45Å; Q119-M122 HydrophobicContact CG-CE 4.35Å; Q119-M122 WeakPolarHBondContact O-CB 3.36Å; Q119-M122 PolarHBondContact O-N 2.81Å; M122-R124 PolarHBondContact O-N 2.87Å; M122-I125 PolarHBondContact O-N 3.43Å; M122-N126 WeakPolarHBondContact O-CB 3.37Å; M122-N126 VanDerWaalsContact O-CG 3.3Å; M122-N126 PolarHBondContact O-N 3.13Å; M122-I133 HydrophobicContact CG-CB 3.98Å; M122-I133 HydrophobicContact CG-CG2 3.93Å; M122-I133 VanDerWaalsContact CG-O 3.28Å; M122-I133 WeakPolarHBondContact CG-O 3.18Å; M122-I133 VanDerWaalsContact SD-O 3.33Å; M122-I135 HydrophobicContact SD-CG1 4.14Å
123	H	97.5	Very high	94	Very high	110 Å²	110	60.4 Å²	60.4	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-42.1	179.8	-68.8	-51.7	0	0	0	112.8	Q119 I125 K127	Q119-H123 WeakPolarHBondContact O-CB 3.38Å; Q119-H123 PolarHBondContact O-CD2 3.19Å; Q119-H123 VanDerWaalsContact O-CG 3.32Å; Q119-H123 PolarHBondContact O-N 2.95Å; H123-I125 VanDerWaalsContact C-N 3.35Å; H123-I125 PolarHBondContact O-N 3.43Å; H123-K127 WeakPolarHBondContact O-CB 3.31Å; H123-K127 PolarHBondContact O-N 3.37Å
124	R	97.8	Very high	94.7	Very high	81 Å²	81	62.4 Å²	62.4	31%	0.306	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-45	176.6	178.7	-172.2	60.3	96.3	6.7	111.4	Y40 K120 H121 M122 A128	Y40-R124 PolarHBondContact O-NH1 3.42Å; Y40-R124 PolarHBondContact O-NH2 2.92Å; K120-R124 WeakPolarHBondContact O-CB 3.27Å; K120-R124 PolarHBondContact O-N 3.45Å; K120-R124 VanDerWaalsContact O-N 3.12Å; H121-R124 PolarHBondContact ND1-NH2 3.03Å; H121-R124 VanDerWaalsContact ND1-NH2 3.13Å; H121-R124 PolarHBondContact O-N 3.19Å; M122-R124 PolarHBondContact O-N 2.87Å; R124-A128 WeakPolarHBondContact O-CB 3.35Å; R124-A128 PolarHBondContact O-N 2.87Å; R124-A128 VanDerWaalsContact O-N 3.09Å
125	I	97.6	Very high	94.7	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-70.7	-45.3	-178.9	-67.2	170.1	0	0	0	110.4	Y40 F41 L94 I98 H121 M122 H123 K127 A128 A129 I133	Y40-I125 HydrophobicContact CG-CG1 4.32Å; Y40-I125 HydrophobicContact CG-CG2 4.49Å; F41-I125 HydrophobicContact CE1-CD1 3.98Å; F41-I125 HydrophobicContact CE2-CD1 4.11Å; F41-I125 HydrophobicContact CZ-CD1 3.49Å; F41-I125 VanDerWaalsContact CZ-CD1 3.49Å; L94-I125 HydrophobicContact CD1-CG2 3.92Å; L94-I125 HydrophobicContact CD2-CG2 4.21Å; L94-I125 HydrophobicContact CG-CG2 4.49Å; I98-I125 HydrophobicContact CD1-CD1 4.17Å; I98-I125 HydrophobicContact CG1-CD1 3.95Å; H121-I125 WeakPolarHBondContact O-CB 3.14Å; H121-I125 VanDerWaalsContact O-CG1 3.25Å; H121-I125 WeakPolarHBondContact O-CG1 3.46Å; H121-I125 PolarHBondContact O-N 3.47Å; M122-I125 PolarHBondContact O-N 3.43Å; H123-I125 VanDerWaalsContact C-N 3.35Å; H123-I125 PolarHBondContact O-N 3.43Å; I125-K127 VanDerWaalsContact C-N 3.25Å; I125-K127 PolarHBondContact O-N 2.96Å; I125-A128 PolarHBondContact O-N 2.83Å; I125-A129 HydrophobicContact CG2-CB 4.22Å; I125-A129 VanDerWaalsContact O-CB 3.28Å; I125-A129 WeakPolarHBondContact O-CB 3.29Å; I125-A129 PolarHBondContact O-N 2.91Å; I125-I133 HydrophobicContact CB-CD1 4.04Å; I125-I133 HydrophobicContact CG2-CD1 3.54Å
126	N	97	Very high	94.3	Very high	24 Å²	24	70.3 Å²	70.3	13%	0.128	35%	0.346	C	S	.	.	H	α-helix	trans	-54.4	-43.6	175.8	-75.6	-9	0	0	0	112.1	M122 K130 T131 I133	M122-N126 WeakPolarHBondContact O-CB 3.37Å; M122-N126 VanDerWaalsContact O-CG 3.3Å; M122-N126 PolarHBondContact O-N 3.13Å; N126-K130 VanDerWaalsContact O-CA 3.27Å; N126-K130 WeakPolarHBondContact O-CA 3.49Å; N126-K130 PolarHBondContact O-N 2.77Å; N126-T131 WeakPolarHBondContact CA-O 3.42Å; N126-T131 WeakPolarHBondContact CB-O 3.18Å; N126-T131 PolarHBondContact O-N 2.79Å; N126-T131 PolarHBondContact OD1-O 3.32Å; N126-T131 PolarHBondContact OD1-OG1 3.41Å; N126-I133 PolarHBondContact ND2-N 2.53Å; N126-I133 PolarHBondContact ND2-O 2.6Å; N126-I133 VanDerWaalsContact OD1-CB 3.23Å; N126-I133 WeakPolarHBondContact OD1-CB 3.39Å; N126-I133 WeakPolarHBondContact OD1-CD1 3.34Å; N126-I133 VanDerWaalsContact OD1-CG1 3.23Å; N126-I133 WeakPolarHBondContact OD1-CG1 3.42Å; N126-I133 PolarHBondContact OD1-N 3.25Å
127	K	96.1	Very high	93.5	Very high	189 Å²	189	67.2 Å²	67.2	82%	0.822	32%	0.322	S	S	*	.	H	α-helix	trans	-64.4	-43	175.8	-174.7	176.5	180	178.4	0	112.7	H123 I125	H123-K127 WeakPolarHBondContact O-CB 3.31Å; H123-K127 PolarHBondContact O-N 3.37Å; I125-K127 VanDerWaalsContact C-N 3.25Å; I125-K127 PolarHBondContact O-N 2.96Å
128	A	95	Very high	92.4	Very high	67 Å²	67	66.9 Å²	66.9	55%	0.554	33%	0.33	S	S	*	.	H	α-helix	trans	-78.8	-37.7	-174.8	0	0	0	0	0	113.5	Y40 R124 I125	Y40-A128 HydrophobicContact CE1-CB 4.03Å; R124-A128 WeakPolarHBondContact O-CB 3.35Å; R124-A128 PolarHBondContact O-N 2.87Å; R124-A128 VanDerWaalsContact O-N 3.09Å; I125-A128 PolarHBondContact O-N 2.83Å
129	A	92.8	Very high	91.6	Very high	25 Å²	25	67.5 Å²	67.5	21%	0.207	33%	0.333	C	S	.	.	H	α-helix	trans	-95.7	-6.6	-175.3	0	0	0	0	0	113.3	Y40 I125 T131	Y40-A129 HydrophobicContact CE1-CB 4.24Å; Y40-A129 HydrophobicContact CE2-CB 4.22Å; Y40-A129 VanDerWaalsContact OH-CB 3.26Å; Y40-A129 WeakPolarHBondContact OH-CB 3.34Å; I125-A129 HydrophobicContact CG2-CB 4.22Å; I125-A129 VanDerWaalsContact O-CB 3.28Å; I125-A129 WeakPolarHBondContact O-CB 3.29Å; I125-A129 PolarHBondContact O-N 2.91Å; A129-T131 HydrophobicContact CB-CG2 3.77Å; A129-T131 PolarHBondContact O-N 2.95Å
130	K	92.7	Very high	90.8	Very high	140 Å²	140	70.3 Å²	70.3	61%	0.609	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	39.3	-170.5	-57.7	-177.7	177.5	-179.4	0	112.2	D13 N126	D13-K130 IonicContact OD1-NZ 2.66Å; D13-K130 PolarHBondContact OD1-NZ 2.77Å; N126-K130 VanDerWaalsContact O-CA 3.27Å; N126-K130 WeakPolarHBondContact O-CA 3.49Å; N126-K130 PolarHBondContact O-N 2.77Å
131	T	93.3	Very high	90.1	Very high	19 Å²	19	70.3 Å²	70.3	12%	0.117	35%	0.352	C	S	.	.			trans	-102.7	168.8	176.5	56.3	0	0	0	0	111.2	V90 L94 N126 A129	V90-T131 HydrophobicContact CG1-CG2 4.13Å; L94-T131 HydrophobicContact CD1-CG2 4.22Å; N126-T131 WeakPolarHBondContact CA-O 3.42Å; N126-T131 WeakPolarHBondContact CB-O 3.18Å; N126-T131 PolarHBondContact O-N 2.79Å; N126-T131 PolarHBondContact OD1-O 3.32Å; N126-T131 PolarHBondContact OD1-OG1 3.41Å; A129-T131 HydrophobicContact CB-CG2 3.77Å; A129-T131 PolarHBondContact O-N 2.95Å
132	N	94.2	Very high	89.5	Confident	106 Å²	106	72 Å²	72	57%	0.567	36%	0.36	S	S	*	.			trans	-123.4	57.1	174.1	-171.1	39.7	0	0	0	111.5	E91 T134	E91-N132 WeakPolarHBondContact OE1-CA 3.46Å; E91-N132 PolarHBondContact OE1-N 3.33Å; N132-T134 PolarHBondContact O-N 3.21Å
133	I	94.3	Very high	88.8	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.01	36%	0.36	C	S	.	.			trans	-58	125.8	171.6	-55.7	160.9	0	0	0	108.4	E91 L94 H95 I98 M122 I125 N126	E91-I133 HydrophobicContact CB-CG1 4.45Å; E91-I133 HydrophobicContact CG-CG1 4.46Å; L94-I133 HydrophobicContact CB-CD1 3.46Å; L94-I133 VanDerWaalsContact CB-CD1 3.46Å; L94-I133 HydrophobicContact CB-CG1 4.08Å; L94-I133 HydrophobicContact CD1-CD1 4Å; L94-I133 HydrophobicContact CG-CD1 4.33Å; H95-I133 HydrophobicContact CB-CG2 3.99Å; I98-I133 HydrophobicContact CD1-CD1 4.46Å; I98-I133 HydrophobicContact CD1-CG2 4.5Å; M122-I133 HydrophobicContact CG-CB 3.98Å; M122-I133 HydrophobicContact CG-CG2 3.93Å; M122-I133 VanDerWaalsContact CG-O 3.28Å; M122-I133 WeakPolarHBondContact CG-O 3.18Å; M122-I133 VanDerWaalsContact SD-O 3.33Å; I125-I133 HydrophobicContact CB-CD1 4.04Å; I125-I133 HydrophobicContact CG2-CD1 3.54Å; N126-I133 PolarHBondContact ND2-N 2.53Å; N126-I133 PolarHBondContact ND2-O 2.6Å; N126-I133 VanDerWaalsContact OD1-CB 3.23Å; N126-I133 WeakPolarHBondContact OD1-CB 3.39Å; N126-I133 WeakPolarHBondContact OD1-CD1 3.34Å; N126-I133 VanDerWaalsContact OD1-CG1 3.23Å; N126-I133 WeakPolarHBondContact OD1-CG1 3.42Å; N126-I133 PolarHBondContact OD1-N 3.25Å
134	T	93.1	Very high	88.2	Confident	49 Å²	49	70 Å²	70	30%	0.301	35%	0.354	S	S	.	.			trans	-113.5	164.5	177.2	56.3	0	0	0	0	111.3	H95 N132 Y136	H95-T134 PolarHBondContact CE1-O 3.48Å; H95-T134 PolarHBondContact ND1-O 2.82Å; N132-T134 PolarHBondContact O-N 3.21Å; T134-Y136 WeakPolarHBondContact CB-O 3.18Å; T134-Y136 PolarHBondContact OG1-O 3.34Å
135	I	90.7	Very high	87.7	Confident	44 Å²	44	73.5 Å²	73.5	23%	0.226	37%	0.371	C	S	.	.	S	Bend	trans	-67.8	-40	172.2	-68.5	179	0	0	0	110.8	H95 H114 Q119 M122	H95-I135 PolarHBondContact CE1-O 3.4Å; H114-I135 HydrophobicContact CB-CB 4.36Å; H114-I135 HydrophobicContact CB-CD1 4.13Å; H114-I135 HydrophobicContact CB-CG1 3.97Å; H114-I135 HydrophobicContact CB-CG2 3.7Å; Q119-I135 HydrophobicContact CG-CD1 4.21Å; M122-I135 HydrophobicContact SD-CG1 4.14Å
136	Y	82.7	Confident	87.1	Confident	185 Å²	185	76.6 Å²	76.6	73%	0.725	38%	0.384	S	S	*	.	S	Bend	trans	-119.6	131.1	179.6	-55.7	-65.1	0	0	0	109.4	T134	T134-Y136 WeakPolarHBondContact CB-O 3.18Å; T134-Y136 PolarHBondContact OG1-O 3.34Å
137	H	74.1	Confident	86.8	Confident	41 Å²	41	79.4 Å²	79.4	19%	0.19	39%	0.393	C	S	.	.			trans	-90.8	143.1	172.5	-60.5	-76.1	0	0	0	111.6	H95 F139	H95-H137 AromaticContact CD2-NE2 3.99Å; H95-H137 AromaticContact CG-NE2 3.51Å; H95-H137 AromaticContact ND1-NE2 3.63Å; H137-F139 HydrophobicContact CB-CD2 3.33Å; H137-F139 HydrophobicContact CB-CE2 3.13Å; H137-F139 HydrophobicContact CB-CG 4.49Å; H137-F139 HydrophobicContact CB-CZ 4.18Å; H137-F139 AromaticContact CG-CE2 3.55Å; H137-F139 PolarHBondContact O-N 2.85Å
138	S	70.1	Confident	86.6	Confident	87 Å²	87	72.5 Å²	72.5	61%	0.608	37%	0.366	S	S	*	.			trans	-90.9	72.7	176.2	49.2	0	0	0	0	111.7
139	F	78.3	Confident	86.7	Confident	13 Å²	13	70.3 Å²	70.3	6%	0.057	34%	0.344	C	S	.	.			trans	-105.4	24.8	171.1	-59.1	-71.1	0	0	0	112.4	A60 L81 H137 D141 E142 V143	A60-F139 HydrophobicContact CB-CD1 4.37Å; A60-F139 HydrophobicContact CB-CD2 3.51Å; A60-F139 HydrophobicContact CB-CE1 4.02Å; A60-F139 HydrophobicContact CB-CE2 3.06Å; A60-F139 HydrophobicContact CB-CG 4.15Å; A60-F139 HydrophobicContact CB-CZ 3.38Å; L81-F139 HydrophobicContact CD2-CE1 4.06Å; L81-F139 HydrophobicContact CD2-CZ 3.94Å; H137-F139 HydrophobicContact CB-CD2 3.33Å; H137-F139 HydrophobicContact CB-CE2 3.13Å; H137-F139 HydrophobicContact CB-CG 4.49Å; H137-F139 HydrophobicContact CB-CZ 4.18Å; H137-F139 AromaticContact CG-CE2 3.55Å; H137-F139 PolarHBondContact O-N 2.85Å; F139-D141 PolarHBondContact O-N 3.19Å; F139-E142 WeakPolarHBondContact CA-OE2 3.45Å; F139-E142 PolarHBondContact O-N 3.17Å; F139-V143 HydrophobicContact CB-CG2 4.08Å; F139-V143 VanDerWaalsContact O-CB 3.24Å; F139-V143 WeakPolarHBondContact O-CB 3.33Å; F139-V143 WeakPolarHBondContact O-CG2 3.23Å; F139-V143 PolarHBondContact O-N 3.32Å
140	H	78.9	Confident	86.9	Confident	132 Å²	132	72.2 Å²	72.2	61%	0.611	35%	0.346	S	S	*	.	H	α-helix	trans	-61.3	-44.7	-169	-61.7	-50.2	0	0	0	112.2	V143 D144	H140-V143 PolarHBondContact O-N 3.2Å; H140-D144 VanDerWaalsContact O-CB 3.24Å; H140-D144 WeakPolarHBondContact O-CB 3.29Å; H140-D144 PolarHBondContact O-N 3.08Å
141	D	81	Confident	87.1	Confident	132 Å²	132	65.9 Å²	65.9	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-68	-42.5	-178	-65.4	-25.7	0	0	0	111.7	F139 D144 F145	F139-D141 PolarHBondContact O-N 3.19Å; D141-D144 PolarHBondContact O-N 3Å; D141-F145 WeakPolarHBondContact O-CB 3.4Å; D141-F145 PolarHBondContact O-N 2.76Å
142	E	84.2	Confident	87.4	Confident	51 Å²	51	69.6 Å²	69.6	24%	0.238	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-42.5	176.8	-65.7	79.8	-175.6	0	0	111.6	L80 R84 F139 D144 F145 Y146	L80-E142 HydrophobicContact CD2-CB 3.44Å; L80-E142 VanDerWaalsContact CD2-CB 3.44Å; L80-E142 HydrophobicContact CD2-CG 4.5Å; R84-E142 IonicContact CZ-OE1 2.66Å; R84-E142 VanDerWaalsContact NH1-CD 3.33Å; R84-E142 IonicContact NH1-OE1 3.65Å; R84-E142 PolarHBondContact NH1-OE1 3.49Å; R84-E142 IonicContact NH1-OE2 3.57Å; F139-E142 WeakPolarHBondContact CA-OE2 3.45Å; F139-E142 PolarHBondContact O-N 3.17Å; E142-D144 VanDerWaalsContact C-N 3.3Å; E142-D144 PolarHBondContact O-N 3.31Å; E142-F145 WeakPolarHBondContact O-CB 3.35Å; E142-F145 PolarHBondContact O-N 3.18Å; E142-Y146 WeakPolarHBondContact O-CD2 3.41Å; E142-Y146 PolarHBondContact O-N 3.44Å; E142-Y146 VanDerWaalsContact O-N 3.13Å
143	V	83.9	Confident	87.6	Confident	10 Å²	10	64.5 Å²	64.5	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-62.4	-41.7	175.9	171.6	0	0	0	0	110	L80 F139 H140 Y146 R147	L80-V143 HydrophobicContact CD1-CG2 4.1Å; L80-V143 HydrophobicContact CD2-CG2 4.3Å; F139-V143 HydrophobicContact CB-CG2 4.08Å; F139-V143 VanDerWaalsContact O-CB 3.24Å; F139-V143 WeakPolarHBondContact O-CB 3.33Å; F139-V143 WeakPolarHBondContact O-CG2 3.23Å; F139-V143 PolarHBondContact O-N 3.32Å; H140-V143 PolarHBondContact O-N 3.2Å; V143-Y146 PolarHBondContact O-N 3.35Å; V143-R147 WeakPolarHBondContact O-CG 3.48Å; V143-R147 PolarHBondContact O-N 3Å; V143-R147 VanDerWaalsContact O-N 3.1Å
144	D	84.8	Confident	87.7	Confident	72 Å²	72	68.7 Å²	68.7	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-33.1	177.3	-80	-10.8	0	0	0	112.8	H140 D141 E142 Y146 R147	H140-D144 VanDerWaalsContact O-CB 3.24Å; H140-D144 WeakPolarHBondContact O-CB 3.29Å; H140-D144 PolarHBondContact O-N 3.08Å; D141-D144 PolarHBondContact O-N 3Å; E142-D144 VanDerWaalsContact C-N 3.3Å; E142-D144 PolarHBondContact O-N 3.31Å; D144-Y146 VanDerWaalsContact C-N 3.3Å; D144-Y146 PolarHBondContact O-N 3.42Å; D144-R147 PolarHBondContact O-N 3.03Å; D144-R147 WeakPolarHBondContact OD1-CD 3.34Å; D144-R147 IonicContact OD1-CZ 3.52Å; D144-R147 IonicContact OD1-NE 3.26Å; D144-R147 IonicContact OD1-NH1 3.96Å; D144-R147 PolarHBondContact OD1-NH1 2.98Å
145	F	86.6	Confident	87.9	Confident	155 Å²	155	66.9 Å²	66.9	68%	0.68	32%	0.317	S	S	*	.	H	α-helix	trans	-58.2	-43.4	170.1	175.7	-93.7	0	0	0	111.3	D141 E142 R147	D141-F145 WeakPolarHBondContact O-CB 3.4Å; D141-F145 PolarHBondContact O-N 2.76Å; E142-F145 WeakPolarHBondContact O-CB 3.35Å; E142-F145 PolarHBondContact O-N 3.18Å; F145-R147 VanDerWaalsContact C-N 3.35Å
146	Y	86.3	Confident	88.2	Confident	66 Å²	66	68.6 Å²	68.6	26%	0.259	33%	0.331	S	S	.	.	H	α-helix	trans	-72.6	-25.5	177.5	-76.9	-68.8	0	0	0	113.4	T57 S79 L80 E142 V143 D144 T148 A170	T57-Y146 HydrophobicContact CG2-CD1 3.75Å; T57-Y146 HydrophobicContact CG2-CD2 3.95Å; T57-Y146 HydrophobicContact CG2-CE1 4.14Å; T57-Y146 HydrophobicContact CG2-CE2 4.35Å; T57-Y146 HydrophobicContact CG2-CG 3.67Å; S79-Y146 WeakPolarHBondContact CB-OH 3.18Å; S79-Y146 PolarHBondContact O-OH 2.65Å; L80-Y146 HydrophobicContact CD2-CD2 3.9Å; L80-Y146 HydrophobicContact CD2-CE2 3.91Å; E142-Y146 WeakPolarHBondContact O-CD2 3.41Å; E142-Y146 PolarHBondContact O-N 3.44Å; E142-Y146 VanDerWaalsContact O-N 3.13Å; V143-Y146 PolarHBondContact O-N 3.35Å; D144-Y146 VanDerWaalsContact C-N 3.3Å; D144-Y146 PolarHBondContact O-N 3.42Å; Y146-T148 PolarHBondContact O-N 3.1Å; Y146-A170 WeakPolarHBondContact O-CA 3.31Å; Y146-A170 WeakPolarHBondContact O-CB 3.41Å
147	R	89.6	Confident	88.9	Confident	83 Å²	83	60.4 Å²	60.4	31%	0.313	30%	0.3	S	S	.	.			trans	-73.1	72.7	178.9	-73.6	168.5	177	172.3	-1.1	111.8	V143 D144 F145 W150 K168 R169	V143-R147 WeakPolarHBondContact O-CG 3.48Å; V143-R147 PolarHBondContact O-N 3Å; V143-R147 VanDerWaalsContact O-N 3.1Å; D144-R147 PolarHBondContact O-N 3.03Å; D144-R147 WeakPolarHBondContact OD1-CD 3.34Å; D144-R147 IonicContact OD1-CZ 3.52Å; D144-R147 IonicContact OD1-NE 3.26Å; D144-R147 IonicContact OD1-NH1 3.96Å; D144-R147 PolarHBondContact OD1-NH1 2.98Å; F145-R147 VanDerWaalsContact C-N 3.35Å; R147-W150 VanDerWaalsContact O-CD1 3.28Å; R147-W150 PolarHBondContact O-NE1 2.82Å; R147-K168 HydrophobicContact CB-CB 4.03Å; R147-K168 HydrophobicContact CG-CB 4.46Å; R147-R169 CarbonylContact C-O 3.51Å; R147-R169 WeakPolarHBondContact CA-O 3.48Å
148	T	92.9	Very high	90	Very high	43 Å²	43	61.1 Å²	61.1	26%	0.264	30%	0.304	S	S	.	.			trans	-88.5	-14.9	-175.3	54.7	0	0	0	0	114.4	Y146 R169	Y146-T148 PolarHBondContact O-N 3.1Å; T148-R169 PolarHBondContact N-O 3.26Å
149	H	95.8	Very high	91.3	Very high	22 Å²	22	64.2 Å²	64.2	10%	0.102	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.5	179.5	-60.5	-82.7	0	0	0	110.9	W151 K168 R169 A170 N172 K197 P199	H149-W151 HydrophobicContact CB-CE3 4.44Å; H149-W151 HydrophobicContact CB-CH2 3.33Å; H149-W151 HydrophobicContact CB-CZ2 4.26Å; H149-W151 HydrophobicContact CB-CZ3 3.44Å; H149-W151 VanDerWaalsContact CB-CZ3 3.44Å; H149-W151 WeakPolarHBondContact O-CZ3 3.47Å; H149-K168 CarbonylContact O-C 3.4Å; H149-K168 WeakPolarHBondContact O-CA 3.45Å; H149-R169 WeakPolarHBondContact CB-O 3.31Å; H149-R169 PolarHBondContact N-O 3.31Å; H149-R169 PolarHBondContact O-N 2.82Å; H149-A170 PolarHBondContact CD2-O 2.82Å; H149-N172 PolarHBondContact CD2-N 3.25Å; H149-N172 VanDerWaalsContact CD2-N 3.34Å; H149-N172 PolarHBondContact NE2-N 3.4Å; H149-K197 WeakPolarHBondContact CA-O 3.39Å; H149-P199 WeakPolarHBondContact CE1-CD 3.41Å
150	W	96.9	Very high	92.1	Very high	65 Å²	65	68.2 Å²	68.2	25%	0.246	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.5	-174.9	-56.7	3	0	0	0	110	R147 W166 K168 V196 K197	R147-W150 VanDerWaalsContact O-CD1 3.28Å; R147-W150 PolarHBondContact O-NE1 2.82Å; W150-W166 HydrophobicContact CE3-CZ3 4.17Å; W150-K168 HydrophobicContact CB-CG 4.45Å; W150-K168 HydrophobicContact CD2-CD 4.14Å; W150-K168 HydrophobicContact CD2-CG 4.2Å; W150-K168 HydrophobicContact CG-CB 4.49Å; W150-K168 HydrophobicContact CG-CD 4.36Å; W150-K168 HydrophobicContact CG-CG 3.91Å; W150-K168 HydrophobicContact CZ2-CD 4.24Å; W150-V196 HydrophobicContact CB-CG2 3.86Å; W150-V196 PolarHBondContact O-N 3.34Å; W150-K197 HydrophobicContact CB-CB 3.63Å; W150-K197 HydrophobicContact CD2-CB 4.01Å; W150-K197 HydrophobicContact CD2-CD 3.51Å; W150-K197 HydrophobicContact CD2-CG 4.41Å; W150-K197 HydrophobicContact CE3-CB 4.39Å; W150-K197 HydrophobicContact CE3-CD 3.92Å; W150-K197 HydrophobicContact CG-CB 3.68Å; W150-K197 HydrophobicContact CG-CD 3.89Å; W150-K197 HydrophobicContact CG-CG 4.4Å; W150-K197 HydrophobicContact CH2-CD 4.32Å; W150-K197 HydrophobicContact CZ2-CD 3.95Å; W150-K197 HydrophobicContact CZ3-CD 4.3Å; W150-K197 PolarHBondContact N-O 3.29Å; W150-K197 PolarHBondContact O-N 3.06Å
151	W	98.1	Very high	92.8	Very high	6 Å²	6	71.7 Å²	71.7	2%	0.023	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.5	169.3	-62.8	-102.2	0	0	0	109.6	H149 V167 R169 R173 A174 P175 F193 I194 K195	H149-W151 HydrophobicContact CB-CE3 4.44Å; H149-W151 HydrophobicContact CB-CH2 3.33Å; H149-W151 HydrophobicContact CB-CZ2 4.26Å; H149-W151 HydrophobicContact CB-CZ3 3.44Å; H149-W151 VanDerWaalsContact CB-CZ3 3.44Å; H149-W151 WeakPolarHBondContact O-CZ3 3.47Å; W151-V167 PolarHBondContact N-O 2.99Å; W151-V167 PolarHBondContact O-N 3.48Å; W151-R169 HydrophobicContact CZ3-CB 3.91Å; W151-R169 HydrophobicContact CZ3-CG 4.06Å; W151-R173 VanDerWaalsContact CH2-O 3.23Å; W151-R173 WeakPolarHBondContact CH2-O 3.41Å; W151-A174 HydrophobicContact CZ2-CB 4.41Å; W151-P175 HydrophobicContact CB-CG 4.28Å; W151-P175 HydrophobicContact CG-CG 4.29Å; W151-F193 HydrophobicContact CB-CB 4.08Å; W151-F193 HydrophobicContact CB-CD1 4.08Å; W151-I194 CarbonylContact C-O 3.54Å; W151-I194 WeakPolarHBondContact CA-O 3.39Å; W151-K195 HydrophobicContact CZ2-CD 4.42Å; W151-K195 HydrophobicContact CZ2-CG 4.46Å
152	R	98.1	Very high	93.4	Very high	97 Å²	97	69.7 Å²	69.7	37%	0.366	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.7	170.9	-162.7	177	-174.3	-177.2	-4.5	108.8	Q158 G165 W166 I194 V196	R152-Q158 VanDerWaalsContact CZ-OE1 3.31Å; R152-Q158 VanDerWaalsContact NE-OE1 3.12Å; R152-G165 CarbonylContact C-O 3.57Å; R152-G165 WeakPolarHBondContact CA-O 3.23Å; R152-W166 HydrophobicContact CB-CE3 4.11Å; R152-W166 HydrophobicContact CB-CH2 4.37Å; R152-W166 HydrophobicContact CB-CZ3 4.07Å; R152-W166 HydrophobicContact CG-CD2 4.21Å; R152-W166 HydrophobicContact CG-CE3 4.29Å; R152-W166 HydrophobicContact CG-CH2 4.38Å; R152-W166 HydrophobicContact CG-CZ2 4.26Å; R152-W166 HydrophobicContact CG-CZ3 4.41Å; R152-I194 PolarHBondContact N-O 3.49Å; R152-I194 PolarHBondContact O-N 3.37Å; R152-V196 HydrophobicContact CB-CG1 4.29Å
153	C	98.2	Very high	93.9	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	140.1	172.2	-171.8	0	0	0	0	109.5	G155 C157 Q158 G165 H185 T192 F193	C153-G155 VanDerWaalsContact C-N 3.35Å; C153-G155 PolarHBondContact SG-N 2.85Å; C153-C157 WeakPolarHBondContact CB-SG 3.15Å; C153-C157 PolarHBondContact SG-SG 3.1Å; C153-Q158 WeakPolarHBondContact O-CG 3.3Å; C153-Q158 PolarHBondContact O-NE2 2.68Å; C153-G165 PolarHBondContact N-O 3.34Å; C153-H185 PolarHBondContact SG-NE2 2.87Å; C153-T192 CarbonylContact C-O 3.58Å; C153-T192 WeakPolarHBondContact CA-O 3.4Å; C153-F193 HydrophobicContact CB-CD1 3.87Å; C153-F193 HydrophobicContact CB-CE1 3.62Å; C153-F193 HydrophobicContact CB-CE2 4.39Å; C153-F193 HydrophobicContact CB-CG 4.36Å; C153-F193 HydrophobicContact CB-CZ 3.92Å
154	N	97.5	Very high	94.5	Very high	89 Å²	89	79.1 Å²	79.1	48%	0.476	37%	0.367	S	S	.	.	S	Bend	trans	-89.2	1.2	173.6	69.8	-8.3	0	0	0	113.6	T192 I194	N154-T192 PolarHBondContact N-O 3.08Å; N154-T192 PolarHBondContact OD1-N 3.15Å; N154-T192 PolarHBondContact OD1-O 3.07Å; N154-T192 VanDerWaalsContact OD1-O 3.12Å; N154-I194 HydrophobicContact CB-CD1 3.92Å
155	G	97.2	Very high	95.1	Very high	12 Å²	12	75.9 Å²	75.9	12%	0.124	35%	0.351	C	S	.	.	S	Bend	trans	-92.8	-174.7	-179	0	0	0	0	0	114.8	C153 C157 Q158	C153-G155 VanDerWaalsContact C-N 3.35Å; C153-G155 PolarHBondContact SG-N 2.85Å; G155-C157 PolarHBondContact O-N 3.23Å; G155-C157 VanDerWaalsContact O-N 3.08Å; G155-Q158 WeakPolarHBondContact O-CG 3.4Å; G155-Q158 PolarHBondContact O-N 3.27Å
156	P	97.4	Very high	95.6	Very high	80 Å²	80	72.6 Å²	72.6	52%	0.519	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-63.7	-15.4	-176	24.8	-35.7	0	0	0	114.5	Q158 L159 C189	P156-Q158 PolarHBondContact O-N 3.36Å; P156-Q158 VanDerWaalsContact O-N 3.1Å; P156-L159 PolarHBondContact O-N 3.06Å; P156-C189 WeakPolarHBondContact CD-O 3.48Å; P156-C189 VanDerWaalsContact CD-SG 3.54Å
157	C	97.4	Very high	96.1	Very high	12 Å²	12	70.4 Å²	70.4	8%	0.081	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-64.5	-11.7	175.3	74.8	0	0	0	0	114	C153 G155 L159 R160 Y164 G165 C189	C153-C157 WeakPolarHBondContact CB-SG 3.15Å; C153-C157 PolarHBondContact SG-SG 3.1Å; G155-C157 PolarHBondContact O-N 3.23Å; G155-C157 VanDerWaalsContact O-N 3.08Å; C157-L159 PolarHBondContact O-N 2.96Å; C157-R160 PolarHBondContact O-N 3.05Å; C157-R160 VanDerWaalsContact O-N 3.08Å; C157-Y164 CarbonylContact O-C 3.54Å; C157-Y164 WeakPolarHBondContact O-CA 3.35Å; C157-G165 PolarHBondContact O-N 3.25Å; C157-C189 HydrophobicContact CB-CB 4.28Å; C157-C189 VanDerWaalsContact CB-SG 3.53Å; C157-C189 PolarHBondContact N-SG 3.02Å; C157-C189 VanDerWaalsContact N-SG 3.38Å; C157-C189 PolarHBondContact SG-SG 3.04Å
158	Q	97.2	Very high	96.4	Very high	56 Å²	56	70.4 Å²	70.4	26%	0.262	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-58.3	-27.3	171	-72.3	-169.6	66.5	0	0	113.8	R152 C153 G155 P156 Y164	R152-Q158 VanDerWaalsContact CZ-OE1 3.31Å; R152-Q158 VanDerWaalsContact NE-OE1 3.12Å; C153-Q158 WeakPolarHBondContact O-CG 3.3Å; C153-Q158 PolarHBondContact O-NE2 2.68Å; G155-Q158 WeakPolarHBondContact O-CG 3.4Å; G155-Q158 PolarHBondContact O-N 3.27Å; P156-Q158 PolarHBondContact O-N 3.36Å; P156-Q158 VanDerWaalsContact O-N 3.1Å; Q158-Y164 WeakPolarHBondContact O-CA 3.28Å; Q158-Y164 WeakPolarHBondContact O-CB 3.45Å
159	L	96.2	Very high	96.4	Very high	153 Å²	153	69.4 Å²	69.4	80%	0.801	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-98.5	-5.9	178.4	-58.7	176.3	0	0	0	112.5	P156 C157	P156-L159 PolarHBondContact O-N 3.06Å; C157-L159 PolarHBondContact O-N 2.96Å
160	R	95.5	Very high	96.1	Very high	97 Å²	97	69.8 Å²	69.8	37%	0.366	33%	0.328	S	S	.	.	S	Bend	trans	-91.4	127.9	-176.3	-66.3	-168.1	-78.5	153.7	-7	111.1	C157 Y164 T188 C189	C157-R160 PolarHBondContact O-N 3.05Å; C157-R160 VanDerWaalsContact O-N 3.08Å; R160-Y164 WeakPolarHBondContact O-CA 3.46Å; R160-Y164 PolarHBondContact O-N 2.85Å; R160-T188 PolarHBondContact NH1-OG1 2.9Å; R160-T188 VanDerWaalsContact NH2-C 3.34Å; R160-T188 PolarHBondContact NH2-O 2.99Å; R160-T188 PolarHBondContact NH2-OG1 3.29Å; R160-T188 VanDerWaalsContact NH2-OG1 3.15Å; R160-C189 VanDerWaalsContact NH2-CB 3.26Å
161	R	94.1	Very high	95.8	Very high	204 Å²	204	72.1 Å²	72.1	77%	0.77	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	152.9	168.8	-61.1	-174.9	72.4	-141.9	3.6	110.1	Y164	R161-Y164 HydrophobicContact CG-CE1 3.96Å; R161-Y164 WeakPolarHBondContact CG-OH 3.36Å
162	P	94	Very high	95.6	Very high	91 Å²	91	76.7 Å²	76.7	59%	0.591	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.6	-12.4	-4.4	35.1	-34.3	0	0	0	113.8	Y164	P162-Y164 VanDerWaalsContact O-CD2 3.28Å; P162-Y164 WeakPolarHBondContact O-CD2 3.35Å
163	F	94.6	Very high	95.5	Very high	152 Å²	152	76.5 Å²	76.5	67%	0.667	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-19.7	-166.7	-54.5	-66.1	0	0	0	114.4	G165 W166	F163-G165 PolarHBondContact O-N 2.96Å; F163-G165 VanDerWaalsContact O-N 3.12Å; F163-W166 WeakPolarHBondContact O-CB 3.2Å; F163-W166 VanDerWaalsContact O-CD1 3.31Å; F163-W166 PolarHBondContact O-N 2.79Å
164	Y	97.1	Very high	95.3	Very high	106 Å²	106	79.2 Å²	79.2	42%	0.416	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	40	-179.1	-56	-79.6	0	0	0	112.8	C157 Q158 R160 R161 P162 W166	C157-Y164 CarbonylContact O-C 3.54Å; C157-Y164 WeakPolarHBondContact O-CA 3.35Å; Q158-Y164 WeakPolarHBondContact O-CA 3.28Å; Q158-Y164 WeakPolarHBondContact O-CB 3.45Å; R160-Y164 WeakPolarHBondContact O-CA 3.46Å; R160-Y164 PolarHBondContact O-N 2.85Å; R161-Y164 HydrophobicContact CG-CE1 3.96Å; R161-Y164 WeakPolarHBondContact CG-OH 3.36Å; P162-Y164 VanDerWaalsContact O-CD2 3.28Å; P162-Y164 WeakPolarHBondContact O-CD2 3.35Å; Y164-W166 VanDerWaalsContact C-N 3.26Å; Y164-W166 PolarHBondContact O-N 3.38Å
165	G	96.7	Very high	95.3	Very high	4 Å²	4	75.5 Å²	75.5	4%	0.041	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	5	-179.9	0	0	0	0	0	115.7	R152 C153 C157 F163 F193	R152-G165 CarbonylContact C-O 3.57Å; R152-G165 WeakPolarHBondContact CA-O 3.23Å; C153-G165 PolarHBondContact N-O 3.34Å; C157-G165 PolarHBondContact O-N 3.25Å; F163-G165 PolarHBondContact O-N 2.96Å; F163-G165 VanDerWaalsContact O-N 3.12Å; G165-F193 WeakPolarHBondContact O-CE1 3.17Å
166	W	97.5	Very high	95.3	Very high	86 Å²	86	75.6 Å²	75.6	33%	0.326	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	137.9	-179.5	-67.8	101.9	0	0	0	113	W150 R152 F163 Y164 V196	W150-W166 HydrophobicContact CE3-CZ3 4.17Å; R152-W166 HydrophobicContact CB-CE3 4.11Å; R152-W166 HydrophobicContact CB-CH2 4.37Å; R152-W166 HydrophobicContact CB-CZ3 4.07Å; R152-W166 HydrophobicContact CG-CD2 4.21Å; R152-W166 HydrophobicContact CG-CE3 4.29Å; R152-W166 HydrophobicContact CG-CH2 4.38Å; R152-W166 HydrophobicContact CG-CZ2 4.26Å; R152-W166 HydrophobicContact CG-CZ3 4.41Å; F163-W166 WeakPolarHBondContact O-CB 3.2Å; F163-W166 VanDerWaalsContact O-CD1 3.31Å; F163-W166 PolarHBondContact O-N 2.79Å; Y164-W166 VanDerWaalsContact C-N 3.26Å; Y164-W166 PolarHBondContact O-N 3.38Å; W166-V196 HydrophobicContact CH2-CG2 4.23Å; W166-V196 HydrophobicContact CZ3-CG2 3.58Å
167	V	96.5	Very high	95.2	Very high	20 Å²	20	76.9 Å²	76.9	12%	0.121	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122.3	163.2	176.2	0	0	0	0	108.3	W151 R169 P175 W181 F193	W151-V167 PolarHBondContact N-O 2.99Å; W151-V167 PolarHBondContact O-N 3.48Å; V167-R169 HydrophobicContact CG1-CG 4.04Å; V167-P175 HydrophobicContact CB-CG 3.92Å; V167-P175 HydrophobicContact CG1-CG 3.87Å; V167-P175 HydrophobicContact CG2-CG 4.03Å; V167-W181 HydrophobicContact CG2-CH2 3.77Å; V167-W181 HydrophobicContact CG2-CZ2 3.97Å; V167-F193 HydrophobicContact CB-CD1 4.46Å; V167-F193 HydrophobicContact CB-CE1 4.24Å; V167-F193 HydrophobicContact CG2-CD1 4.05Å; V167-F193 HydrophobicContact CG2-CE1 3.41Å; V167-F193 VanDerWaalsContact CG2-CE1 3.41Å; V167-F193 HydrophobicContact CG2-CZ 3.86Å
168	K	94.9	Very high	95.1	Very high	84 Å²	84	84 Å²	84	37%	0.365	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.7	178.5	-55.3	-179.6	-177.9	174.8	0	109.3	R147 H149 W150	R147-K168 HydrophobicContact CB-CB 4.03Å; R147-K168 HydrophobicContact CG-CB 4.46Å; H149-K168 CarbonylContact O-C 3.4Å; H149-K168 WeakPolarHBondContact O-CA 3.45Å; W150-K168 HydrophobicContact CB-CG 4.45Å; W150-K168 HydrophobicContact CD2-CD 4.14Å; W150-K168 HydrophobicContact CD2-CG 4.2Å; W150-K168 HydrophobicContact CG-CB 4.49Å; W150-K168 HydrophobicContact CG-CD 4.36Å; W150-K168 HydrophobicContact CG-CG 3.91Å; W150-K168 HydrophobicContact CZ2-CD 4.24Å
169	R	94	Very high	95	Very high	22 Å²	22	82 Å²	82	8%	0.083	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.3	-177.4	-58.9	176.2	174.1	175.1	-1.2	111.4	R147 T148 H149 W151 V167 M171 R173 A174 D179	R147-R169 CarbonylContact C-O 3.51Å; R147-R169 WeakPolarHBondContact CA-O 3.48Å; T148-R169 PolarHBondContact N-O 3.26Å; H149-R169 WeakPolarHBondContact CB-O 3.31Å; H149-R169 PolarHBondContact N-O 3.31Å; H149-R169 PolarHBondContact O-N 2.82Å; W151-R169 HydrophobicContact CZ3-CB 3.91Å; W151-R169 HydrophobicContact CZ3-CG 4.06Å; V167-R169 HydrophobicContact CG1-CG 4.04Å; R169-M171 VanDerWaalsContact C-N 3.33Å; R169-R173 WeakPolarHBondContact CD-O 3.46Å; R169-R173 VanDerWaalsContact CZ-CZ 3.45Å; R169-R173 VanDerWaalsContact CZ-NH2 3.27Å; R169-R173 PolarHBondContact NH1-O 2.85Å; R169-A174 PolarHBondContact NH1-O 2.94Å; R169-D179 IonicContact CZ-OD1 2.67Å; R169-D179 IonicContact CZ-OD2 3.15Å; R169-D179 IonicContact NH1-OD1 2.82Å; R169-D179 IonicContact NH1-OD2 3.21Å; R169-D179 IonicContact NH2-OD1 2.61Å; R169-D179 PolarHBondContact NH2-OD1 3.12Å; R169-D179 IonicContact NH2-OD2 3.52Å; R169-D179 PolarHBondContact NH2-OD2 2.88Å
170	A	90.2	Very high	94.9	Very high	30 Å²	30	85.2 Å²	85.2	25%	0.248	41%	0.411	C	S	.	.	S	Bend	trans	-77.2	-20.2	176.2	0	0	0	0	0	114.1	T57 Y146 H149	T57-A170 WeakPolarHBondContact OG1-CB 2.98Å; Y146-A170 WeakPolarHBondContact O-CA 3.31Å; Y146-A170 WeakPolarHBondContact O-CB 3.41Å; H149-A170 PolarHBondContact CD2-O 2.82Å
171	M	90	Very high	95	Very high	114 Å²	114	83.8 Å²	83.8	56%	0.562	41%	0.406	S	S	*	.	S	Bend	trans	-118.5	152.8	179.1	58.3	-170.5	-90.3	0	0	110.7	R169 R173	R169-M171 VanDerWaalsContact C-N 3.33Å; M171-R173 HydrophobicContact CE-CB 3.76Å; M171-R173 HydrophobicContact CE-CG 4.32Å; M171-R173 HydrophobicContact CG-CB 4.11Å; M171-R173 PolarHBondContact O-N 2.9Å
172	N	94.4	Very high	95.1	Very high	101 Å²	101	76.3 Å²	76.3	54%	0.54	38%	0.377	S	S	.	.	S	Bend	trans	-72.3	67.7	175.1	-171.4	22.8	0	0	0	111.7	H149 K195	H149-N172 PolarHBondContact CD2-N 3.25Å; H149-N172 VanDerWaalsContact CD2-N 3.34Å; H149-N172 PolarHBondContact NE2-N 3.4Å; N172-K195 VanDerWaalsContact CG-NZ 3.26Å; N172-K195 PolarHBondContact ND2-NZ 2.9Å; N172-K195 VanDerWaalsContact OD1-CE 3.31Å; N172-K195 WeakPolarHBondContact OD1-CE 3.36Å; N172-K195 PolarHBondContact OD1-NZ 3.49Å
173	R	94.2	Very high	95.2	Very high	93 Å²	93	79.1 Å²	79.1	35%	0.351	38%	0.38	S	S	.	.			trans	-118.1	109.6	173.5	-177.5	179.2	68	86.8	-4.2	107.9	W151 R169 M171 D179	W151-R173 VanDerWaalsContact CH2-O 3.23Å; W151-R173 WeakPolarHBondContact CH2-O 3.41Å; R169-R173 WeakPolarHBondContact CD-O 3.46Å; R169-R173 VanDerWaalsContact CZ-CZ 3.45Å; R169-R173 VanDerWaalsContact CZ-NH2 3.27Å; R169-R173 PolarHBondContact NH1-O 2.85Å; M171-R173 HydrophobicContact CE-CB 3.76Å; M171-R173 HydrophobicContact CE-CG 4.32Å; M171-R173 HydrophobicContact CG-CB 4.11Å; M171-R173 PolarHBondContact O-N 2.9Å; R173-D179 IonicContact CZ-OD1 2.85Å; R173-D179 VanDerWaalsContact CZ-OD1 3.26Å; R173-D179 VanDerWaalsContact NH1-CG 3.27Å; R173-D179 IonicContact NH1-OD1 3.17Å; R173-D179 PolarHBondContact NH1-OD1 3.17Å; R173-D179 IonicContact NH1-OD2 3.2Å; R173-D179 PolarHBondContact NH1-OD2 2.73Å; R173-D179 VanDerWaalsContact NH1-OD2 3.17Å; R173-D179 IonicContact NH2-OD1 2.72Å; R173-D179 PolarHBondContact NH2-OD1 2.62Å
174	A	95.9	Very high	95.3	Very high	57 Å²	57	76.3 Å²	76.3	47%	0.471	37%	0.372	S	S	.	.			trans	-61.2	148.1	175.1	0	0	0	0	0	111	W151 R169 G176	W151-A174 HydrophobicContact CZ2-CB 4.41Å; R169-A174 PolarHBondContact NH1-O 2.94Å; A174-G176 PolarHBondContact O-N 2.73Å
175	P	97.1	Very high	95.3	Very high	12 Å²	12	72 Å²	72	8%	0.078	36%	0.356	C	S	.	.	S	Bend	trans	-51.4	135.6	164.5	-30.4	40.3	0	0	0	111.5	W151 V167 D179 W181 W182 F193	W151-P175 HydrophobicContact CB-CG 4.28Å; W151-P175 HydrophobicContact CG-CG 4.29Å; V167-P175 HydrophobicContact CB-CG 3.92Å; V167-P175 HydrophobicContact CG1-CG 3.87Å; V167-P175 HydrophobicContact CG2-CG 4.03Å; P175-D179 WeakPolarHBondContact CA-OD2 3.42Å; P175-W181 HydrophobicContact CB-CH2 3.86Å; P175-W181 HydrophobicContact CG-CH2 4.42Å; P175-W182 VanDerWaalsContact C-CZ3 3.44Å; P175-W182 HydrophobicContact CB-CE3 4.25Å; P175-W182 HydrophobicContact CB-CZ3 3.64Å; P175-F193 HydrophobicContact CB-CB 4.01Å; P175-F193 HydrophobicContact CB-CD1 4.32Å; P175-F193 HydrophobicContact CB-CD2 3.51Å; P175-F193 HydrophobicContact CB-CE2 3.97Å; P175-F193 HydrophobicContact CB-CG 3.69Å; P175-F193 HydrophobicContact CG-CB 3.8Å; P175-F193 HydrophobicContact CG-CD1 3.85Å; P175-F193 HydrophobicContact CG-CD2 3.97Å; P175-F193 HydrophobicContact CG-CE1 4.4Å; P175-F193 HydrophobicContact CG-CE2 4.47Å; P175-F193 HydrophobicContact CG-CG 3.59Å
176	G	96.1	Very high	95.3	Very high	13 Å²	13	75 Å²	75	13%	0.134	37%	0.37	C	S	.	.			trans	-171	-173.4	-179	0	0	0	0	0	114	A174 N178 D179 W182	A174-G176 PolarHBondContact O-N 2.73Å; G176-N178 PolarHBondContact O-N 2.92Å; G176-D179 PolarHBondContact N-OD2 2.86Å; G176-D179 WeakPolarHBondContact O-CB 3.35Å; G176-D179 PolarHBondContact O-N 2.85Å; G176-W182 VanDerWaalsContact C-CG 3.43Å; G176-W182 VanDerWaalsContact O-CB 3.32Å; G176-W182 WeakPolarHBondContact O-CB 3.37Å; G176-W182 VanDerWaalsContact O-CG 3.31Å
177	P	96.1	Very high	95.2	Very high	108 Å²	108	77.4 Å²	77.4	70%	0.701	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-22.4	-172.5	-28.7	35.7	0	0	0	116.5	D179 W182	P177-D179 VanDerWaalsContact C-N 3.27Å; P177-D179 PolarHBondContact O-N 2.72Å; P177-W182 VanDerWaalsContact CA-CD1 3.43Å
178	N	94.8	Very high	95.3	Very high	160 Å²	160	79.6 Å²	79.6	86%	0.856	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-9.4	177.9	-63.9	-16.9	0	0	0	113.5	G176	G176-N178 PolarHBondContact O-N 2.92Å
179	D	95.6	Very high	95.4	Very high	14 Å²	14	76.4 Å²	76.4	8%	0.075	39%	0.386	C	S	.	.	S	Bend	trans	-82.9	129.5	173.1	-64.4	-62.5	0	0	0	110	R169 R173 P175 G176 P177 W181 W182	R169-D179 IonicContact CZ-OD1 2.67Å; R169-D179 IonicContact CZ-OD2 3.15Å; R169-D179 IonicContact NH1-OD1 2.82Å; R169-D179 IonicContact NH1-OD2 3.21Å; R169-D179 IonicContact NH2-OD1 2.61Å; R169-D179 PolarHBondContact NH2-OD1 3.12Å; R169-D179 IonicContact NH2-OD2 3.52Å; R169-D179 PolarHBondContact NH2-OD2 2.88Å; R173-D179 IonicContact CZ-OD1 2.85Å; R173-D179 VanDerWaalsContact CZ-OD1 3.26Å; R173-D179 VanDerWaalsContact NH1-CG 3.27Å; R173-D179 IonicContact NH1-OD1 3.17Å; R173-D179 PolarHBondContact NH1-OD1 3.17Å; R173-D179 IonicContact NH1-OD2 3.2Å; R173-D179 PolarHBondContact NH1-OD2 2.73Å; R173-D179 VanDerWaalsContact NH1-OD2 3.17Å; R173-D179 IonicContact NH2-OD1 2.72Å; R173-D179 PolarHBondContact NH2-OD1 2.62Å; P175-D179 WeakPolarHBondContact CA-OD2 3.42Å; G176-D179 PolarHBondContact N-OD2 2.86Å; G176-D179 WeakPolarHBondContact O-CB 3.35Å; G176-D179 PolarHBondContact O-N 2.85Å; P177-D179 VanDerWaalsContact C-N 3.27Å; P177-D179 PolarHBondContact O-N 2.72Å; D179-W181 HydrophobicContact CB-CD2 4.24Å; D179-W181 HydrophobicContact CB-CZ2 4.14Å; D179-W181 PolarHBondContact O-N 2.8Å; D179-W181 VanDerWaalsContact O-N 3.09Å; D179-W182 HydrophobicContact CB-CB 4.29Å; D179-W182 WeakPolarHBondContact O-CB 3.35Å; D179-W182 PolarHBondContact O-N 3.19Å
180	Y	95	Very high	95.4	Very high	222 Å²	222	77.8 Å²	77.8	87%	0.871	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.5	-174.7	71.5	-90.6	0	0	0	113.9
181	W	95.7	Very high	95.7	Very high	67 Å²	67	76.7 Å²	76.7	25%	0.254	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-4.8	178.7	53.1	-99.9	0	0	0	113.5	V167 P175 D179 K183 N184 H185 F193	V167-W181 HydrophobicContact CG2-CH2 3.77Å; V167-W181 HydrophobicContact CG2-CZ2 3.97Å; P175-W181 HydrophobicContact CB-CH2 3.86Å; P175-W181 HydrophobicContact CG-CH2 4.42Å; D179-W181 HydrophobicContact CB-CD2 4.24Å; D179-W181 HydrophobicContact CB-CZ2 4.14Å; D179-W181 PolarHBondContact O-N 2.8Å; D179-W181 VanDerWaalsContact O-N 3.09Å; W181-K183 PolarHBondContact O-N 3.38Å; W181-N184 PolarHBondContact O-N 3.1Å; W181-H185 HydrophobicContact CE3-CB 3.86Å; W181-H185 HydrophobicContact CZ3-CB 4.02Å; W181-H185 PolarHBondContact O-N 2.95Å; W181-F193 AromaticContact CH2-CE2 3.9Å; W181-F193 HydrophobicContact CH2-CE2 3.9Å; W181-F193 AromaticContact CH2-CZ 3.82Å; W181-F193 HydrophobicContact CH2-CZ 3.82Å; W181-F193 AromaticContact CZ3-CE2 3.79Å; W181-F193 HydrophobicContact CZ3-CE2 3.79Å; W181-F193 AromaticContact CZ3-CZ 3.86Å; W181-F193 HydrophobicContact CZ3-CZ 3.86Å
182	W	97	Very high	96.1	Very high	46 Å²	46	75.5 Å²	75.5	17%	0.174	40%	0.398	C	S	.	.	H	α-helix	trans	-60	-44.9	-173.4	-176.5	-100.7	0	0	0	112.7	P175 G176 P177 D179 N184 H185 M186 F193	P175-W182 VanDerWaalsContact C-CZ3 3.44Å; P175-W182 HydrophobicContact CB-CE3 4.25Å; P175-W182 HydrophobicContact CB-CZ3 3.64Å; G176-W182 VanDerWaalsContact C-CG 3.43Å; G176-W182 VanDerWaalsContact O-CB 3.32Å; G176-W182 WeakPolarHBondContact O-CB 3.37Å; G176-W182 VanDerWaalsContact O-CG 3.31Å; P177-W182 VanDerWaalsContact CA-CD1 3.43Å; D179-W182 HydrophobicContact CB-CB 4.29Å; D179-W182 WeakPolarHBondContact O-CB 3.35Å; D179-W182 PolarHBondContact O-N 3.19Å; W182-N184 PolarHBondContact O-N 3.22Å; W182-H185 WeakPolarHBondContact O-CB 3.4Å; W182-H185 PolarHBondContact O-N 2.81Å; W182-H185 VanDerWaalsContact O-N 3.16Å; W182-M186 HydrophobicContact CD2-CE 4.42Å; W182-M186 HydrophobicContact CD2-CG 4.45Å; W182-M186 HydrophobicContact CG-CG 4.47Å; W182-M186 HydrophobicContact CH2-CE 3.78Å; W182-M186 HydrophobicContact CZ2-CE 3.53Å; W182-M186 HydrophobicContact CZ2-CG 4.42Å; W182-M186 HydrophobicContact CZ2-SD 3.81Å; W182-M186 HydrophobicContact CZ3-CE 4.3Å; W182-M186 WeakPolarHBondContact O-CG 3.37Å; W182-M186 PolarHBondContact O-N 2.9Å; W182-F193 HydrophobicContact CH2-CD2 4.19Å; W182-F193 AromaticContact CZ3-CD2 3.66Å; W182-F193 HydrophobicContact CZ3-CD2 3.66Å; W182-F193 AromaticContact CZ3-CE2 3.86Å; W182-F193 HydrophobicContact CZ3-CE2 3.86Å
183	K	96.5	Very high	96.3	Very high	151 Å²	151	71.9 Å²	71.9	66%	0.657	38%	0.378	S	S	*	.	H	α-helix	trans	-58.3	-49.3	179.8	-175.2	179	174.3	-176.3	0	111.5	W181 H185 M186 E187	W181-K183 PolarHBondContact O-N 3.38Å; K183-H185 VanDerWaalsContact C-N 3.33Å; K183-H185 PolarHBondContact O-N 3.45Å; K183-M186 PolarHBondContact O-N 3.09Å; K183-M186 VanDerWaalsContact O-N 3.17Å; K183-E187 WeakPolarHBondContact CE-OE1 3.43Å; K183-E187 WeakPolarHBondContact O-CG 3.11Å; K183-E187 PolarHBondContact O-N 3.23Å
184	N	96.3	Very high	96.4	Very high	93 Å²	93	71.8 Å²	71.8	50%	0.497	38%	0.383	S	S	.	.	H	α-helix	trans	-61.1	-41.3	175.6	-179.8	-11.1	0	0	0	111.6	W181 W182 M186 E187 T188	W181-N184 PolarHBondContact O-N 3.1Å; W182-N184 PolarHBondContact O-N 3.22Å; N184-M186 VanDerWaalsContact C-N 3.35Å; N184-M186 PolarHBondContact O-N 3.49Å; N184-E187 PolarHBondContact O-N 3.08Å; N184-T188 WeakPolarHBondContact O-CB 3.46Å; N184-T188 WeakPolarHBondContact O-CG2 3.21Å; N184-T188 PolarHBondContact O-N 3.06Å; N184-T188 PolarHBondContact O-OG1 3.45Å; N184-T188 WeakPolarHBondContact OD1-CG2 3.49Å; N184-T188 PolarHBondContact OD1-OG1 2.95Å
185	H	97.6	Very high	96.5	Very high	15 Å²	15	72.2 Å²	72.2	7%	0.069	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-41.8	175.1	175.2	-90	0	0	0	112.2	C153 W181 W182 K183 C189 G190 G191 F193	C153-H185 PolarHBondContact SG-NE2 2.87Å; W181-H185 HydrophobicContact CE3-CB 3.86Å; W181-H185 HydrophobicContact CZ3-CB 4.02Å; W181-H185 PolarHBondContact O-N 2.95Å; W182-H185 WeakPolarHBondContact O-CB 3.4Å; W182-H185 PolarHBondContact O-N 2.81Å; W182-H185 VanDerWaalsContact O-N 3.16Å; K183-H185 VanDerWaalsContact C-N 3.33Å; K183-H185 PolarHBondContact O-N 3.45Å; H185-C189 WeakPolarHBondContact NE2-CB 3.03Å; H185-C189 WeakPolarHBondContact O-CA 3.48Å; H185-C189 WeakPolarHBondContact O-CB 3.49Å; H185-C189 PolarHBondContact O-N 3.49Å; H185-G190 PolarHBondContact O-N 3.49Å; H185-G191 PolarHBondContact CE1-O 3.38Å; H185-G191 VanDerWaalsContact CE1-O 3.3Å; H185-F193 AromaticContact CD2-CE2 3.96Å; H185-F193 AromaticContact CE1-CE2 3.37Å; H185-F193 WeakPolarHBondContact CE1-CE2 3.42Å; H185-F193 AromaticContact ND1-CE2 3.7Å; H185-F193 AromaticContact NE2-CE2 3.53Å; H185-F193 AromaticContact NE2-CZ 3.7Å
186	M	96.5	Very high	96.5	Very high	68 Å²	68	75.4 Å²	75.4	34%	0.335	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-44	175.6	-68	-67.6	97.2	0	0	111.5	W182 K183 N184 G190 G191	W182-M186 HydrophobicContact CD2-CE 4.42Å; W182-M186 HydrophobicContact CD2-CG 4.45Å; W182-M186 HydrophobicContact CG-CG 4.47Å; W182-M186 HydrophobicContact CH2-CE 3.78Å; W182-M186 HydrophobicContact CZ2-CE 3.53Å; W182-M186 HydrophobicContact CZ2-CG 4.42Å; W182-M186 HydrophobicContact CZ2-SD 3.81Å; W182-M186 HydrophobicContact CZ3-CE 4.3Å; W182-M186 WeakPolarHBondContact O-CG 3.37Å; W182-M186 PolarHBondContact O-N 2.9Å; K183-M186 PolarHBondContact O-N 3.09Å; K183-M186 VanDerWaalsContact O-N 3.17Å; N184-M186 VanDerWaalsContact C-N 3.35Å; N184-M186 PolarHBondContact O-N 3.49Å; M186-G190 WeakPolarHBondContact O-CA 3.36Å; M186-G190 PolarHBondContact O-N 2.98Å; M186-G190 VanDerWaalsContact O-N 3.07Å; M186-G191 WeakPolarHBondContact CE-O 3.48Å
187	E	96.2	Very high	96.4	Very high	136 Å²	136	79.4 Å²	79.4	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-67.5	-41.6	-179.8	-70.9	166.6	179.5	0	0	113	K183 N184	K183-E187 WeakPolarHBondContact CE-OE1 3.43Å; K183-E187 WeakPolarHBondContact O-CG 3.11Å; K183-E187 PolarHBondContact O-N 3.23Å; N184-E187 PolarHBondContact O-N 3.08Å
188	T	96.7	Very high	96.3	Very high	65 Å²	65	78.5 Å²	78.5	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-97	-13.5	-173.4	65.9	0	0	0	0	114.6	R160 N184	R160-T188 PolarHBondContact NH1-OG1 2.9Å; R160-T188 VanDerWaalsContact NH2-C 3.34Å; R160-T188 PolarHBondContact NH2-O 2.99Å; R160-T188 PolarHBondContact NH2-OG1 3.29Å; R160-T188 VanDerWaalsContact NH2-OG1 3.15Å; N184-T188 WeakPolarHBondContact O-CB 3.46Å; N184-T188 WeakPolarHBondContact O-CG2 3.21Å; N184-T188 PolarHBondContact O-N 3.06Å; N184-T188 PolarHBondContact O-OG1 3.45Å; N184-T188 WeakPolarHBondContact OD1-CG2 3.49Å; N184-T188 PolarHBondContact OD1-OG1 2.95Å
189	C	97.1	Very high	96	Very high	17 Å²	17	73.7 Å²	73.7	12%	0.115	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126	-50.2	-176.8	-163.2	0	0	0	0	112.5	P156 C157 R160 H185 G191	P156-C189 WeakPolarHBondContact CD-O 3.48Å; P156-C189 VanDerWaalsContact CD-SG 3.54Å; C157-C189 HydrophobicContact CB-CB 4.28Å; C157-C189 VanDerWaalsContact CB-SG 3.53Å; C157-C189 PolarHBondContact N-SG 3.02Å; C157-C189 VanDerWaalsContact N-SG 3.38Å; C157-C189 PolarHBondContact SG-SG 3.04Å; R160-C189 VanDerWaalsContact NH2-CB 3.26Å; H185-C189 WeakPolarHBondContact NE2-CB 3.03Å; H185-C189 WeakPolarHBondContact O-CA 3.48Å; H185-C189 WeakPolarHBondContact O-CB 3.49Å; H185-C189 PolarHBondContact O-N 3.49Å; C189-G191 PolarHBondContact O-N 3.15Å
190	G	95.5	Very high	95.5	Very high	52 Å²	52	79 Å²	79	54%	0.536	40%	0.399	S	S	.	.			trans	65.5	-1	-170.7	0	0	0	0	0	115.4	H185 M186	H185-G190 PolarHBondContact O-N 3.49Å; M186-G190 WeakPolarHBondContact O-CA 3.36Å; M186-G190 PolarHBondContact O-N 2.98Å; M186-G190 VanDerWaalsContact O-N 3.07Å
191	G	96.6	Very high	94.5	Very high	6 Å²	6	76.2 Å²	76.2	6%	0.062	39%	0.392	C	S	.	.			trans	-72.2	164.1	-177.5	0	0	0	0	0	114.1	H185 M186 C189	H185-G191 PolarHBondContact CE1-O 3.38Å; H185-G191 VanDerWaalsContact CE1-O 3.3Å; M186-G191 WeakPolarHBondContact CE-O 3.48Å; C189-G191 PolarHBondContact O-N 3.15Å
192	T	97.1	Very high	92.7	Very high	90 Å²	90	77.6 Å²	77.6	55%	0.552	41%	0.412	S	S	*	.			trans	-105.9	139.7	175.3	-59.9	0	0	0	0	110.6	C153 N154	C153-T192 CarbonylContact C-O 3.58Å; C153-T192 WeakPolarHBondContact CA-O 3.4Å; N154-T192 PolarHBondContact N-O 3.08Å; N154-T192 PolarHBondContact OD1-N 3.15Å; N154-T192 PolarHBondContact OD1-O 3.07Å; N154-T192 VanDerWaalsContact OD1-O 3.12Å
193	F	98.2	Very high	90.6	Very high	25 Å²	25	84 Å²	84	11%	0.11	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	112.6	176.9	-78.2	-85.6	0	0	0	111.7	W151 C153 G165 V167 P175 W181 W182 H185	W151-F193 HydrophobicContact CB-CB 4.08Å; W151-F193 HydrophobicContact CB-CD1 4.08Å; C153-F193 HydrophobicContact CB-CD1 3.87Å; C153-F193 HydrophobicContact CB-CE1 3.62Å; C153-F193 HydrophobicContact CB-CE2 4.39Å; C153-F193 HydrophobicContact CB-CG 4.36Å; C153-F193 HydrophobicContact CB-CZ 3.92Å; G165-F193 WeakPolarHBondContact O-CE1 3.17Å; V167-F193 HydrophobicContact CB-CD1 4.46Å; V167-F193 HydrophobicContact CB-CE1 4.24Å; V167-F193 HydrophobicContact CG2-CD1 4.05Å; V167-F193 HydrophobicContact CG2-CE1 3.41Å; V167-F193 VanDerWaalsContact CG2-CE1 3.41Å; V167-F193 HydrophobicContact CG2-CZ 3.86Å; P175-F193 HydrophobicContact CB-CB 4.01Å; P175-F193 HydrophobicContact CB-CD1 4.32Å; P175-F193 HydrophobicContact CB-CD2 3.51Å; P175-F193 HydrophobicContact CB-CE2 3.97Å; P175-F193 HydrophobicContact CB-CG 3.69Å; P175-F193 HydrophobicContact CG-CB 3.8Å; P175-F193 HydrophobicContact CG-CD1 3.85Å; P175-F193 HydrophobicContact CG-CD2 3.97Å; P175-F193 HydrophobicContact CG-CE1 4.4Å; P175-F193 HydrophobicContact CG-CE2 4.47Å; P175-F193 HydrophobicContact CG-CG 3.59Å; W181-F193 AromaticContact CH2-CE2 3.9Å; W181-F193 HydrophobicContact CH2-CE2 3.9Å; W181-F193 AromaticContact CH2-CZ 3.82Å; W181-F193 HydrophobicContact CH2-CZ 3.82Å; W181-F193 AromaticContact CZ3-CE2 3.79Å; W181-F193 HydrophobicContact CZ3-CE2 3.79Å; W181-F193 AromaticContact CZ3-CZ 3.86Å; W181-F193 HydrophobicContact CZ3-CZ 3.86Å; W182-F193 HydrophobicContact CH2-CD2 4.19Å; W182-F193 AromaticContact CZ3-CD2 3.66Å; W182-F193 HydrophobicContact CZ3-CD2 3.66Å; W182-F193 AromaticContact CZ3-CE2 3.86Å; W182-F193 HydrophobicContact CZ3-CE2 3.86Å; H185-F193 AromaticContact CD2-CE2 3.96Å; H185-F193 AromaticContact CE1-CE2 3.37Å; H185-F193 WeakPolarHBondContact CE1-CE2 3.42Å; H185-F193 AromaticContact ND1-CE2 3.7Å; H185-F193 AromaticContact NE2-CE2 3.53Å; H185-F193 AromaticContact NE2-CZ 3.7Å
194	I	97.3	Very high	88.4	Confident	91 Å²	91	81 Å²	81	47%	0.467	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.5	178.3	-55.7	175.4	0	0	0	108.7	W151 R152 N154	W151-I194 CarbonylContact C-O 3.54Å; W151-I194 WeakPolarHBondContact CA-O 3.39Å; R152-I194 PolarHBondContact N-O 3.49Å; R152-I194 PolarHBondContact O-N 3.37Å; N154-I194 HydrophobicContact CB-CD1 3.92Å
195	K	97.6	Very high	85.7	Confident	66 Å²	66	82.6 Å²	82.6	29%	0.287	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.5	176.9	-162.7	178.3	-172.1	-170.4	0	109.9	W151 N172 E198	W151-K195 HydrophobicContact CZ2-CD 4.42Å; W151-K195 HydrophobicContact CZ2-CG 4.46Å; N172-K195 VanDerWaalsContact CG-NZ 3.26Å; N172-K195 PolarHBondContact ND2-NZ 2.9Å; N172-K195 VanDerWaalsContact OD1-CE 3.31Å; N172-K195 WeakPolarHBondContact OD1-CE 3.36Å; N172-K195 PolarHBondContact OD1-NZ 3.49Å; K195-E198 WeakPolarHBondContact CE-OE2 3.32Å; K195-E198 IonicContact NZ-OE2 2.62Å; K195-E198 PolarHBondContact NZ-OE2 2.88Å
196	V	96.5	Very high	83	Confident	79 Å²	79	85.5 Å²	85.5	48%	0.479	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	-14.9	-175.6	-60.3	0	0	0	0	113.8	W150 R152 W166	W150-V196 HydrophobicContact CB-CG2 3.86Å; W150-V196 PolarHBondContact O-N 3.34Å; R152-V196 HydrophobicContact CB-CG1 4.29Å; W166-V196 HydrophobicContact CH2-CG2 4.23Å; W166-V196 HydrophobicContact CZ3-CG2 3.58Å
197	K	94.9	Very high	80.4	Confident	97 Å²	97	91.8 Å²	91.8	42%	0.422	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	139.2	174.6	-163.2	-178.4	-179.3	178.9	0	111.3	H149 W150	H149-K197 WeakPolarHBondContact CA-O 3.39Å; W150-K197 HydrophobicContact CB-CB 3.63Å; W150-K197 HydrophobicContact CD2-CB 4.01Å; W150-K197 HydrophobicContact CD2-CD 3.51Å; W150-K197 HydrophobicContact CD2-CG 4.41Å; W150-K197 HydrophobicContact CE3-CB 4.39Å; W150-K197 HydrophobicContact CE3-CD 3.92Å; W150-K197 HydrophobicContact CG-CB 3.68Å; W150-K197 HydrophobicContact CG-CD 3.89Å; W150-K197 HydrophobicContact CG-CG 4.4Å; W150-K197 HydrophobicContact CH2-CD 4.32Å; W150-K197 HydrophobicContact CZ2-CD 3.95Å; W150-K197 HydrophobicContact CZ3-CD 4.3Å; W150-K197 PolarHBondContact N-O 3.29Å; W150-K197 PolarHBondContact O-N 3.06Å
198	E	92.9	Very high	77.6	Confident	88 Å²	88	92.8 Å²	92.8	41%	0.411	52%	0.522	S	S	.	.			trans	-143.7	154.8	165.5	58.7	178.9	-150.6	0	0	110	K195	K195-E198 WeakPolarHBondContact CE-OE2 3.32Å; K195-E198 IonicContact NZ-OE2 2.62Å; K195-E198 PolarHBondContact NZ-OE2 2.88Å
199	P	89.9	Confident	74.9	Confident	60 Å²	60	96.1 Å²	96.1	39%	0.39	54%	0.541	S	S	.	.			trans	-66.9	142.7	173.7	27.6	-33.1	0	0	0	110.8	H149 K201	H149-P199 WeakPolarHBondContact CE1-CD 3.41Å; P199-K201 PolarHBondContact O-N 2.87Å
200	D	85.6	Confident	72.4	Confident	125 Å²	125	103.4 Å²	103.4	67%	0.668	58%	0.578	S	S	*	*			trans	-59.7	122.7	177	-63.5	-42.4	0	0	0	110.9	S202 K203	D200-S202 PolarHBondContact O-N 3.45Å; D200-K203 PolarHBondContact O-N 3.17Å
201	K	72.3	Confident	69.8	Low	163 Å²	163	110.7 Å²	110.7	71%	0.709	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-62.8	-12.5	178.7	-64.1	177.3	-174.1	168.8	0	113	P199 K203	P199-K201 PolarHBondContact O-N 2.87Å; K201-K203 VanDerWaalsContact C-N 3.3Å; K201-K203 PolarHBondContact O-N 3.22Å
202	S	59.2	Low	67.2	Low	97 Å²	97	115.8 Å²	115.8	68%	0.678	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-70.5	-16.6	-177	56	0	0	0	0	114.6	D200	D200-S202 PolarHBondContact O-N 3.45Å
203	K	52.4	Low	64.6	Low	181 Å²	181	121.1 Å²	121.1	79%	0.787	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-95.4	-11.4	-179.6	-64.8	-171.9	-178.4	178.2	0	115.1	D200 K201	D200-K203 PolarHBondContact O-N 3.17Å; K201-K203 VanDerWaalsContact C-N 3.3Å; K201-K203 PolarHBondContact O-N 3.22Å
204	A	50.2	Low	61.8	Low	86 Å²	86	124.6 Å²	124.6	71%	0.711	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-17	-176.8	0	0	0	0	0	114.3
205	N	40.2	Very low	59.2	Low	127 Å²	127	130.2 Å²	130.2	68%	0.679	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	20.1	-175.9	-79.8	-9.2	0	0	0	114.9	K207 N208	N205-K207 PolarHBondContact O-N 3.16Å; N205-N208 PolarHBondContact O-N 3.42Å
206	G	41	Very low	56.4	Low	76 Å²	76	131.4 Å²	131.4	78%	0.784	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	9.5	-179	0	0	0	0	0	116.8
207	K	41.2	Very low	53.7	Low	201 Å²	201	133.3 Å²	133.3	87%	0.874	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	3.9	177.5	-82.4	-174.7	176.7	177.9	0	115.6	N205	N205-K207 PolarHBondContact O-N 3.16Å
208	N	36.4	Very low	51.1	Low	157 Å²	157	134.7 Å²	134.7	84%	0.84	76%	0.758	S	S	*	*	S	Bend	trans	-145.5	38	-179	-91	-24.7	0	0	0	115.8	N205	N205-N208 PolarHBondContact O-N 3.42Å
209	V	40.7	Very low	48.6	Very low	134 Å²	134	138.1 Å²	138.1	81%	0.812	78%	0.779	S	S	*	*			trans	-128.6	63.2	171.4	-167.9	0	0	0	0	110.8
210	L	43.9	Very low	46.3	Very low	170 Å²	170	143.7 Å²	143.7	89%	0.89	80%	0.797	S	S	*	*	S	Bend	trans	-147	65.2	166	-90.8	165.8	0	0	0	108.1
211	K	40.9	Very low	44.3	Very low	205 Å²	205	145.2 Å²	145.2	89%	0.891	81%	0.805	S	S	*	*			trans	177.1	90.7	161.1	-104.6	166.6	-177.6	180	0	109.2
212	S	42.2	Very low	43	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	81%	0.811	S	S	*	*				174.5	122.9	127.9	40.9	0	0	0	0	111.9
213	K	43.3	Very low	42.3	Very low	203 Å²	203	144.6 Å²	144.6	88%	0.883	82%	0.816	S	S	*	*			trans	75.2	86.3	144.8	-65.3	-177.3	175.9	179.5	0	118
214	A	39.9	Very low	42.3	Very low	97 Å²	97	145.2 Å²	145.2	80%	0.802	82%	0.822	S	S	*	*			trans	-31.4	127.5	138.5	0	0	0	0	0	114
215	K	41.8	Very low	42.1	Very low	209 Å²	209	146.8 Å²	146.8	91%	0.909	82%	0.823	S	S	*	*			trans	-139.4	125.4	134.8	-81.5	-166.3	177	-179.7	0	108.1
216	A	39.4	Very low	42.5	Very low	91 Å²	91	146.3 Å²	146.3	75%	0.752	82%	0.824	S	S	*	*			trans	-74.3	147.2	-173	0	0	0	0	0	112.6
217	S	39.4	Very low	43	Very low	120 Å²	120	150.2 Å²	150.2	84%	0.839	83%	0.825	S	S	*	*			trans	-157.9	115.9	143.1	-83.2	0	0	0	0	107.4
218	P	39.4	Very low	43.3	Very low	126 Å²	126	147.3 Å²	147.3	82%	0.818	82%	0.824	S	S	*	*			trans	-93.2	125.4	174.5	33.1	-24.5	0	0	0	108.9
219	N	41	Very low	43.6	Very low	160 Å²	160	146.9 Å²	146.9	86%	0.856	83%	0.828	S	S	*	*			trans	-133.9	142.8	156.2	-149.5	1.8	0	0	0	111.3
220	K	42.6	Very low	44	Very low	177 Å²	177	144.7 Å²	144.7	77%	0.77	82%	0.824	S	S	*	*			trans	-83.2	166.5	-151.4	-61.3	167.3	168.4	172.5	0	113.4
221	N	42.4	Very low	44.2	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	83%	0.825	S	S	*	*			trans	83.7	100	156.4	-53.2	-17.1	0	0	0	117.1
222	S	45.2	Very low	44.5	Very low	118 Å²	118	146.8 Å²	146.8	83%	0.825	83%	0.826	S	S	*	*				-172.7	130.9	115.8	-168.8	0	0	0	0	110.4
223	T	45.6	Very low	44.6	Very low	128 Å²	128	153.4 Å²	153.4	79%	0.785	83%	0.834	S	S	*	*			trans	-62.8	120.8	177.8	25.8	0	0	0	0	113.1
224	Q	51.1	Low	44.6	Very low	195 Å²	195	148.5 Å²	148.5	91%	0.911	83%	0.831	S	S	*	*			trans	-149.2	82.3	149.9	-118.9	175.7	25.6	0	0	110.1
225	T	46.2	Very low	44.8	Very low	119 Å²	119	148.8 Å²	148.8	73%	0.73	83%	0.834	S	S	*	*			trans	-49.9	135.6	145.8	-34.2	0	0	0	0	106.6
226	V	48.2	Very low	45	Very low	117 Å²	117	148.5 Å²	148.5	71%	0.709	83%	0.832	S	S	*	*				-170	169.9	68.5	-163.9	0	0	0	0	106.5
227	I	51.8	Low	45.4	Very low	158 Å²	158	151.3 Å²	151.3	81%	0.81	84%	0.835	S	S	*	*	S	Bend	trans	72.5	51.6	169.4	52.9	171.1	0	0	0	119.6
228	T	47.6	Very low	45.9	Very low	139 Å²	139	155 Å²	155	85%	0.853	84%	0.839	S	S	*	*			trans	-150.3	54.8	156.2	41.9	0	0	0	0	113.2
229	T	43.9	Very low	46.1	Very low	149 Å²	149	153.2 Å²	153.2	91%	0.914	84%	0.835	S	S	*	*	S	Bend	trans	-136.4	13.7	178.7	7.7	0	0	0	0	116.9
230	A	48.9	Very low	46.5	Very low	88 Å²	88	155.9 Å²	155.9	73%	0.727	84%	0.839	S	S	*	*	S	Bend	trans	-112.2	-10.6	-178.4	0	0	0	0	0	116.9
231	F	48.4	Very low	47.2	Very low	207 Å²	207	156.2 Å²	156.2	91%	0.908	84%	0.84	S	S	*	*	S	Bend	trans	-111.6	13.4	-172.5	-76.1	-77	0	0	0	116.6
232	K	46.5	Very low	48.2	Very low	211 Å²	211	154.5 Å²	154.5	92%	0.917	84%	0.837	S	S	*	*	S	Bend	trans	-113	16.6	-178	-80.2	-172.2	177	177.9	0	115.9
233	R	44.1	Very low	49.1	Very low	253 Å²	253	157.8 Å²	157.8	96%	0.955	84%	0.837	S	S	*	*	S	Bend	trans	-115.5	11.6	179.5	-74.6	-172.1	173.4	-168.5	-1.3	116.1
234	A	43.7	Very low	50.3	Low	99 Å²	99	157.7 Å²	157.7	82%	0.818	84%	0.836	S	S	*	*	S	Bend	trans	-127.4	72.7	178	0	0	0	0	0	111.6
235	A	44.3	Very low	51.4	Low	104 Å²	104	152.9 Å²	152.9	86%	0.86	82%	0.822	S	S	*	*	S	Bend	trans	-167	4.5	167.3	0	0	0	0	0	115.9
236	K	44.7	Very low	52.3	Low	202 Å²	202	156 Å²	156	88%	0.878	83%	0.825	S	S	*	*	S	Bend	trans	-109.9	2.8	-170.5	-123	-176	-178.2	-175.5	0	117.2
237	D	47.6	Very low	53.6	Low	151 Å²	151	156 Å²	156	81%	0.807	83%	0.831	S	S	*	*	S	Bend	trans	-130.3	87.5	173	-77.2	-48.7	0	0	0	109.4
238	Q	50	Low	54.2	Low	197 Å²	197	150.2 Å²	150.2	92%	0.921	81%	0.81	S	S	*	*			trans	179.1	146.6	144.1	-98.6	169	78.3	0	0	111.3
239	A	43.9	Very low	55.2	Low	89 Å²	89	150.2 Å²	150.2	74%	0.736	81%	0.81	S	S	*	*			trans	83.2	61.2	165.3	0	0	0	0	0	118	K241	A239-K241 PolarHBondContact O-N 2.96Å
240	K	48.8	Very low	55.7	Low	216 Å²	216	146 Å²	146	94%	0.939	80%	0.796	S	S	*	*				-70.6	96.4	123.6	-76.1	-177.9	178.7	-178.9	0	107.8
241	K	58.8	Low	56.5	Low	184 Å²	184	150.7 Å²	150.7	80%	0.8	80%	0.803	S	S	*	*			trans	-139.3	132.8	157.4	-78.6	-170.1	178.9	179.6	0	108.6	A239	A239-K241 PolarHBondContact O-N 2.96Å
242	P	63.1	Low	57	Low	120 Å²	120	146.6 Å²	146.6	78%	0.779	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.1	140.8	-178.8	-9.2	24.2	0	0	0	110.7	V244	P242-V244 PolarHBondContact O-N 2.89Å
243	F	65	Low	57.2	Low	187 Å²	187	144.8 Å²	144.8	82%	0.82	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64.3	118.1	167	174.2	-96.9	0	0	0	109.3	P245	F243-P245 HydrophobicContact CE1-CB 4.05Å
244	V	70.6	Confident	57.3	Low	127 Å²	127	136.4 Å²	136.4	77%	0.77	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-103.7	116.6	168.7	-91.5	0	0	0	0	108.3	P242	P242-V244 PolarHBondContact O-N 2.89Å
245	P	72.8	Confident	57.5	Low	94 Å²	94	136.1 Å²	136.1	61%	0.61	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-67.9	142.1	174.9	26.9	-31.4	0	0	0	110.4	F243 S247	F243-P245 HydrophobicContact CE1-CB 4.05Å; P245-S247 PolarHBondContact O-N 3.31Å
246	F	66.7	Low	57.6	Low	183 Å²	183	137.2 Å²	137.2	80%	0.803	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-59.3	117.3	175.1	174.3	-101.9	0	0	0	110.5	G248	F246-G248 WeakPolarHBondContact CE1-O 3.06Å
247	S	74.2	Confident	57.9	Low	117 Å²	117	133.4 Å²	133.4	82%	0.818	78%	0.775	S	S	*	*			trans	-96.7	19.6	179.8	65.3	0	0	0	0	113.4	P245 V249	P245-S247 PolarHBondContact O-N 3.31Å; S247-V249 PolarHBondContact O-N 3.36Å
248	G	65.7	Low	57.9	Low	37 Å²	37	135.8 Å²	135.8	38%	0.381	78%	0.778	S	S	.	*			trans	-76.4	123.8	-179.8	0	0	0	0	0	111.7	F246 G250	F246-G248 WeakPolarHBondContact CE1-O 3.06Å; G248-G250 PolarHBondContact O-N 3.47Å
249	V	67.5	Low	57.6	Low	139 Å²	139	131.3 Å²	131.3	84%	0.842	77%	0.769	S	S	*	*			trans	-72.7	103.9	168.7	-166.3	0	0	0	0	107.3	S247	S247-V249 PolarHBondContact O-N 3.36Å
250	G	55.2	Low	57.6	Low	61 Å²	61	135 Å²	135	63%	0.629	78%	0.776	S	S	*	*			trans	-61.6	136	176.6	0	0	0	0	0	111.2	G248 V252	G248-G250 PolarHBondContact O-N 3.47Å; G250-V252 PolarHBondContact O-N 3Å
251	H	65	Low	57.3	Low	187 Å²	187	127.9 Å²	127.9	87%	0.866	76%	0.764	S	S	*	*			trans	-74.6	121.5	170.6	-94.9	54.4	0	0	0	109.9	L253	H251-L253 PolarHBondContact O-N 3.4Å
252	V	59.1	Low	56.6	Low	120 Å²	120	126.4 Å²	126.4	73%	0.727	77%	0.77	S	S	*	*			trans	-80.8	110.2	170.6	178.8	0	0	0	0	108.2	G250 G254	G250-V252 PolarHBondContact O-N 3Å; V252-G254 PolarHBondContact O-N 3.12Å
253	L	50.2	Low	55.7	Low	173 Å²	173	124.6 Å²	124.6	91%	0.906	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	113	168.6	-66.2	170.5	0	0	0	108.2	H251	H251-L253 PolarHBondContact O-N 3.4Å
254	G	47.3	Very low	54.7	Low	77 Å²	77	120.6 Å²	120.6	79%	0.794	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	129.2	12.5	169.2	0	0	0	0	0	118.1	V252	V252-G254 PolarHBondContact O-N 3.12Å
255	S	46.3	Very low	53.5	Low	93 Å²	93	122.5 Å²	122.5	65%	0.65	77%	0.769	S	S	*	*			trans	-96.2	130.2	170.8	-68.4	0	0	0	0	112.1	S257	S255-S257 PolarHBondContact O-N 2.92Å
256	P	48.3	Very low	52.3	Low	128 Å²	128	122.3 Å²	122.3	83%	0.831	77%	0.77	S	S	*	*			trans	-79.7	110.1	176.2	30.2	-29.8	0	0	0	110.3
257	S	50.5	Low	51.4	Low	121 Å²	121	120.4 Å²	120.4	85%	0.846	77%	0.773	S	S	*	*			trans	-75.4	128.9	174.6	-46.1	0	0	0	0	110.8	S255	S255-S257 PolarHBondContact O-N 2.92Å
258	K	47.5	Very low	49.9	Very low	202 Å²	202	118.1 Å²	118.1	88%	0.878	77%	0.769	S	S	*	*			trans	-67.1	139.5	173.9	-71.7	177.8	176.2	177.6	0	111.8
259	S	44	Very low	49.1	Very low	103 Å²	103	124 Å²	124	72%	0.72	79%	0.792	S	S	*	*			trans	-24.6	140.8	170.4	54.7	0	0	0	0	119.8
260	N	43.8	Very low	47.9	Very low	167 Å²	167	123.8 Å²	123.8	89%	0.893	79%	0.79	S	S	*	*				-160.1	130.5	122.8	-96.8	-12.6	0	0	0	110.5
261	G	41.8	Very low	47.1	Very low	66 Å²	66	126.9 Å²	126.9	68%	0.68	80%	0.797	S	S	*	*			trans	110.4	92.6	152.8	0	0	0	0	0	118.9
262	T	44	Very low	46.2	Very low	152 Å²	152	126 Å²	126	93%	0.933	80%	0.797	S	S	*	*			trans	60.6	113.2	134.6	55.5	0	0	0	0	120.8
263	G	43.7	Very low	45.1	Very low	82 Å²	82	123.3 Å²	123.3	85%	0.845	79%	0.793	S	S	*	*			trans	168.6	98.8	161.4	0	0	0	0	0	113.4
264	S	44.3	Very low	44.9	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	80%	0.796	S	S	*	*			trans	-62	131.2	179.1	178.8	0	0	0	0	113.7
265	H	46.8	Very low	45.1	Very low	167 Å²	167	132.9 Å²	132.9	77%	0.773	80%	0.799	S	S	*	*				175.2	123.2	119	-99.2	-70.3	0	0	0	113.4
266	S	46.9	Very low	44.9	Very low	91 Å²	91	134.3 Å²	134.3	64%	0.636	81%	0.806	S	S	*	*			trans	-6.5	142.6	146	58	0	0	0	0	117.3
267	T	48	Very low	44.9	Very low	142 Å²	142	136.8 Å²	136.8	87%	0.871	81%	0.812	S	S	*	*			cis	-175.4	147	34.9	-20.8	0	0	0	0	109.3
268	G	42.1	Very low	44.3	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	81%	0.812	S	S	*	*			trans	103.2	107.6	133.7	0	0	0	0	0	121.3
269	N	48.4	Very low	43.9	Very low	161 Å²	161	131.6 Å²	131.6	86%	0.861	81%	0.807	S	S	*	*			trans	93.3	83.6	142.7	-70.1	1.6	0	0	0	122.3
270	T	42.3	Very low	43.9	Very low	133 Å²	133	133.7 Å²	133.7	82%	0.816	82%	0.815	S	S	*	*				32.4	120.5	114.9	-42.8	0	0	0	0	121.8
271	V	39.3	Very low	44	Very low	127 Å²	127	135.2 Å²	135.2	77%	0.77	81%	0.813	S	S	*	*			trans	-58.1	136.8	165	176	0	0	0	0	114.2
272	I	46.2	Very low	43.7	Very low	167 Å²	167	141.4 Å²	141.4	86%	0.856	82%	0.822	S	S	*	*			trans	-143.8	124.3	141.2	-57.4	-174.8	0	0	0	110.1
273	G	35.9	Very low	43.7	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	82%	0.815	S	S	*	*			trans	-73.7	162.6	-179	0	0	0	0	0	115.4
274	R	45.3	Very low	43.3	Very low	253 Å²	253	148.8 Å²	148.8	96%	0.955	82%	0.817	S	S	*	*			trans	-122.4	123.9	166.4	-79.3	-176.6	173.9	178.5	-1.3	110.2
275	K	51.1	Low	43.1	Very low	198 Å²	198	149.5 Å²	149.5	86%	0.861	82%	0.822	S	S	*	*			trans	-66.9	152.4	174.8	-65.4	176.6	175.3	-178.8	0	111.2
276	P	43.7	Very low	42.5	Very low	124 Å²	124	145.6 Å²	145.6	81%	0.805	82%	0.819	S	S	*	*			trans	-80.9	133.8	168.8	8.6	8	0	0	0	111.1	T278	P276-T278 PolarHBondContact O-N 2.75Å
277	L	47.3	Very low	42.1	Very low	180 Å²	180	152.5 Å²	152.5	94%	0.942	83%	0.831	S	S	*	*			trans	-72.1	115	172.3	-86	152	0	0	0	110.5
278	T	38.3	Very low	41.7	Very low	140 Å²	140	150 Å²	150	86%	0.859	82%	0.82	S	S	*	*			trans	-81.6	122	163.7	50.2	0	0	0	0	109.4	P276	P276-T278 PolarHBondContact O-N 2.75Å
279	G	38.6	Very low	41.3	Very low	74 Å²	74	154.1 Å²	154.1	76%	0.763	83%	0.825	S	S	*	*			trans	-173.5	80.7	174.4	0	0	0	0	0	112.3
280	V	44.7	Very low	40.9	Very low	147 Å²	147	156.2 Å²	156.2	89%	0.891	83%	0.826	S	S	*	*			trans	-117.2	107.3	165.4	179.8	0	0	0	0	108.4
281	K	44.6	Very low	40.5	Very low	198 Å²	198	155.6 Å²	155.6	86%	0.861	83%	0.825	S	S	*	*			trans	-72.6	128.2	170.3	-74.9	179.5	176.4	179.1	0	109.2	I283	K281-I283 PolarHBondContact O-N 3.3Å
282	K	36.5	Very low	40.1	Very low	196 Å²	196	157.7 Å²	157.7	85%	0.852	83%	0.832	S	S	*	*			trans	-76.7	104.3	176.1	-164.9	174.6	-171.4	173.9	0	108.8
283	I	44.3	Very low	39.8	Very low	157 Å²	157	154.3 Å²	154.3	81%	0.805	83%	0.828	S	S	*	*			trans	-92.3	115.4	169.4	-64.4	177.8	0	0	0	108.1	K281	K281-I283 PolarHBondContact O-N 3.3Å
284	R	33.8	Very low	39.6	Very low	233 Å²	233	157.9 Å²	157.9	88%	0.879	83%	0.832	S	S	*	*			trans	-73.6	134	166.6	-69.9	174.8	167.6	178.7	-4	108
285	S	41	Very low	39.1	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	83%	0.827	S	S	*	*			trans	-137.4	123.5	158.1	-165.2	0	0	0	0	109.8
286	A	35	Very low	38.3	Very low	86 Å²	86	147.7 Å²	147.7	71%	0.711	81%	0.813	S	S	*	*			trans	-84.7	150.6	171.3	0	0	0	0	0	110
287	R	37.9	Very low	37.8	Very low	235 Å²	235	149 Å²	149	89%	0.887	81%	0.811	S	S	*	*			trans	168.3	105.7	147.5	-92.4	157	-173.4	-155.9	2	107
288	S	39.8	Very low	37.3	Very low	91 Å²	91	148.2 Å²	148.2	64%	0.636	81%	0.806	S	S	*	*				55.4	106.5	77.7	71.8	0	0	0	0	113.5
289	D	33	Very low	37.1	Very low	155 Å²	155	147 Å²	147	83%	0.829	79%	0.794	S	S	*	*			trans	57.2	116.8	140.4	-48.8	-41.7	0	0	0	120.2
290	K	40.3	Very low	36.9	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	80%	0.8	S	S	*	*			trans	-143.8	133.4	140.3	-96.3	-170.6	179.8	-178.7	0	111.3
291	P	34	Very low	36.5	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	79%	0.792	S	S	*	*			trans	-87.4	170.3	172.1	36.2	-32	0	0	0	112
292	N	31	Very low	36.5	Very low	171 Å²	171	144.1 Å²	144.1	91%	0.914	79%	0.787	S	S	*	*			trans	-37	137.2	170.4	-92	-26.1	0	0	0	114.4
293	A	40.5	Very low	36.4	Very low	95 Å²	95	148.5 Å²	148.5	79%	0.785	81%	0.806	S	S	*	*			trans	-136.9	115.7	155.7	0	0	0	0	0	109.3
294	D	31.6	Very low	36	Very low	140 Å²	140	148.1 Å²	148.1	75%	0.749	81%	0.806	S	S	*	*			trans	-46	145.6	153.7	-172.3	3.7	0	0	0	111.2	S296	D294-S296 PolarHBondContact OD1-N 3.07Å
295	N	35.2	Very low	36.2	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	80%	0.802	S	S	*	*			trans	-159.6	87.3	159.6	-101.4	-5.4	0	0	0	109.5
296	S	33.5	Very low	35.9	Very low	81 Å²	81	145.1 Å²	145.1	57%	0.566	80%	0.801	S	S	*	*				0.3	142	128.4	54.2	0	0	0	0	119.7	D294	D294-S296 PolarHBondContact OD1-N 3.07Å
297	I	32	Very low	35.9	Very low	151 Å²	151	148.6 Å²	148.6	77%	0.774	81%	0.806	S	S	*	*			trans	74	111.9	138.8	-76	169.7	0	0	0	118.4
298	I	38.2	Very low	35.8	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	80%	0.801	S	S	*	*			trans	-120.4	105.2	145.3	-33.9	173.2	0	0	0	105.4
299	D	34.4	Very low	35.6	Very low	114 Å²	114	146.7 Å²	146.7	61%	0.61	81%	0.812	S	S	*	*			trans	-73.6	135.6	169.2	-179.6	21.2	0	0	0	109.1
300	L	34.3	Very low	35.7	Very low	167 Å²	167	146.1 Å²	146.1	87%	0.874	81%	0.811	S	S	*	*			trans	-117.9	88.3	172.4	-76.7	170.3	0	0	0	107.2
301	T	36.3	Very low	35.4	Very low	120 Å²	120	141.5 Å²	141.5	74%	0.736	81%	0.805	S	S	*	*			trans	-106.1	119.6	157.8	45.1	0	0	0	0	108.2
302	G	44.5	Very low	35.5	Very low	72 Å²	72	143.3 Å²	143.3	74%	0.742	81%	0.807	S	S	*	*			trans	167.5	80.7	178	0	0	0	0	0	115
303	K	34.7	Very low	35.9	Very low	288 Å²	288	140.7 Å²	140.7	100%	1.252	80%	0.797	S	S	*	*			trans	85.9	0	173.6	-59.6	-175.5	178.5	-176.7	0	117.5

Retrieved 303 of 303 residues in 69.3 ms (Link to these results)

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