A0A061IDI8_CRIGR Loading...

6-phosphofructo-2-kinase/fructose-2, 6-biphosphatase 3-like isoform 6

AlphaFold DB , UniProt , Accession A0A061IDI8, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Pfkfb3, Length 555 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	59.3	Low	89.1	Confident	227 Å²	227	106.1 Å²	106.1	100%	1.118	54%	0.543	S	S	*	.				0	132.5	0	-64.4	-111	-85.8	0	0	106.9
2	P	71.6	Confident	89.8	Confident	125 Å²	125	99.2 Å²	99.2	81%	0.812	51%	0.506	S	S	*	.			trans	-55.7	139.1	170.9	-16.8	29.3	0	0	0	109.2	E4	P2-E4 PolarHBondContact O-N 3.07Å
3	L	81.9	Confident	90.3	Very high	159 Å²	159	97.3 Å²	97.3	83%	0.832	50%	0.497	S	S	*	.			trans	-73.4	99.2	177.7	-71	165.5	0	0	0	108.5
4	E	93.3	Very high	90.6	Very high	128 Å²	128	101.6 Å²	101.6	60%	0.598	50%	0.504	S	S	*	.			trans	-77.2	127.9	171.8	-165.2	179.8	171.1	0	0	109.6	P2 V17	P2-E4 PolarHBondContact O-N 3.07Å; E4-V17 HydrophobicContact CB-CG2 4.23Å; E4-V17 HydrophobicContact CG-CG2 3.8Å; E4-V17 PolarHBondContact O-N 3.1Å; E4-V17 VanDerWaalsContact O-N 3.1Å
5	L	95.5	Very high	90.9	Very high	85 Å²	85	98.9 Å²	98.9	45%	0.445	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.4	-178.2	-56.8	179.2	0	0	0	110.1	W14 V15 P16	L5-W14 HydrophobicContact CB-CE3 3.85Å; L5-W14 HydrophobicContact CB-CZ3 4.47Å; L5-W14 HydrophobicContact CD1-CB 4.4Å; L5-V15 CarbonylContact C-O 3.56Å; L5-V15 WeakPolarHBondContact CA-O 3.37Å; L5-P16 HydrophobicContact CD2-CB 4.44Å; L5-P16 HydrophobicContact CD2-CG 4.3Å
6	T	95.7	Very high	91.1	Very high	71 Å²	71	98.4 Å²	98.4	44%	0.436	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147	167.5	-177.1	0	0	0	0	109.4	V15 V17	T6-V15 HydrophobicContact CG2-CG2 3.86Å; T6-V15 PolarHBondContact N-O 3.02Å; T6-V15 WeakPolarHBondContact O-CG2 3.5Å; T6-V15 PolarHBondContact O-N 2.76Å; T6-V15 VanDerWaalsContact O-O 3.12Å; T6-V17 HydrophobicContact CG2-CG2 4.08Å
7	Q	96.6	Very high	91	Very high	78 Å²	78	95.2 Å²	95.2	36%	0.364	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.9	175.3	-162.9	177.4	40.5	0	0	110.2	R9 K12 I13 W14	Q7-R9 PolarHBondContact O-N 3.15Å; Q7-K12 VanDerWaalsContact CG-C 3.49Å; Q7-K12 HydrophobicContact CG-CB 4.38Å; Q7-K12 PolarHBondContact NE2-O 3.19Å; Q7-I13 CarbonylContact C-O 3.57Å; Q7-I13 WeakPolarHBondContact CA-O 3.45Å; Q7-W14 HydrophobicContact CB-CD2 4.01Å; Q7-W14 HydrophobicContact CB-CE3 3.9Å; Q7-W14 HydrophobicContact CB-CH2 4.08Å; Q7-W14 HydrophobicContact CB-CZ2 4.16Å; Q7-W14 HydrophobicContact CB-CZ3 3.95Å; Q7-W14 HydrophobicContact CG-CD2 4.26Å; Q7-W14 HydrophobicContact CG-CZ2 4.49Å
8	S	96.6	Very high	90.7	Very high	36 Å²	36	95.9 Å²	95.9	25%	0.252	49%	0.493	S	S	.	.			trans	-64.3	133.6	174.5	72.1	0	0	0	0	110.2	V10 K12 I13	S8-V10 PolarHBondContact O-N 2.86Å; S8-K12 WeakPolarHBondContact O-CA 3.49Å; S8-K12 PolarHBondContact O-N 3.48Å; S8-K12 PolarHBondContact OG-N 3.48Å; S8-I13 PolarHBondContact N-O 3.43Å; S8-I13 PolarHBondContact OG-N 2.92Å; S8-I13 PolarHBondContact OG-O 3.47Å
9	R	96.9	Very high	90.4	Very high	147 Å²	147	98.5 Å²	98.5	56%	0.555	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-39.7	-174.3	-66.4	176.3	66.8	-160	-3.8	114.3	Q7 K12 E343 L347	Q7-R9 PolarHBondContact O-N 3.15Å; R9-K12 WeakPolarHBondContact O-CE 3.42Å; R9-K12 PolarHBondContact O-NZ 3.14Å; R9-E343 IonicContact CZ-OE1 3Å; R9-E343 IonicContact NE-OE1 2.7Å; R9-E343 PolarHBondContact NE-OE1 2.86Å; R9-E343 IonicContact NH2-OE1 3.25Å; R9-E343 PolarHBondContact NH2-OE1 2.99Å; R9-E343 IonicContact NH2-OE2 2.92Å; R9-L347 HydrophobicContact CB-CD1 3.95Å; R9-L347 HydrophobicContact CB-CD2 4.32Å
10	V	96.4	Very high	90	Very high	34 Å²	34	102.3 Å²	102.3	21%	0.206	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-60.3	-176.5	177.5	0	0	0	0	111.8	S8 K12 L347 D351 R356	S8-V10 PolarHBondContact O-N 2.86Å; V10-K12 PolarHBondContact O-N 2.89Å; V10-L347 HydrophobicContact CG2-CD2 4.07Å; V10-D351 HydrophobicContact CG1-CB 4.11Å; V10-R356 PolarHBondContact O-N 3.04Å
11	Q	96.3	Very high	89.7	Confident	77 Å²	77	101.5 Å²	101.5	36%	0.36	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.2	-171.7	-62.8	-178.7	-64.6	0	0	114.1	I13	Q11-I13 HydrophobicContact CB-CG1 3.84Å; Q11-I13 PolarHBondContact O-N 2.76Å
12	K	97.6	Very high	90.8	Very high	23 Å²	23	96.5 Å²	96.5	10%	0.1	50%	0.499	C	S	.	.			trans	56.3	32.9	-177.4	-52.6	-57.7	-167.8	-64.1	0	114.3	Q7 S8 R9 V10 E344 R356	Q7-K12 VanDerWaalsContact CG-C 3.49Å; Q7-K12 HydrophobicContact CG-CB 4.38Å; Q7-K12 PolarHBondContact NE2-O 3.19Å; S8-K12 WeakPolarHBondContact O-CA 3.49Å; S8-K12 PolarHBondContact O-N 3.48Å; S8-K12 PolarHBondContact OG-N 3.48Å; R9-K12 WeakPolarHBondContact O-CE 3.42Å; R9-K12 PolarHBondContact O-NZ 3.14Å; V10-K12 PolarHBondContact O-N 2.89Å; K12-E344 WeakPolarHBondContact CE-OE2 3.24Å; K12-E344 IonicContact NZ-OE1 3.36Å; K12-E344 PolarHBondContact NZ-OE1 3.33Å; K12-E344 IonicContact NZ-OE2 3.57Å; K12-E344 PolarHBondContact NZ-OE2 2.92Å; K12-R356 HydrophobicContact CB-CB 4.48Å; K12-R356 HydrophobicContact CG-CB 4.19Å; K12-R356 WeakPolarHBondContact CG-O 3.45Å; K12-R356 PolarHBondContact NZ-O 3.19Å; K12-R356 VanDerWaalsContact NZ-O 3.07Å
13	I	96	Very high	91.3	Very high	75 Å²	75	97.1 Å²	97.1	39%	0.385	50%	0.495	S	S	.	.			trans	-90.8	132	176.9	-56.5	-57.9	0	0	0	110.6	Q7 S8 Q11 V15	Q7-I13 CarbonylContact C-O 3.57Å; Q7-I13 WeakPolarHBondContact CA-O 3.45Å; S8-I13 PolarHBondContact N-O 3.43Å; S8-I13 PolarHBondContact OG-N 2.92Å; S8-I13 PolarHBondContact OG-O 3.47Å; Q11-I13 HydrophobicContact CB-CG1 3.84Å; Q11-I13 PolarHBondContact O-N 2.76Å; I13-V15 HydrophobicContact CG2-CG1 4.21Å; I13-V15 PolarHBondContact O-N 3.1Å
14	W	95.4	Very high	91.1	Very high	157 Å²	157	93.4 Å²	93.4	60%	0.595	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.1	172.2	-68.9	100.3	0	0	0	110.5	L5 Q7	L5-W14 HydrophobicContact CB-CE3 3.85Å; L5-W14 HydrophobicContact CB-CZ3 4.47Å; L5-W14 HydrophobicContact CD1-CB 4.4Å; Q7-W14 HydrophobicContact CB-CD2 4.01Å; Q7-W14 HydrophobicContact CB-CE3 3.9Å; Q7-W14 HydrophobicContact CB-CH2 4.08Å; Q7-W14 HydrophobicContact CB-CZ2 4.16Å; Q7-W14 HydrophobicContact CB-CZ3 3.95Å; Q7-W14 HydrophobicContact CG-CD2 4.26Å; Q7-W14 HydrophobicContact CG-CZ2 4.49Å
15	V	94.7	Very high	90.4	Very high	62 Å²	62	98.6 Å²	98.6	38%	0.376	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.2	177.6	-62.7	0	0	0	0	109.9	L5 T6 I13	L5-V15 CarbonylContact C-O 3.56Å; L5-V15 WeakPolarHBondContact CA-O 3.37Å; T6-V15 HydrophobicContact CG2-CG2 3.86Å; T6-V15 PolarHBondContact N-O 3.02Å; T6-V15 WeakPolarHBondContact O-CG2 3.5Å; T6-V15 PolarHBondContact O-N 2.76Å; T6-V15 VanDerWaalsContact O-O 3.12Å; I13-V15 HydrophobicContact CG2-CG1 4.21Å; I13-V15 PolarHBondContact O-N 3.1Å
16	P	93.3	Very high	89.4	Confident	90 Å²	90	101.1 Å²	101.1	58%	0.584	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.1	141.3	171.5	-22.5	33.6	0	0	0	111	L5 D18	L5-P16 HydrophobicContact CD2-CB 4.44Å; L5-P16 HydrophobicContact CD2-CG 4.3Å; P16-D18 PolarHBondContact O-N 2.95Å; P16-D18 VanDerWaalsContact O-N 3.15Å
17	V	90.7	Very high	88.3	Confident	44 Å²	44	102.8 Å²	102.8	27%	0.267	53%	0.527	S	S	.	.			trans	-66	116.8	174.2	-177.9	0	0	0	0	109	E4 T6 H19	E4-V17 HydrophobicContact CB-CG2 4.23Å; E4-V17 HydrophobicContact CG-CG2 3.8Å; E4-V17 PolarHBondContact O-N 3.1Å; E4-V17 VanDerWaalsContact O-N 3.1Å; T6-V17 HydrophobicContact CG2-CG2 4.08Å; V17-H19 VanDerWaalsContact CG1-CE1 3.45Å; V17-H19 WeakPolarHBondContact CG1-CE1 3.43Å; V17-H19 WeakPolarHBondContact CG1-NE2 3.34Å; V17-H19 PolarHBondContact O-N 3.31Å
18	D	85.6	Confident	86.6	Confident	109 Å²	109	101.6 Å²	101.6	58%	0.583	54%	0.536	S	S	*	.			trans	-93.4	87.7	176.4	-179.9	20.7	0	0	0	109.8	P16 R20	P16-D18 PolarHBondContact O-N 2.95Å; P16-D18 VanDerWaalsContact O-N 3.15Å; D18-R20 PolarHBondContact O-N 2.8Å; D18-R20 VanDerWaalsContact OD2-CG 3.23Å; D18-R20 WeakPolarHBondContact OD2-CG 3.16Å; D18-R20 IonicContact OD2-NE 2.85Å; D18-R20 PolarHBondContact OD2-NE 3.5Å; D18-R20 VanDerWaalsContact OD2-NE 3.08Å
19	H	85.1	Confident	85.1	Confident	144 Å²	144	106.2 Å²	106.2	67%	0.667	57%	0.565	S	S	*	*			trans	-72.9	81.8	166.9	-64	-57.7	0	0	0	109.4	V17	V17-H19 VanDerWaalsContact CG1-CE1 3.45Å; V17-H19 WeakPolarHBondContact CG1-CE1 3.43Å; V17-H19 WeakPolarHBondContact CG1-NE2 3.34Å; V17-H19 PolarHBondContact O-N 3.31Å
20	R	81.7	Confident	82.9	Confident	174 Å²	174	108.1 Å²	108.1	66%	0.657	58%	0.577	S	S	*	*			trans	-55.5	132	-176.7	-70	-177.2	-174.1	179.6	7.1	110.7	D18 P24	D18-R20 PolarHBondContact O-N 2.8Å; D18-R20 VanDerWaalsContact OD2-CG 3.23Å; D18-R20 WeakPolarHBondContact OD2-CG 3.16Å; D18-R20 IonicContact OD2-NE 2.85Å; D18-R20 PolarHBondContact OD2-NE 3.5Å; D18-R20 VanDerWaalsContact OD2-NE 3.08Å; R20-P24 HydrophobicContact CB-CB 4.45Å
21	P	84.5	Confident	80.9	Confident	86 Å²	86	111.4 Å²	111.4	56%	0.558	59%	0.593	S	S	*	*			trans	-64.4	166.6	173.6	28.7	-34.4	0	0	0	110.4	L23	P21-L23 CarbonylContact O-C 3.55Å; P21-L23 PolarHBondContact O-N 2.75Å
22	S	82.3	Confident	79	Confident	122 Å²	122	114.2 Å²	114.2	85%	0.853	62%	0.616	S	S	*	*	S	Bend	trans	-50.4	-29.1	-179.9	53.4	0	0	0	0	114.1
23	L	80.6	Confident	78	Confident	138 Å²	138	118.6 Å²	118.6	72%	0.723	64%	0.64	S	S	*	*	S	Bend	trans	-114.5	95	170.8	-67.6	171.5	0	0	0	109.8	P21 R25	P21-L23 CarbonylContact O-C 3.55Å; P21-L23 PolarHBondContact O-N 2.75Å; L23-R25 PolarHBondContact O-N 3.36Å
24	P	78.6	Confident	77.7	Confident	81 Å²	81	117.7 Å²	117.7	53%	0.526	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-65.7	127	179	26.1	-32.8	0	0	0	110	R20	R20-P24 HydrophobicContact CB-CB 4.45Å
25	R	78.6	Confident	77.7	Confident	238 Å²	238	111 Å²	111	90%	0.898	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-95.8	124	173.2	-70.6	-177	173.6	176.8	-1.8	109.4	L23	L23-R25 PolarHBondContact O-N 3.36Å
26	T	75.2	Confident	77.9	Confident	137 Å²	137	108.3 Å²	108.3	84%	0.84	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-91.6	123.2	167.2	43.9	0	0	0	0	108.9
27	C	71.8	Confident	78.2	Confident	106 Å²	106	104 Å²	104	72%	0.716	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-84.5	133.1	163.6	-68.9	0	0	0	0	107.8
28	G	60.8	Low	78.6	Confident	54 Å²	54	102 Å²	102	56%	0.557	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-56.3	151.6	164.6	0	0	0	0	0	110.1	K30	G28-K30 PolarHBondContact O-N 2.83Å
29	P	65.3	Low	79.2	Confident	132 Å²	132	96.8 Å²	96.8	86%	0.857	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-57.1	116.7	-179.1	23.9	-32.8	0	0	0	109.7
30	K	50.3	Low	79.9	Confident	188 Å²	188	89.9 Å²	89.9	82%	0.817	50%	0.501	S	S	*	.			trans	-95	96.7	172.5	-68.7	-174.6	179.7	-177.9	0	107.7	G28 T32	G28-K30 PolarHBondContact O-N 2.83Å; K30-T32 PolarHBondContact O-N 2.74Å
31	L	54.4	Low	80.7	Confident	103 Å²	103	81.6 Å²	81.6	54%	0.539	47%	0.47	S	S	.	.			trans	-70.4	120.4	171.8	-73.3	167.3	0	0	0	108.5	N33 P35	L31-N33 PolarHBondContact O-N 3.07Å; L31-P35 HydrophobicContact CD1-CG 4.42Å
32	T	57.1	Low	81.3	Confident	135 Å²	135	77.5 Å²	77.5	83%	0.828	44%	0.443	S	S	*	.	S	Bend	trans	-72.9	-15.8	170.8	53.1	0	0	0	0	112.1	K30	K30-T32 PolarHBondContact O-N 2.74Å
33	N	76.1	Confident	82	Confident	115 Å²	115	72.2 Å²	72.2	62%	0.615	41%	0.405	S	S	*	.	S	Bend	trans	-114.9	117	-179.3	-62	-24.9	0	0	0	109.9	L31	L31-N33 PolarHBondContact O-N 3.07Å
34	S	90	Very high	82.6	Confident	56 Å²	56	66 Å²	66	39%	0.392	37%	0.373	S	S	.	.			trans	-55.9	133.3	172.8	-68.7	0	0	0	0	111.5	D145	S34-D145 VanDerWaalsContact CB-O 3.24Å; S34-D145 WeakPolarHBondContact CB-O 3.36Å; S34-D145 PolarHBondContact OG-O 2.88Å
35	P	96.3	Very high	83.2	Confident	18 Å²	18	62.4 Å²	62.4	12%	0.117	35%	0.35	C	S	.	.			trans	-56.8	157.7	171.8	-23.3	33	0	0	0	112.7	L31 L114 Q120 F146 K147	L31-P35 HydrophobicContact CD1-CG 4.42Å; P35-L114 HydrophobicContact CB-CB 4.05Å; P35-L114 HydrophobicContact CB-CD1 4.07Å; P35-L114 HydrophobicContact CB-CD2 3.99Å; P35-L114 HydrophobicContact CB-CG 4.25Å; P35-L114 HydrophobicContact CG-CB 4.41Å; P35-Q120 WeakPolarHBondContact CA-O 3.33Å; P35-Q120 WeakPolarHBondContact CB-O 3.45Å; P35-F146 HydrophobicContact CB-CD1 4.12Å; P35-F146 HydrophobicContact CB-CE1 4.48Å; P35-F146 HydrophobicContact CG-CD1 4.34Å; P35-F146 HydrophobicContact CG-CE1 4.44Å; P35-F146 WeakPolarHBondContact O-CA 3.46Å; P35-K147 PolarHBondContact O-N 3.36Å
36	T	98.3	Very high	83.8	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.2	-175.7	-58.8	0	0	0	0	112.1	I38 Q120 I121 A122 K147 F149	T36-I38 HydrophobicContact CG2-CG1 4.39Å; T36-Q120 PolarHBondContact N-O 3.41Å; T36-I121 WeakPolarHBondContact O-CA 3.37Å; T36-A122 PolarHBondContact O-N 3.05Å; T36-K147 HydrophobicContact CG2-CB 4.23Å; T36-F149 HydrophobicContact CG2-CB 4.12Å
37	V	98.8	Very high	84.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.8	165.8	-174.9	0	0	0	0	108.5	V39 V110 L114 A122 F124 F146 K147 A148 F149	V37-V39 HydrophobicContact CG1-CG2 4.03Å; V37-V110 HydrophobicContact CG2-CG1 3.92Å; V37-L114 HydrophobicContact CG2-CD1 3.9Å; V37-A122 CarbonylContact C-O 3.59Å; V37-A122 WeakPolarHBondContact CA-O 3.44Å; V37-F124 HydrophobicContact CG1-CB 4.2Å; V37-F146 HydrophobicContact CG2-CB 4.13Å; V37-F146 HydrophobicContact CG2-CD2 3.96Å; V37-F146 HydrophobicContact CG2-CG 4.36Å; V37-K147 PolarHBondContact N-O 2.71Å; V37-A148 WeakPolarHBondContact O-CA 3.36Å; V37-F149 PolarHBondContact O-N 2.67Å
38	I	98.9	Very high	85.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.5	169.6	-64.6	178.2	0	0	0	108.1	T36 M40 L55 I121 A122 V123 F124 F149 I151 I235	T36-I38 HydrophobicContact CG2-CG1 4.39Å; I38-M40 HydrophobicContact CG2-SD 4.17Å; I38-L55 HydrophobicContact CD1-CD2 3.82Å; I38-I121 HydrophobicContact CD1-CG2 3.52Å; I38-I121 HydrophobicContact CG1-CG2 3.83Å; I38-A122 PolarHBondContact N-O 3.4Å; I38-V123 HydrophobicContact CB-CG2 4.25Å; I38-V123 HydrophobicContact CD1-CG2 4.24Å; I38-V123 HydrophobicContact CG2-CG1 4.29Å; I38-F124 PolarHBondContact O-N 3.26Å; I38-F149 CarbonylContact C-O 3.47Å; I38-F149 VanDerWaalsContact CA-O 3.26Å; I38-F149 WeakPolarHBondContact CA-O 3.47Å; I38-I151 HydrophobicContact CG2-CD1 3.44Å; I38-I151 VanDerWaalsContact CG2-CD1 3.44Å; I38-I151 HydrophobicContact CG2-CG1 3.9Å; I38-I235 HydrophobicContact CD1-CD1 3.56Å; I38-I235 HydrophobicContact CD1-CG1 4.47Å; I38-I235 HydrophobicContact CG1-CD1 4.42Å
39	V	98.9	Very high	87.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	109.3	-176.8	-173.6	0	0	0	0	109.4	V37 V41 N128 I137 F149 F150 I151	V37-V39 HydrophobicContact CG1-CG2 4.03Å; V39-V41 HydrophobicContact CG1-CG2 4.47Å; V39-N128 HydrophobicContact CG1-CB 4.32Å; V39-I137 HydrophobicContact CG1-CD1 3.9Å; V39-I137 HydrophobicContact CG1-CG2 4.48Å; V39-I137 HydrophobicContact CG2-CG2 3.64Å; V39-F149 PolarHBondContact N-O 2.99Å; V39-F150 HydrophobicContact CB-CD1 3.61Å; V39-F150 HydrophobicContact CB-CE1 3.72Å; V39-F150 HydrophobicContact CB-CG 4.27Å; V39-F150 HydrophobicContact CB-CZ 4.45Å; V39-F150 HydrophobicContact CG1-CD1 3.8Å; V39-F150 HydrophobicContact CG1-CE1 3.71Å; V39-F150 HydrophobicContact CG2-CD1 4.35Å; V39-F150 HydrophobicContact CG2-CE1 4.05Å; V39-F150 HydrophobicContact CG2-CZ 4.34Å; V39-F150 WeakPolarHBondContact O-CA 3.39Å; V39-I151 PolarHBondContact O-N 3.29Å
40	M	98.8	Very high	88.4	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.3	175.5	-57	-54.7	-59.3	0	0	110.3	I38 K48 I51 S52 V123 F124 D125 N128 I151	I38-M40 HydrophobicContact CG2-SD 4.17Å; M40-K48 HydrophobicContact CB-CB 4.35Å; M40-K48 HydrophobicContact CB-CD 4.11Å; M40-K48 HydrophobicContact CB-CG 4.47Å; M40-K48 HydrophobicContact CE-CB 4.17Å; M40-K48 HydrophobicContact CE-CG 4.43Å; M40-I51 HydrophobicContact CE-CB 4.02Å; M40-I51 HydrophobicContact CE-CG2 3.88Å; M40-S52 VanDerWaalsContact CG-OG 3.29Å; M40-S52 WeakPolarHBondContact CG-OG 3.44Å; M40-V123 HydrophobicContact CG-CG1 4.07Å; M40-V123 HydrophobicContact SD-CG1 4.13Å; M40-F124 PolarHBondContact N-O 3.41Å; M40-F124 VanDerWaalsContact N-O 3.15Å; M40-D125 HydrophobicContact CG-CB 4.35Å; M40-N128 WeakPolarHBondContact O-CB 3.23Å; M40-N128 PolarHBondContact O-ND2 3.02Å; M40-I151 CarbonylContact C-O 3.56Å; M40-I151 WeakPolarHBondContact CA-O 3.32Å; M40-I151 HydrophobicContact CE-CB 3.98Å; M40-I151 HydrophobicContact CE-CG2 3.81Å; M40-I151 HydrophobicContact SD-CB 3.92Å; M40-I151 HydrophobicContact SD-CD1 4.22Å; M40-I151 HydrophobicContact SD-CG2 4.36Å
41	V	98.7	Very high	90.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.2	178.8	-175.3	0	0	0	0	110.1	V39 T127 N128 F150 I151 E152 S153 L201	V39-V41 HydrophobicContact CG1-CG2 4.47Å; V41-T127 CarbonylContact C-O 3.21Å; V41-T127 WeakPolarHBondContact CA-O 3.49Å; V41-N128 HydrophobicContact CG2-CB 4.25Å; V41-F150 HydrophobicContact CG2-CD1 3.9Å; V41-I151 PolarHBondContact N-O 3.15Å; V41-E152 HydrophobicContact CB-CB 3.89Å; V41-E152 HydrophobicContact CB-CG 3.92Å; V41-E152 HydrophobicContact CG1-CB 4.32Å; V41-E152 HydrophobicContact CG1-CG 3.87Å; V41-E152 WeakPolarHBondContact CG1-OE1 3.21Å; V41-E152 VanDerWaalsContact O-CA 3.31Å; V41-E152 WeakPolarHBondContact O-CA 3.41Å; V41-S153 PolarHBondContact O-N 3.17Å; V41-L201 HydrophobicContact CG2-CD1 4.41Å
42	G	97.3	Very high	92.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.139	C	C	.	.	S	Bend	trans	135.7	169	170.1	0	0	0	0	0	113.7	K48 T127	G42-K48 WeakPolarHBondContact O-CE 3.18Å; G42-K48 PolarHBondContact O-NZ 2.88Å; G42-T127 PolarHBondContact N-O 3.16Å; G42-T127 WeakPolarHBondContact O-CA 3.08Å
43	L	96.5	Very high	94.3	Very high	11 Å²	11	21.2 Å²	21.2	6%	0.058	12%	0.116	C	C	.	.			trans	-63.1	159.3	-178.8	-64.4	175.3	0	0	0	112.7	R46 K48 T129 E195 Y198	L43-R46 HydrophobicContact CB-CG 3.97Å; L43-R46 WeakPolarHBondContact O-CB 3.45Å; L43-R46 WeakPolarHBondContact O-CG 3.36Å; L43-K48 PolarHBondContact O-NZ 3.11Å; L43-T129 HydrophobicContact CD2-CG2 4.27Å; L43-E195 HydrophobicContact CD1-CG 3.83Å; L43-E195 HydrophobicContact CD2-CG 4.14Å; L43-Y198 HydrophobicContact CD1-CD1 4.08Å; L43-Y198 HydrophobicContact CD1-CE1 4.31Å; L43-Y198 HydrophobicContact CD2-CD1 3.93Å; L43-Y198 HydrophobicContact CD2-CG 4.02Å; L43-Y198 HydrophobicContact CG-CD1 3.85Å; L43-Y198 HydrophobicContact CG-CE1 4.04Å; L43-Y198 HydrophobicContact CG-CG 4.37Å
44	P	94.3	Very high	95.2	Very high	8 Å²	8	16.4 Å²	16.4	5%	0.052	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	155.6	170.9	-20.7	32.2	0	0	0	112.6	R46 T127 F187 I191 Y194	P44-R46 PolarHBondContact O-N 2.91Å; P44-R46 PolarHBondContact O-NH1 3.1Å; P44-T127 HydrophobicContact CG-CG2 4.18Å; P44-F187 HydrophobicContact CB-CE1 3.74Å; P44-F187 HydrophobicContact CB-CZ 3.78Å; P44-I191 HydrophobicContact CB-CG1 3.89Å; P44-I191 HydrophobicContact CG-CG1 4.24Å; P44-Y194 HydrophobicContact CG-CD2 3.65Å; P44-Y194 HydrophobicContact CG-CE2 3.99Å; P44-Y194 HydrophobicContact CG-CG 4.33Å
45	A	90.5	Very high	95.6	Very high	5 Å²	5	13.7 Å²	13.7	4%	0.041	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	25.1	-176.8	0	0	0	0	0	116.3	V161 N164 I165 F187 I191	A45-V161 HydrophobicContact CB-CG1 4.24Å; A45-N164 HydrophobicContact CB-CB 4.29Å; A45-N164 PolarHBondContact O-ND2 2.92Å; A45-I165 HydrophobicContact CB-CD1 4.29Å; A45-I165 HydrophobicContact CB-CG1 3.59Å; A45-F187 HydrophobicContact CB-CE1 3.69Å; A45-F187 HydrophobicContact CB-CZ 4.41Å; A45-I191 HydrophobicContact CB-CD1 4.34Å
46	R	92.1	Very high	95.6	Very high	22 Å²	22	13.4 Å²	13.4	8%	0.083	7%	0.069	C	C	.	.	S	Bend	trans	-100.7	25.1	173.9	-57.4	-58.4	-172.2	-98.8	17	114.2	L43 P44 K48 S153 C155 V161	L43-R46 HydrophobicContact CB-CG 3.97Å; L43-R46 WeakPolarHBondContact O-CB 3.45Å; L43-R46 WeakPolarHBondContact O-CG 3.36Å; P44-R46 PolarHBondContact O-N 2.91Å; P44-R46 PolarHBondContact O-NH1 3.1Å; R46-K48 VanDerWaalsContact C-N 3.29Å; R46-K48 PolarHBondContact O-N 3.33Å; R46-K48 VanDerWaalsContact O-N 3.17Å; R46-S153 WeakPolarHBondContact O-CB 3.27Å; R46-S153 PolarHBondContact O-OG 3.35Å; R46-C155 WeakPolarHBondContact CD-O 3.17Å; R46-C155 PolarHBondContact NE-O 2.72Å; R46-C155 PolarHBondContact NH2-O 2.83Å; R46-V161 VanDerWaalsContact NH1-CG1 3.31Å
47	G	89.8	Confident	95.6	Very high	24 Å²	24	14.4 Å²	14.4	25%	0.247	7%	0.072	C	C	.	.	S	Bend	trans	71	8.9	176.2	0	0	0	0	0	117	T49 Y50 I51	G47-T49 PolarHBondContact O-N 3.28Å; G47-Y50 WeakPolarHBondContact O-CB 3.43Å; G47-Y50 PolarHBondContact O-N 2.84Å; G47-Y50 VanDerWaalsContact O-N 3.11Å; G47-I51 WeakPolarHBondContact O-CG1 3.33Å; G47-I51 PolarHBondContact O-N 3.18Å
48	K	93.9	Very high	95.6	Very high	13 Å²	13	14.4 Å²	14.4	6%	0.057	7%	0.072	C	C	.	.	H	α-helix	trans	-53.8	-49.4	179.9	-64.3	-172	-58.7	-75.2	0	113.8	M40 G42 L43 R46 Y50 I51 S52 A126	M40-K48 HydrophobicContact CB-CB 4.35Å; M40-K48 HydrophobicContact CB-CD 4.11Å; M40-K48 HydrophobicContact CB-CG 4.47Å; M40-K48 HydrophobicContact CE-CB 4.17Å; M40-K48 HydrophobicContact CE-CG 4.43Å; G42-K48 WeakPolarHBondContact O-CE 3.18Å; G42-K48 PolarHBondContact O-NZ 2.88Å; L43-K48 PolarHBondContact O-NZ 3.11Å; R46-K48 VanDerWaalsContact C-N 3.29Å; R46-K48 PolarHBondContact O-N 3.33Å; R46-K48 VanDerWaalsContact O-N 3.17Å; K48-Y50 VanDerWaalsContact C-N 3.31Å; K48-Y50 PolarHBondContact O-N 2.79Å; K48-I51 PolarHBondContact O-N 3.4Å; K48-S52 WeakPolarHBondContact O-CB 3.36Å; K48-S52 PolarHBondContact O-N 2.94Å; K48-S52 PolarHBondContact O-OG 2.7Å; K48-A126 WeakPolarHBondContact CD-O 3.46Å; K48-A126 WeakPolarHBondContact CE-O 3.45Å
49	T	92.7	Very high	95.5	Very high	19 Å²	19	14.4 Å²	14.4	12%	0.117	7%	0.072	C	C	.	.	H	α-helix	trans	-66.8	-33.5	178.9	-51.7	0	0	0	0	112.1	G47 S52 K53 D125 Y425	G47-T49 PolarHBondContact O-N 3.28Å; T49-S52 PolarHBondContact O-N 3.49Å; T49-K53 HydrophobicContact CG2-CD 4.42Å; T49-K53 WeakPolarHBondContact O-CG 3.42Å; T49-K53 PolarHBondContact O-N 2.63Å; T49-D125 VanDerWaalsContact CA-OD2 3.29Å; T49-D125 WeakPolarHBondContact CA-OD2 3.16Å; T49-D125 VanDerWaalsContact CB-OD2 3.29Å; T49-D125 WeakPolarHBondContact CB-OD2 3.44Å; T49-D125 WeakPolarHBondContact CG2-OD2 3.44Å; T49-D125 PolarHBondContact OG1-OD2 2.87Å; T49-Y425 HydrophobicContact CG2-CD1 4.15Å; T49-Y425 HydrophobicContact CG2-CE1 3.55Å
50	Y	91.9	Very high	95.5	Very high	55 Å²	55	17.5 Å²	17.5	22%	0.216	9%	0.089	C	C	.	.	H	α-helix	trans	-60.8	-54.5	172.5	171	-87.8	0	0	0	110.3	G47 K48 S52 K53 K54 H243 V244 A424	G47-Y50 WeakPolarHBondContact O-CB 3.43Å; G47-Y50 PolarHBondContact O-N 2.84Å; G47-Y50 VanDerWaalsContact O-N 3.11Å; K48-Y50 VanDerWaalsContact C-N 3.31Å; K48-Y50 PolarHBondContact O-N 2.79Å; Y50-S52 VanDerWaalsContact C-N 3.31Å; Y50-S52 PolarHBondContact O-N 2.81Å; Y50-K53 PolarHBondContact O-N 3.26Å; Y50-K54 HydrophobicContact CE1-CD 3.83Å; Y50-K54 HydrophobicContact CE2-CD 4.5Å; Y50-K54 VanDerWaalsContact O-CB 3.28Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 PolarHBondContact O-N 2.98Å; Y50-K54 PolarHBondContact OH-NZ 3.49Å; Y50-H243 PolarHBondContact OH-O 2.74Å; Y50-V244 HydrophobicContact CE1-CG1 4Å; Y50-A424 VanDerWaalsContact CD2-O 3.31Å; Y50-A424 WeakPolarHBondContact CD2-O 3.47Å
51	I	94.9	Very high	95.5	Very high	11 Å²	11	18.1 Å²	18.1	6%	0.056	9%	0.091	C	C	.	.	H	α-helix	trans	-57.6	-46.4	177.8	-66.3	170.3	0	0	0	110.2	M40 G47 K48 K53 K54 L55 I151 L239	M40-I51 HydrophobicContact CE-CB 4.02Å; M40-I51 HydrophobicContact CE-CG2 3.88Å; G47-I51 WeakPolarHBondContact O-CG1 3.33Å; G47-I51 PolarHBondContact O-N 3.18Å; K48-I51 PolarHBondContact O-N 3.4Å; I51-K53 PolarHBondContact O-N 2.88Å; I51-K54 PolarHBondContact O-N 3.28Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 PolarHBondContact O-N 2.69Å; I51-I151 HydrophobicContact CG2-CG2 4.36Å; I51-L239 HydrophobicContact CG2-CD2 3.59Å
52	S	96.6	Very high	95.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.9	-49.6	-178.1	-59.1	0	0	0	0	112.3	M40 K48 T49 Y50 T56	M40-S52 VanDerWaalsContact CG-OG 3.29Å; M40-S52 WeakPolarHBondContact CG-OG 3.44Å; K48-S52 WeakPolarHBondContact O-CB 3.36Å; K48-S52 PolarHBondContact O-N 2.94Å; K48-S52 PolarHBondContact O-OG 2.7Å; T49-S52 PolarHBondContact O-N 3.49Å; Y50-S52 VanDerWaalsContact C-N 3.31Å; Y50-S52 PolarHBondContact O-N 2.81Å; S52-T56 VanDerWaalsContact O-CB 3.24Å; S52-T56 WeakPolarHBondContact O-CB 3.3Å; S52-T56 PolarHBondContact O-N 2.75Å; S52-T56 PolarHBondContact O-OG1 3.13Å
53	K	95.2	Very high	95.3	Very high	83 Å²	83	20.7 Å²	20.7	36%	0.361	12%	0.116	S	C	.	.	H	α-helix	trans	-69	-45.7	-179.7	-72.6	-172.8	175.5	-171	0	111.7	T49 Y50 I51 T56 R57 Y425	T49-K53 HydrophobicContact CG2-CD 4.42Å; T49-K53 WeakPolarHBondContact O-CG 3.42Å; T49-K53 PolarHBondContact O-N 2.63Å; Y50-K53 PolarHBondContact O-N 3.26Å; I51-K53 PolarHBondContact O-N 2.88Å; K53-T56 PolarHBondContact O-N 3.07Å; K53-R57 WeakPolarHBondContact O-CB 3.31Å; K53-R57 PolarHBondContact O-N 3.19Å; K53-Y425 HydrophobicContact CD-CD1 3.76Å; K53-Y425 HydrophobicContact CD-CG 3.92Å
54	K	95.4	Very high	95.3	Very high	14 Å²	14	21.2 Å²	21.2	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-43.2	-178	-154.7	-173.8	178.1	174.9	0	111.9	Y50 I51 R57 Y58 Y238 I242 E378	Y50-K54 HydrophobicContact CE1-CD 3.83Å; Y50-K54 HydrophobicContact CE2-CD 4.5Å; Y50-K54 VanDerWaalsContact O-CB 3.28Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 PolarHBondContact O-N 2.98Å; Y50-K54 PolarHBondContact OH-NZ 3.49Å; I51-K54 PolarHBondContact O-N 3.28Å; K54-R57 PolarHBondContact O-N 3.24Å; K54-Y58 PolarHBondContact O-N 3.02Å; K54-Y238 WeakPolarHBondContact CG-OH 3.32Å; K54-I242 HydrophobicContact CD-CD1 4.36Å; K54-I242 HydrophobicContact CD-CG2 4.15Å; K54-E378 WeakPolarHBondContact CE-OE1 3.41Å; K54-E378 WeakPolarHBondContact CE-OE2 3.49Å; K54-E378 IonicContact NZ-OE1 3.2Å; K54-E378 IonicContact NZ-OE2 2.73Å; K54-E378 PolarHBondContact NZ-OE2 3.4Å
55	L	97.1	Very high	95.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.1	-43.8	175	-177.2	63.9	0	0	0	111.6	I38 I51 R57 Y58 L59 I151 I235 Y238	I38-L55 HydrophobicContact CD1-CD2 3.82Å; I51-L55 WeakPolarHBondContact O-CB 3.33Å; I51-L55 PolarHBondContact O-N 2.69Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.09Å; L55-Y58 HydrophobicContact CD1-CD1 4.34Å; L55-Y58 PolarHBondContact O-N 3.46Å; L55-L59 HydrophobicContact CD1-CD1 4.1Å; L55-L59 HydrophobicContact CD1-CG 4.22Å; L55-L59 HydrophobicContact CD2-CD1 4.37Å; L55-L59 HydrophobicContact CG-CD1 3.76Å; L55-L59 HydrophobicContact CG-CG 4.32Å; L55-L59 WeakPolarHBondContact O-CB 3.43Å; L55-L59 VanDerWaalsContact O-CG 3.24Å; L55-L59 WeakPolarHBondContact O-CG 3.37Å; L55-L59 PolarHBondContact O-N 2.99Å; L55-I151 HydrophobicContact CD2-CD1 3.79Å; L55-I235 HydrophobicContact CD1-CB 4.39Å; L55-I235 HydrophobicContact CD1-CG1 4.1Å; L55-I235 HydrophobicContact CD1-CG2 3.99Å; L55-I235 HydrophobicContact CD2-CG1 4.39Å; L55-I235 HydrophobicContact CD2-CG2 3.76Å; L55-Y238 HydrophobicContact CD1-CD1 3.66Å; L55-Y238 HydrophobicContact CD1-CE1 4.26Å; L55-Y238 HydrophobicContact CD1-CG 4.41Å
56	T	98.2	Very high	95.9	Very high	12 Å²	12	23.1 Å²	23.1	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-43.2	176.6	-63.9	0	0	0	0	111.6	S52 K53 L59 N60 T66 V68	S52-T56 VanDerWaalsContact O-CB 3.24Å; S52-T56 WeakPolarHBondContact O-CB 3.3Å; S52-T56 PolarHBondContact O-N 2.75Å; S52-T56 PolarHBondContact O-OG1 3.13Å; K53-T56 PolarHBondContact O-N 3.07Å; T56-L59 PolarHBondContact O-N 3.24Å; T56-N60 WeakPolarHBondContact CG2-ND2 3.38Å; T56-N60 WeakPolarHBondContact O-CB 3.23Å; T56-N60 PolarHBondContact O-N 3.48Å; T56-N60 PolarHBondContact O-ND2 3.01Å; T56-T66 HydrophobicContact CG2-CG2 3.87Å; T56-T66 WeakPolarHBondContact CG2-O 3.28Å; T56-V68 HydrophobicContact CG2-CG2 4.15Å; T56-V68 WeakPolarHBondContact OG1-CG2 3.44Å
57	R	97.3	Very high	96.2	Very high	25 Å²	25	26.5 Å²	26.5	9%	0.094	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-47.4	176	-175.7	171.1	74.4	175.5	-2.2	111.9	K53 K54 L55 W61 Y398 F399 D401	K53-R57 WeakPolarHBondContact O-CB 3.31Å; K53-R57 PolarHBondContact O-N 3.19Å; K54-R57 PolarHBondContact O-N 3.24Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.09Å; R57-W61 VanDerWaalsContact O-CB 3.27Å; R57-W61 WeakPolarHBondContact O-CB 3.22Å; R57-W61 PolarHBondContact O-N 2.99Å; R57-Y398 WeakPolarHBondContact CD-O 3.41Å; R57-Y398 VanDerWaalsContact CG-O 3.31Å; R57-Y398 WeakPolarHBondContact CG-O 3.28Å; R57-Y398 PolarHBondContact NE-O 2.79Å; R57-F399 PolarHBondContact NH1-O 2.65Å; R57-D401 HydrophobicContact CG-CB 4.07Å; R57-D401 WeakPolarHBondContact CG-OD1 3.49Å
58	Y	97.9	Very high	96.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.3	-50.6	174.8	167.2	-114.1	0	0	0	112.2	K54 L55 N60 W61 I62 R234 Y238 E371 M375 Y398	K54-Y58 PolarHBondContact O-N 3.02Å; L55-Y58 HydrophobicContact CD1-CD1 4.34Å; L55-Y58 PolarHBondContact O-N 3.46Å; Y58-N60 PolarHBondContact O-N 3.16Å; Y58-W61 PolarHBondContact O-N 2.79Å; Y58-I62 HydrophobicContact CD2-CG2 3.99Å; Y58-I62 HydrophobicContact CE1-CD1 4.41Å; Y58-I62 HydrophobicContact CE2-CG2 3.61Å; Y58-I62 WeakPolarHBondContact O-CG1 3.35Å; Y58-I62 PolarHBondContact O-N 3.14Å; Y58-I62 VanDerWaalsContact O-N 3.08Å; Y58-R234 PolarHBondContact OH-NE 3.34Å; Y58-R234 PolarHBondContact OH-NH2 3.15Å; Y58-Y238 HydrophobicContact CD1-CD1 4.09Å; Y58-Y238 AromaticContact CD1-CD2 3.63Å; Y58-Y238 HydrophobicContact CD1-CD2 3.63Å; Y58-Y238 HydrophobicContact CD1-CE1 4.46Å; Y58-Y238 HydrophobicContact CD1-CE2 4.04Å; Y58-Y238 AromaticContact CD1-CG 3.64Å; Y58-Y238 HydrophobicContact CD1-CG 3.64Å; Y58-Y238 AromaticContact CD2-CD2 3.91Å; Y58-Y238 HydrophobicContact CD2-CD2 3.91Å; Y58-Y238 AromaticContact CD2-CE2 3.85Å; Y58-Y238 HydrophobicContact CD2-CE2 3.85Å; Y58-Y238 AromaticContact CE1-CD2 3.85Å; Y58-Y238 HydrophobicContact CE1-CD2 3.85Å; Y58-Y238 AromaticContact CE1-CG 3.87Å; Y58-Y238 HydrophobicContact CE1-CG 3.87Å; Y58-Y238 HydrophobicContact CE2-CD2 4.13Å; Y58-Y238 HydrophobicContact CE2-CE2 4.47Å; Y58-Y238 HydrophobicContact CG-CD1 4.48Å; Y58-Y238 AromaticContact CG-CD2 3.64Å; Y58-Y238 HydrophobicContact CG-CD2 3.64Å; Y58-Y238 HydrophobicContact CG-CE1 4.44Å; Y58-Y238 AromaticContact CG-CE2 3.59Å; Y58-Y238 HydrophobicContact CG-CE2 3.59Å; Y58-Y238 HydrophobicContact CG-CG 4.08Å; Y58-E371 HydrophobicContact CE2-CG 4.29Å; Y58-E371 PolarHBondContact OH-OE1 2.93Å; Y58-M375 HydrophobicContact CD2-CE 3.73Å; Y58-M375 HydrophobicContact CE2-CE 3.28Å; Y58-M375 HydrophobicContact CE2-SD 4.18Å; Y58-Y398 HydrophobicContact CD2-CE2 4.33Å
59	L	98.3	Very high	96.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-41.1	-178.2	-69.2	168.4	0	0	0	112.3	L55 T56 I62 G63 V64 T66 I121 I231 I235	L55-L59 HydrophobicContact CD1-CD1 4.1Å; L55-L59 HydrophobicContact CD1-CG 4.22Å; L55-L59 HydrophobicContact CD2-CD1 4.37Å; L55-L59 HydrophobicContact CG-CD1 3.76Å; L55-L59 HydrophobicContact CG-CG 4.32Å; L55-L59 WeakPolarHBondContact O-CB 3.43Å; L55-L59 VanDerWaalsContact O-CG 3.24Å; L55-L59 WeakPolarHBondContact O-CG 3.37Å; L55-L59 PolarHBondContact O-N 2.99Å; T56-L59 PolarHBondContact O-N 3.24Å; L59-I62 HydrophobicContact CD2-CD1 3.92Å; L59-I62 WeakPolarHBondContact O-CG1 3.21Å; L59-G63 PolarHBondContact O-N 3Å; L59-V64 CarbonylContact C-O 3.52Å; L59-V64 VanDerWaalsContact C-O 3.28Å; L59-V64 HydrophobicContact CB-CB 4.41Å; L59-V64 CarbonylContact O-C 3.54Å; L59-V64 WeakPolarHBondContact O-CA 3.33Å; L59-V64 WeakPolarHBondContact O-CB 3.19Å; L59-V64 PolarHBondContact O-N 3.38Å; L59-V64 VanDerWaalsContact O-O 3.05Å; L59-T66 HydrophobicContact CB-CG2 4.37Å; L59-T66 WeakPolarHBondContact CB-OG1 3.42Å; L59-T66 HydrophobicContact CD1-CG2 3.91Å; L59-I121 HydrophobicContact CD1-CD1 3.71Å; L59-I121 HydrophobicContact CD1-CG2 4.36Å; L59-I121 HydrophobicContact CD2-CD1 4.06Å; L59-I121 HydrophobicContact CG-CD1 4.4Å; L59-I231 HydrophobicContact CD2-CD1 3.76Å; L59-I235 HydrophobicContact CD2-CG1 4.35Å
60	N	98.1	Very high	97	Very high	65 Å²	65	26.8 Å²	26.8	35%	0.348	14%	0.143	S	C	.	.	H	α-helix	trans	-66.1	-41.5	174.3	-78.3	-43	0	0	0	111.9	T56 Y58 I62 G63 V64 T66	T56-N60 WeakPolarHBondContact CG2-ND2 3.38Å; T56-N60 WeakPolarHBondContact O-CB 3.23Å; T56-N60 PolarHBondContact O-N 3.48Å; T56-N60 PolarHBondContact O-ND2 3.01Å; Y58-N60 PolarHBondContact O-N 3.16Å; N60-I62 VanDerWaalsContact C-N 3.33Å; N60-I62 PolarHBondContact O-N 3.43Å; N60-G63 PolarHBondContact O-N 3.37Å; N60-V64 PolarHBondContact OD1-O 2.95Å; N60-T66 PolarHBondContact ND2-O 3.04Å; N60-T66 PolarHBondContact OD1-N 2.66Å; N60-T66 PolarHBondContact OD1-O 3.27Å
61	W	98.3	Very high	97.3	Very high	13 Å²	13	24.9 Å²	24.9	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-40.7	-179.1	-178.6	81.8	0	0	0	112.2	R57 Y58 G63 V367 L370 E371 I374 C394 Y398	R57-W61 VanDerWaalsContact O-CB 3.27Å; R57-W61 WeakPolarHBondContact O-CB 3.22Å; R57-W61 PolarHBondContact O-N 2.99Å; Y58-W61 PolarHBondContact O-N 2.79Å; W61-G63 PolarHBondContact O-N 2.83Å; W61-V367 HydrophobicContact CD2-CG1 4.14Å; W61-V367 HydrophobicContact CE3-CG1 4.12Å; W61-V367 HydrophobicContact CH2-CG1 4.18Å; W61-V367 VanDerWaalsContact CH2-O 3.22Å; W61-V367 WeakPolarHBondContact CH2-O 3.46Å; W61-V367 HydrophobicContact CZ2-CB 4.38Å; W61-V367 HydrophobicContact CZ2-CG1 4.23Å; W61-V367 HydrophobicContact CZ2-CG2 4.19Å; W61-V367 HydrophobicContact CZ3-CG1 4.12Å; W61-V367 WeakPolarHBondContact O-CG1 3.35Å; W61-L370 HydrophobicContact CH2-CB 3.89Å; W61-L370 HydrophobicContact CZ2-CB 4.2Å; W61-E371 HydrophobicContact CZ3-CB 4.18Å; W61-I374 HydrophobicContact CE3-CG1 4.43Å; W61-I374 HydrophobicContact CH2-CG1 3.53Å; W61-I374 HydrophobicContact CZ2-CG1 3.93Å; W61-I374 HydrophobicContact CZ3-CB 4.4Å; W61-I374 HydrophobicContact CZ3-CG1 3.81Å; W61-C394 PolarHBondContact NE1-O 3.05Å; W61-Y398 HydrophobicContact CB-CD2 4.04Å; W61-Y398 HydrophobicContact CD2-CD2 4.03Å; W61-Y398 HydrophobicContact CD2-CG 4.49Å; W61-Y398 HydrophobicContact CE3-CD2 4.32Å; W61-Y398 AromaticContact CG-CD2 3.9Å; W61-Y398 HydrophobicContact CG-CD2 3.9Å; W61-Y398 HydrophobicContact CG-CG 4.43Å
62	I	96.9	Very high	97.3	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.046	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.1	175.7	64.6	169.1	0	0	0	113.8	Y58 L59 N60 V64 Q368 E371	Y58-I62 HydrophobicContact CD2-CG2 3.99Å; Y58-I62 HydrophobicContact CE1-CD1 4.41Å; Y58-I62 HydrophobicContact CE2-CG2 3.61Å; Y58-I62 WeakPolarHBondContact O-CG1 3.35Å; Y58-I62 PolarHBondContact O-N 3.14Å; Y58-I62 VanDerWaalsContact O-N 3.08Å; L59-I62 HydrophobicContact CD2-CD1 3.92Å; L59-I62 WeakPolarHBondContact O-CG1 3.21Å; N60-I62 VanDerWaalsContact C-N 3.33Å; N60-I62 PolarHBondContact O-N 3.43Å; I62-V64 HydrophobicContact CD1-CB 4.31Å; I62-V64 HydrophobicContact CD1-CG2 3.75Å; I62-V64 HydrophobicContact CG1-CB 4.43Å; I62-V64 HydrophobicContact CG1-CG2 4.07Å; I62-Q368 PolarHBondContact O-NE2 2.72Å; I62-E371 HydrophobicContact CG2-CG 4.49Å
63	G	95.6	Very high	97.2	Very high	46 Å²	46	30 Å²	30	47%	0.474	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	19.4	178.7	0	0	0	0	0	116.2	L59 N60 W61 P65	L59-G63 PolarHBondContact O-N 3Å; N60-G63 PolarHBondContact O-N 3.37Å; W61-G63 PolarHBondContact O-N 2.83Å; G63-P65 WeakPolarHBondContact O-CD 3.37Å
64	V	96.8	Very high	97.3	Very high	22 Å²	22	28.8 Å²	28.8	13%	0.133	16%	0.159	C	C	.	.			trans	-103	104.9	174.6	-177.6	0	0	0	0	110.2	L59 N60 I62 T66 Q120 I121 I231	L59-V64 CarbonylContact C-O 3.52Å; L59-V64 VanDerWaalsContact C-O 3.28Å; L59-V64 HydrophobicContact CB-CB 4.41Å; L59-V64 CarbonylContact O-C 3.54Å; L59-V64 WeakPolarHBondContact O-CA 3.33Å; L59-V64 WeakPolarHBondContact O-CB 3.19Å; L59-V64 PolarHBondContact O-N 3.38Å; L59-V64 VanDerWaalsContact O-O 3.05Å; N60-V64 PolarHBondContact OD1-O 2.95Å; I62-V64 HydrophobicContact CD1-CB 4.31Å; I62-V64 HydrophobicContact CD1-CG2 3.75Å; I62-V64 HydrophobicContact CG1-CB 4.43Å; I62-V64 HydrophobicContact CG1-CG2 4.07Å; V64-T66 PolarHBondContact O-N 2.84Å; V64-T66 PolarHBondContact O-OG1 3.32Å; V64-Q120 HydrophobicContact CG1-CB 4.15Å; V64-I121 HydrophobicContact CG1-CD1 3.55Å; V64-I121 HydrophobicContact CG1-CG1 4.04Å; V64-I231 HydrophobicContact CG1-CD1 4.43Å; V64-I231 HydrophobicContact CG2-CD1 4.22Å
65	P	97.5	Very high	97.3	Very high	46 Å²	46	28.5 Å²	28.5	30%	0.299	16%	0.158	S	C	.	.			trans	-57.7	112.1	-176.6	-25.4	34.9	0	0	0	112.2	G63 Y113 Q120 I121	G63-P65 WeakPolarHBondContact O-CD 3.37Å; P65-Y113 PolarHBondContact O-OH 2.84Å; P65-Q120 HydrophobicContact CG-CG 4.49Å; P65-Q120 PolarHBondContact O-N 3.34Å; P65-I121 PolarHBondContact O-N 3.09Å; P65-I121 VanDerWaalsContact O-N 3.08Å
66	T	98.6	Very high	97.2	Very high	6 Å²	6	31.7 Å²	31.7	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.8	-173.6	-54.6	0	0	0	0	111.5	T56 L59 N60 V64 Y113 I121 V123	T56-T66 HydrophobicContact CG2-CG2 3.87Å; T56-T66 WeakPolarHBondContact CG2-O 3.28Å; L59-T66 HydrophobicContact CB-CG2 4.37Å; L59-T66 WeakPolarHBondContact CB-OG1 3.42Å; L59-T66 HydrophobicContact CD1-CG2 3.91Å; N60-T66 PolarHBondContact ND2-O 3.04Å; N60-T66 PolarHBondContact OD1-N 2.66Å; N60-T66 PolarHBondContact OD1-O 3.27Å; V64-T66 PolarHBondContact O-N 2.84Å; V64-T66 PolarHBondContact O-OG1 3.32Å; T66-Y113 WeakPolarHBondContact CA-OH 3.27Å; T66-Y113 PolarHBondContact N-OH 3.46Å; T66-I121 VanDerWaalsContact CA-O 3.29Å; T66-I121 WeakPolarHBondContact CA-O 3.43Å; T66-I121 HydrophobicContact CG2-CB 3.88Å; T66-I121 HydrophobicContact CG2-CG2 3.82Å; T66-V123 HydrophobicContact CG2-CG2 3.93Å
67	K	98.6	Very high	97	Very high	94 Å²	94	38.6 Å²	38.6	41%	0.409	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.8	177.4	-171.2	174.5	-179.8	-178.2	0	111.9	F69 Y113 I121 V123	K67-F69 HydrophobicContact CB-CE2 3.95Å; K67-F69 HydrophobicContact CB-CZ 4.32Å; K67-F69 HydrophobicContact CD-CE1 4.41Å; K67-F69 HydrophobicContact CD-CE2 4.31Å; K67-F69 HydrophobicContact CD-CZ 3.88Å; K67-F69 HydrophobicContact CG-CE2 4.08Å; K67-F69 HydrophobicContact CG-CZ 4.15Å; K67-Y113 HydrophobicContact CB-CD1 4.15Å; K67-Y113 HydrophobicContact CB-CD2 4.41Å; K67-Y113 HydrophobicContact CB-CE1 3.67Å; K67-Y113 HydrophobicContact CB-CE2 3.97Å; K67-Y113 HydrophobicContact CB-CG 4.5Å; K67-Y113 HydrophobicContact CD-CD2 4.02Å; K67-Y113 HydrophobicContact CD-CE2 4.11Å; K67-Y113 HydrophobicContact CD-CG 4.4Å; K67-I121 PolarHBondContact N-O 3.31Å; K67-I121 VanDerWaalsContact N-O 3.13Å; K67-V123 PolarHBondContact O-N 3.37Å
68	V	98.6	Very high	96.7	Very high	35 Å²	35	40.6 Å²	40.6	21%	0.212	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.6	173.4	-175.9	0	0	0	0	110.3	T56 N70 V123 D125	T56-V68 HydrophobicContact CG2-CG2 4.15Å; T56-V68 WeakPolarHBondContact OG1-CG2 3.44Å; V68-N70 HydrophobicContact CG1-CB 4.49Å; V68-V123 CarbonylContact C-O 3.51Å; V68-V123 WeakPolarHBondContact CA-O 3.4Å; V68-V123 HydrophobicContact CG2-CB 4.25Å; V68-D125 HydrophobicContact CG1-CB 3.97Å
69	F	98.6	Very high	96.3	Very high	6 Å²	6	43 Å²	43	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	91.9	172.3	-62.7	-94.6	0	0	0	108.2	K67 V71 D109 V110 Y113 A122 V123 F124 D125	K67-F69 HydrophobicContact CB-CE2 3.95Å; K67-F69 HydrophobicContact CB-CZ 4.32Å; K67-F69 HydrophobicContact CD-CE1 4.41Å; K67-F69 HydrophobicContact CD-CE2 4.31Å; K67-F69 HydrophobicContact CD-CZ 3.88Å; K67-F69 HydrophobicContact CG-CE2 4.08Å; K67-F69 HydrophobicContact CG-CZ 4.15Å; F69-V71 PolarHBondContact O-N 3.15Å; F69-D109 HydrophobicContact CD1-CB 4.01Å; F69-D109 HydrophobicContact CE1-CB 3.68Å; F69-V110 HydrophobicContact CB-CG2 4.11Å; F69-V110 HydrophobicContact CD1-CG2 3.94Å; F69-V110 HydrophobicContact CD2-CG2 3.55Å; F69-V110 HydrophobicContact CE1-CG2 4.25Å; F69-V110 HydrophobicContact CE2-CG2 3.89Å; F69-V110 HydrophobicContact CG-CG2 3.58Å; F69-V110 HydrophobicContact CZ-CG2 4.22Å; F69-Y113 HydrophobicContact CE2-CD1 4.02Å; F69-Y113 HydrophobicContact CE2-CG 4.38Å; F69-Y113 HydrophobicContact CZ-CD1 4.03Å; F69-Y113 AromaticContact CZ-CG 3.91Å; F69-Y113 HydrophobicContact CZ-CG 3.91Å; F69-A122 HydrophobicContact CD2-CB 4.02Å; F69-A122 HydrophobicContact CE2-CB 3.72Å; F69-V123 PolarHBondContact N-O 3.1Å; F69-F124 HydrophobicContact CB-CD2 4.46Å; F69-D125 PolarHBondContact O-N 2.87Å
70	N	97.6	Very high	95.5	Very high	21 Å²	21	52 Å²	52	11%	0.112	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	107.1	-177	-175.3	-65	0	0	0	110.6	V68 G72 E73 Y74 D125	V68-N70 HydrophobicContact CG1-CB 4.49Å; N70-G72 PolarHBondContact O-N 2.94Å; N70-G72 WeakPolarHBondContact OD1-CA 3.45Å; N70-G72 PolarHBondContact OD1-N 3.49Å; N70-E73 HydrophobicContact CB-CG 4.1Å; N70-E73 WeakPolarHBondContact O-CB 3.37Å; N70-E73 PolarHBondContact O-N 3.46Å; N70-E73 PolarHBondContact OD1-N 3.21Å; N70-Y74 WeakPolarHBondContact O-CD2 3.42Å; N70-D125 HydrophobicContact CB-CB 4.44Å; N70-D125 PolarHBondContact ND2-OD2 2.82Å
71	V	97.4	Very high	94.7	Very high	15 Å²	15	53 Å²	53	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-22.1	-177.1	-178.9	0	0	0	0	112.4	F69 E73 R75 C102 A103 A106 F124 D125 A126	F69-V71 PolarHBondContact O-N 3.15Å; V71-E73 VanDerWaalsContact C-N 3.33Å; V71-R75 WeakPolarHBondContact O-CB 3.44Å; V71-R75 PolarHBondContact O-N 3.4Å; V71-C102 HydrophobicContact CG1-CB 4.09Å; V71-A103 HydrophobicContact CG1-CB 4.31Å; V71-A106 HydrophobicContact CG2-CB 4.12Å; V71-F124 HydrophobicContact CG2-CE1 4.11Å; V71-F124 HydrophobicContact CG2-CE2 3.78Å; V71-F124 HydrophobicContact CG2-CZ 3.54Å; V71-D125 PolarHBondContact N-O 3.46Å; V71-A126 HydrophobicContact CB-CB 3.94Å; V71-A126 HydrophobicContact CG2-CB 3.75Å
72	G	94.3	Very high	94.2	Very high	17 Å²	17	53.2 Å²	53.2	18%	0.175	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-32.3	172.3	0	0	0	0	0	113.7	N70 R76	N70-G72 PolarHBondContact O-N 2.94Å; N70-G72 WeakPolarHBondContact OD1-CA 3.45Å; N70-G72 PolarHBondContact OD1-N 3.49Å; G72-R76 WeakPolarHBondContact O-CG 3.3Å; G72-R76 PolarHBondContact O-N 3.35Å
73	E	94.8	Very high	93.6	Very high	101 Å²	101	57.5 Å²	57.5	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-69	-48.7	174.2	-68.9	170.7	-180	0	0	110.8	N70 V71 R75 R76 E77	N70-E73 HydrophobicContact CB-CG 4.1Å; N70-E73 WeakPolarHBondContact O-CB 3.37Å; N70-E73 PolarHBondContact O-N 3.46Å; N70-E73 PolarHBondContact OD1-N 3.21Å; V71-E73 VanDerWaalsContact C-N 3.33Å; E73-R75 PolarHBondContact O-N 3.37Å; E73-R76 PolarHBondContact O-N 2.84Å; E73-E77 PolarHBondContact O-N 3.22Å
74	Y	97.1	Very high	93.4	Very high	57 Å²	57	56.6 Å²	56.6	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-55.5	-40.3	173.7	-70.6	-96.3	0	0	0	112.2	N70 A78 A105 A106 D109	N70-Y74 WeakPolarHBondContact O-CD2 3.42Å; Y74-A78 WeakPolarHBondContact O-CB 3.48Å; Y74-A78 PolarHBondContact O-N 3.42Å; Y74-A105 HydrophobicContact CD1-CB 4.09Å; Y74-A105 HydrophobicContact CE1-CB 4.45Å; Y74-A106 HydrophobicContact CD1-CB 4.38Å; Y74-A106 HydrophobicContact CD2-CB 3.87Å; Y74-A106 HydrophobicContact CE1-CB 4.21Å; Y74-A106 HydrophobicContact CE2-CB 3.69Å; Y74-A106 HydrophobicContact CG-CB 4.22Å; Y74-D109 WeakPolarHBondContact CE1-OD2 3.01Å; Y74-D109 VanDerWaalsContact CZ-OD2 3.3Å; Y74-D109 WeakPolarHBondContact OH-CB 3.5Å; Y74-D109 PolarHBondContact OH-OD2 3.41Å
75	R	96.1	Very high	93.3	Very high	9 Å²	9	58.5 Å²	58.5	3%	0.034	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-44	176	-176.7	-85.1	-62.6	179.2	-4.5	112.1	V71 E73 E77 A78 V79 F87 D174	V71-R75 WeakPolarHBondContact O-CB 3.44Å; V71-R75 PolarHBondContact O-N 3.4Å; E73-R75 PolarHBondContact O-N 3.37Å; R75-E77 VanDerWaalsContact C-N 3.3Å; R75-E77 PolarHBondContact O-N 2.91Å; R75-A78 PolarHBondContact O-N 2.9Å; R75-V79 HydrophobicContact CG-CG2 4.31Å; R75-V79 WeakPolarHBondContact O-CB 3.35Å; R75-V79 WeakPolarHBondContact O-CG2 3.41Å; R75-V79 PolarHBondContact O-N 3.09Å; R75-F87 HydrophobicContact CG-CE1 3.85Å; R75-F87 HydrophobicContact CG-CZ 4.02Å; R75-D174 IonicContact CZ-OD1 3.97Å; R75-D174 IonicContact CZ-OD2 3.5Å; R75-D174 IonicContact NH1-OD1 3.32Å; R75-D174 PolarHBondContact NH1-OD1 3.16Å; R75-D174 IonicContact NH1-OD2 3.38Å; R75-D174 IonicContact NH2-OD1 2.82Å; R75-D174 PolarHBondContact NH2-OD1 2.74Å; R75-D174 IonicContact NH2-OD2 3.4Å; R75-D174 PolarHBondContact NH2-OD2 2.91Å
76	R	93.9	Very high	93.1	Very high	66 Å²	66	59.4 Å²	59.4	25%	0.249	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-40.1	179.4	-79.4	-173.5	-66.3	-88.5	-1.4	111.3	G72 E73 K80 D174	G72-R76 WeakPolarHBondContact O-CG 3.3Å; G72-R76 PolarHBondContact O-N 3.35Å; E73-R76 PolarHBondContact O-N 2.84Å; R76-K80 WeakPolarHBondContact O-CA 3.27Å; R76-K80 PolarHBondContact O-N 3.34Å; R76-D174 WeakPolarHBondContact CD-OD1 3.49Å; R76-D174 WeakPolarHBondContact CG-OD1 3.41Å; R76-D174 IonicContact NH1-OD2 3.16Å
77	E	93.9	Very high	92.9	Very high	158 Å²	158	60.5 Å²	60.5	74%	0.738	31%	0.309	S	S	*	.	H	α-helix	trans	-62.6	-44.5	174.6	-168.7	59.7	-148	0	0	111.8	E73 R75	E73-E77 PolarHBondContact O-N 3.22Å; R75-E77 VanDerWaalsContact C-N 3.3Å; R75-E77 PolarHBondContact O-N 2.91Å
78	A	92.4	Very high	92.7	Very high	66 Å²	66	56.3 Å²	56.3	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-35.4	-177.1	0	0	0	0	0	114.4	Y74 R75	Y74-A78 WeakPolarHBondContact O-CB 3.48Å; Y74-A78 PolarHBondContact O-N 3.42Å; R75-A78 PolarHBondContact O-N 2.9Å
79	V	89.3	Confident	92.4	Very high	50 Å²	50	59.1 Å²	59.1	30%	0.303	30%	0.298	S	S	.	.	H	α-helix	trans	-101.5	-13	-172.5	-175.9	0	0	0	0	112.5	R75 Q81 F87 V98	R75-V79 HydrophobicContact CG-CG2 4.31Å; R75-V79 WeakPolarHBondContact O-CB 3.35Å; R75-V79 WeakPolarHBondContact O-CG2 3.41Å; R75-V79 PolarHBondContact O-N 3.09Å; V79-Q81 PolarHBondContact O-N 2.97Å; V79-F87 HydrophobicContact CG1-CE2 4.32Å; V79-F87 HydrophobicContact CG2-CE2 3.94Å; V79-F87 HydrophobicContact CG2-CZ 3.93Å; V79-V98 HydrophobicContact CG2-CG1 3.79Å
80	K	80.6	Confident	92	Very high	189 Å²	189	62.4 Å²	62.4	82%	0.822	32%	0.319	S	S	*	.			trans	61.6	-61.7	-176.8	-59	-175.8	178.5	-177.7	0	114.9	R76	R76-K80 WeakPolarHBondContact O-CA 3.27Å; R76-K80 PolarHBondContact O-N 3.34Å
81	Q	81.2	Confident	91.8	Very high	87 Å²	87	66 Å²	66	41%	0.407	34%	0.339	S	S	.	.	S	Bend	trans	-119.5	127.5	-176.5	-171.4	68.8	20.4	0	0	111.1	V79 D177	V79-Q81 PolarHBondContact O-N 2.97Å; Q81-D177 PolarHBondContact NE2-OD2 3.43Å
82	Y	87.6	Confident	91.6	Very high	17 Å²	17	67.7 Å²	67.7	7%	0.067	35%	0.347	C	S	.	.			trans	-81.9	137.1	169.9	-179.5	-107.7	0	0	0	109.9	S84 Y85 F88 D174 Y175 D186	Y82-S84 VanDerWaalsContact CE2-O 3.28Å; Y82-S84 WeakPolarHBondContact CE2-O 3.22Å; Y82-S84 PolarHBondContact OH-O 2.79Å; Y82-Y85 WeakPolarHBondContact OH-CA 3.4Å; Y82-Y85 PolarHBondContact OH-N 3.36Å; Y82-F88 HydrophobicContact CD2-CE2 4.25Å; Y82-F88 HydrophobicContact CE2-CD2 4.05Å; Y82-F88 AromaticContact CE2-CE2 3.35Å; Y82-F88 HydrophobicContact CE2-CE2 3.35Å; Y82-F88 HydrophobicContact CE2-CZ 4.21Å; Y82-F88 AromaticContact CZ-CE2 3.92Å; Y82-D174 HydrophobicContact CD1-CB 3.95Å; Y82-D174 VanDerWaalsContact CD1-O 3.26Å; Y82-D174 WeakPolarHBondContact CD1-O 3.49Å; Y82-D174 HydrophobicContact CG-CB 4.07Å; Y82-Y175 HydrophobicContact CD1-CE1 4.48Å; Y82-Y175 HydrophobicContact CE1-CD1 4.48Å; Y82-Y175 AromaticContact CE1-CE1 3.77Å; Y82-Y175 HydrophobicContact CE1-CE1 3.77Å; Y82-Y175 AromaticContact CE1-CZ 3.87Å; Y82-D186 WeakPolarHBondContact CE1-OD2 3.13Å; Y82-D186 PolarHBondContact OH-OD2 2.79Å
83	S	84.4	Confident	91.6	Very high	100 Å²	100	74.1 Å²	74.1	70%	0.699	37%	0.373	S	S	*	.			trans	-107.4	-60.9	176.4	56.5	0	0	0	0	111.8
84	S	92.9	Very high	91.5	Very high	27 Å²	27	75.7 Å²	75.7	19%	0.189	38%	0.38	C	S	.	.			trans	-160.8	173.8	-177.3	63.4	0	0	0	0	112.8	Y82 N86 F87 D186	Y82-S84 VanDerWaalsContact CE2-O 3.28Å; Y82-S84 WeakPolarHBondContact CE2-O 3.22Å; Y82-S84 PolarHBondContact OH-O 2.79Å; S84-N86 PolarHBondContact O-N 2.97Å; S84-N86 PolarHBondContact OG-ND2 3.13Å; S84-N86 VanDerWaalsContact OG-ND2 3.15Å; S84-F87 PolarHBondContact O-N 3.23Å; S84-D186 VanDerWaalsContact CA-OD1 3.26Å; S84-D186 WeakPolarHBondContact CA-OD1 3.41Å
85	Y	93.8	Very high	91.4	Very high	61 Å²	61	73.1 Å²	73.1	24%	0.239	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-56.9	-17.3	177.3	77.6	-84.3	0	0	0	113.6	Y82 F87 F88 D186 K189	Y82-Y85 WeakPolarHBondContact OH-CA 3.4Å; Y82-Y85 PolarHBondContact OH-N 3.36Å; Y85-F87 PolarHBondContact O-N 3.14Å; Y85-F87 VanDerWaalsContact O-N 3.14Å; Y85-F88 WeakPolarHBondContact O-CA 3.45Å; Y85-F88 WeakPolarHBondContact O-CB 3.3Å; Y85-F88 PolarHBondContact O-N 3.24Å; Y85-D186 WeakPolarHBondContact CD1-OD1 3.44Å; Y85-D186 PolarHBondContact N-OD1 2.83Å; Y85-K189 HydrophobicContact CD1-CB 3.74Å; Y85-K189 HydrophobicContact CD1-CD 3.86Å; Y85-K189 HydrophobicContact CD1-CG 4.44Å; Y85-K189 HydrophobicContact CD2-CB 3.67Å; Y85-K189 HydrophobicContact CE1-CB 4.06Å; Y85-K189 HydrophobicContact CE1-CD 3.5Å; Y85-K189 HydrophobicContact CE1-CG 4.36Å; Y85-K189 HydrophobicContact CE2-CB 3.97Å; Y85-K189 HydrophobicContact CE2-CD 4.49Å; Y85-K189 HydrophobicContact CG-CB 3.54Å
86	N	94	Very high	91.1	Very high	65 Å²	65	76.7 Å²	76.7	35%	0.348	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-55.2	-29.1	174.9	-73.3	-48.3	0	0	0	113	S84 F88 R89 N92	S84-N86 PolarHBondContact O-N 2.97Å; S84-N86 PolarHBondContact OG-ND2 3.13Å; S84-N86 VanDerWaalsContact OG-ND2 3.15Å; N86-F88 PolarHBondContact O-N 3.34Å; N86-R89 PolarHBondContact O-N 3.48Å; N86-R89 WeakPolarHBondContact OD1-CD 3.38Å; N86-N92 PolarHBondContact O-ND2 2.96Å; N86-N92 VanDerWaalsContact O-ND2 3.1Å
87	F	94.2	Very high	91.2	Very high	29 Å²	29	80.2 Å²	80.2	13%	0.127	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-62.8	-26.6	172.6	-177.6	-94	0	0	0	112.7	R75 V79 S84 Y85 A95 V98 R99	R75-F87 HydrophobicContact CG-CE1 3.85Å; R75-F87 HydrophobicContact CG-CZ 4.02Å; V79-F87 HydrophobicContact CG1-CE2 4.32Å; V79-F87 HydrophobicContact CG2-CE2 3.94Å; V79-F87 HydrophobicContact CG2-CZ 3.93Å; S84-F87 PolarHBondContact O-N 3.23Å; Y85-F87 PolarHBondContact O-N 3.14Å; Y85-F87 VanDerWaalsContact O-N 3.14Å; F87-A95 HydrophobicContact CD1-CB 4.43Å; F87-A95 HydrophobicContact CD2-CB 3.59Å; F87-A95 HydrophobicContact CE1-CB 4.45Å; F87-A95 HydrophobicContact CE2-CB 3.62Å; F87-A95 HydrophobicContact CG-CB 4.01Å; F87-A95 HydrophobicContact CZ-CB 4.06Å; F87-A95 WeakPolarHBondContact O-CB 3.48Å; F87-V98 HydrophobicContact CZ-CB 4.5Å; F87-V98 HydrophobicContact CZ-CG1 4.22Å; F87-R99 HydrophobicContact CE1-CG 3.73Å; F87-R99 HydrophobicContact CZ-CG 4.12Å
88	F	94.6	Very high	91.2	Very high	6 Å²	6	74.2 Å²	74.2	3%	0.026	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-95.5	-6.3	-175.8	-64.6	-66.3	0	0	0	114.5	Y82 Y85 N86 R99 R190 C193 Y194	Y82-F88 HydrophobicContact CD2-CE2 4.25Å; Y82-F88 HydrophobicContact CE2-CD2 4.05Å; Y82-F88 AromaticContact CE2-CE2 3.35Å; Y82-F88 HydrophobicContact CE2-CE2 3.35Å; Y82-F88 HydrophobicContact CE2-CZ 4.21Å; Y82-F88 AromaticContact CZ-CE2 3.92Å; Y85-F88 WeakPolarHBondContact O-CA 3.45Å; Y85-F88 WeakPolarHBondContact O-CB 3.3Å; Y85-F88 PolarHBondContact O-N 3.24Å; N86-F88 PolarHBondContact O-N 3.34Å; F88-R99 PolarHBondContact O-NH1 2.83Å; F88-R99 VanDerWaalsContact O-NH1 3.13Å; F88-R99 PolarHBondContact O-NH2 3.08Å; F88-R190 HydrophobicContact CB-CG 4.25Å; F88-R190 HydrophobicContact CD2-CB 4.35Å; F88-R190 VanDerWaalsContact CD2-CD 3.47Å; F88-R190 HydrophobicContact CD2-CG 3.53Å; F88-R190 VanDerWaalsContact CE2-CD 3.46Å; F88-R190 HydrophobicContact CE2-CG 4.08Å; F88-R190 HydrophobicContact CG-CG 3.97Å; F88-C193 HydrophobicContact CB-CB 4.34Å; F88-Y194 HydrophobicContact CB-CE2 4.09Å; F88-Y194 HydrophobicContact CD1-CE2 4.08Å; F88-Y194 AromaticContact CD1-CZ 3.93Å; F88-Y194 WeakPolarHBondContact CD1-OH 3.46Å; F88-Y194 HydrophobicContact CG-CE2 4.19Å
89	R	92.7	Very high	91.4	Very high	95 Å²	95	72.4 Å²	72.4	36%	0.358	36%	0.355	S	S	.	.			trans	-57.9	144.8	179.6	-64	170.5	59.1	130.8	-0.2	111.5	N86 D91 N92 R99	N86-R89 PolarHBondContact O-N 3.48Å; N86-R89 WeakPolarHBondContact OD1-CD 3.38Å; R89-D91 VanDerWaalsContact C-N 3.3Å; R89-D91 WeakPolarHBondContact CB-OD1 3.47Å; R89-D91 IonicContact CZ-OD1 3.67Å; R89-D91 IonicContact CZ-OD2 2.72Å; R89-D91 IonicContact NE-OD1 2.63Å; R89-D91 PolarHBondContact NE-OD1 3.29Å; R89-D91 IonicContact NE-OD2 3.74Å; R89-D91 PolarHBondContact NE-OD2 3.34Å; R89-D91 IonicContact NH2-OD1 2.92Å; R89-D91 IonicContact NH2-OD2 3.48Å; R89-D91 PolarHBondContact NH2-OD2 3.22Å; R89-D91 PolarHBondContact O-N 3.37Å; R89-N92 HydrophobicContact CB-CB 4.37Å; R89-N92 PolarHBondContact O-N 3.3Å; R89-R99 PolarHBondContact O-NH2 3.32Å; R89-R99 VanDerWaalsContact O-NH2 3.17Å
90	P	90.1	Very high	91.7	Very high	74 Å²	74	74.4 Å²	74.4	48%	0.481	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.9	-179.4	27.7	-34.3	0	0	0	113.1	N92	P90-N92 VanDerWaalsContact C-N 3.31Å
91	D	92.1	Very high	92.5	Very high	98 Å²	98	71 Å²	71	52%	0.524	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-5.9	177.6	61.8	-14.7	0	0	0	113.6	R89 E93	R89-D91 VanDerWaalsContact C-N 3.3Å; R89-D91 WeakPolarHBondContact CB-OD1 3.47Å; R89-D91 IonicContact CZ-OD1 3.67Å; R89-D91 IonicContact CZ-OD2 2.72Å; R89-D91 IonicContact NE-OD1 2.63Å; R89-D91 PolarHBondContact NE-OD1 3.29Å; R89-D91 IonicContact NE-OD2 3.74Å; R89-D91 PolarHBondContact NE-OD2 3.34Å; R89-D91 IonicContact NH2-OD1 2.92Å; R89-D91 IonicContact NH2-OD2 3.48Å; R89-D91 PolarHBondContact NH2-OD2 3.22Å; R89-D91 PolarHBondContact O-N 3.37Å; D91-E93 PolarHBondContact O-N 2.69Å; D91-E93 VanDerWaalsContact O-N 3.13Å
92	N	94.3	Very high	93.3	Very high	50 Å²	50	67.2 Å²	67.2	27%	0.267	33%	0.33	S	S	.	.			trans	-83.5	86.5	175.7	-170.7	-25.1	0	0	0	110.7	N86 R89 P90 E94 A95 M96	N86-N92 PolarHBondContact O-ND2 2.96Å; N86-N92 VanDerWaalsContact O-ND2 3.1Å; R89-N92 HydrophobicContact CB-CB 4.37Å; R89-N92 PolarHBondContact O-N 3.3Å; P90-N92 VanDerWaalsContact C-N 3.31Å; N92-E94 VanDerWaalsContact C-N 3.33Å; N92-E94 PolarHBondContact O-N 3.17Å; N92-A95 HydrophobicContact CB-CB 4.11Å; N92-A95 VanDerWaalsContact CG-CB 3.41Å; N92-A95 PolarHBondContact O-N 3.43Å; N92-A95 WeakPolarHBondContact OD1-CB 3.44Å; N92-A95 PolarHBondContact OD1-N 3.3Å; N92-M96 WeakPolarHBondContact O-CB 3.46Å; N92-M96 VanDerWaalsContact O-CG 3.3Å; N92-M96 WeakPolarHBondContact O-CG 3.36Å; N92-M96 PolarHBondContact O-N 3.18Å
93	E	93.9	Very high	93.8	Very high	152 Å²	152	66.4 Å²	66.4	71%	0.71	33%	0.327	S	S	*	.	H	α-helix	trans	-58.7	-40.4	-176.8	-66.9	-170.7	173.7	0	0	113.5	D91 M96 R97	D91-E93 PolarHBondContact O-N 2.69Å; D91-E93 VanDerWaalsContact O-N 3.13Å; E93-M96 PolarHBondContact O-N 3.37Å; E93-R97 WeakPolarHBondContact O-CB 3.45Å; E93-R97 PolarHBondContact O-N 3.32Å
94	E	93.6	Very high	94.4	Very high	134 Å²	134	65.3 Å²	65.3	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-64.9	-49.4	179.1	-176.9	171.2	-168.9	0	0	110.9	N92 M96 R97 V98	N92-E94 VanDerWaalsContact C-N 3.33Å; N92-E94 PolarHBondContact O-N 3.17Å; E94-M96 VanDerWaalsContact C-N 3.3Å; E94-M96 PolarHBondContact O-N 3.26Å; E94-R97 WeakPolarHBondContact O-CB 3.44Å; E94-R97 PolarHBondContact O-N 3.01Å; E94-R97 VanDerWaalsContact O-N 3.12Å; E94-V98 WeakPolarHBondContact O-CG2 3.48Å; E94-V98 PolarHBondContact O-N 2.72Å
95	A	93	Very high	94.7	Very high	3 Å²	3	64.9 Å²	64.9	3%	0.025	31%	0.311	C	S	.	.	H	α-helix	trans	-67.1	-31.9	178	0	0	0	0	0	112.5	F87 N92 R99	F87-A95 HydrophobicContact CD1-CB 4.43Å; F87-A95 HydrophobicContact CD2-CB 3.59Å; F87-A95 HydrophobicContact CE1-CB 4.45Å; F87-A95 HydrophobicContact CE2-CB 3.62Å; F87-A95 HydrophobicContact CG-CB 4.01Å; F87-A95 HydrophobicContact CZ-CB 4.06Å; F87-A95 WeakPolarHBondContact O-CB 3.48Å; N92-A95 HydrophobicContact CB-CB 4.11Å; N92-A95 VanDerWaalsContact CG-CB 3.41Å; N92-A95 PolarHBondContact O-N 3.43Å; N92-A95 WeakPolarHBondContact OD1-CB 3.44Å; N92-A95 PolarHBondContact OD1-N 3.3Å; A95-R99 WeakPolarHBondContact O-CB 3.16Å; A95-R99 VanDerWaalsContact O-CG 3.25Å; A95-R99 WeakPolarHBondContact O-CG 3.31Å; A95-R99 PolarHBondContact O-N 3.27Å; A95-R99 PolarHBondContact O-NE 3.08Å
96	M	91.4	Very high	94.9	Very high	83 Å²	83	62 Å²	62	41%	0.409	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-44.1	170.2	-78.8	-69.1	-80.5	0	0	111.6	N92 E93 E94 R99 K100	N92-M96 WeakPolarHBondContact O-CB 3.46Å; N92-M96 VanDerWaalsContact O-CG 3.3Å; N92-M96 WeakPolarHBondContact O-CG 3.36Å; N92-M96 PolarHBondContact O-N 3.18Å; E93-M96 PolarHBondContact O-N 3.37Å; E94-M96 VanDerWaalsContact C-N 3.3Å; E94-M96 PolarHBondContact O-N 3.26Å; M96-R99 PolarHBondContact O-N 3.04Å; M96-R99 PolarHBondContact SD-NH2 2.9Å; M96-K100 WeakPolarHBondContact O-CB 3.46Å; M96-K100 PolarHBondContact O-N 3.17Å
97	R	94.5	Very high	95.1	Very high	140 Å²	140	59.1 Å²	59.1	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-47.7	176.1	-165.8	-173.2	-54.8	124.7	3.9	111.5	E93 E94 K100 Q101	E93-R97 WeakPolarHBondContact O-CB 3.45Å; E93-R97 PolarHBondContact O-N 3.32Å; E94-R97 WeakPolarHBondContact O-CB 3.44Å; E94-R97 PolarHBondContact O-N 3.01Å; E94-R97 VanDerWaalsContact O-N 3.12Å; R97-K100 PolarHBondContact O-N 3.25Å; R97-Q101 WeakPolarHBondContact O-CG 3.48Å; R97-Q101 PolarHBondContact O-N 3.32Å
98	V	95.6	Very high	95.3	Very high	33 Å²	33	66.1 Å²	66.1	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-47.1	177.3	174	0	0	0	0	111.2	V79 F87 E94 K100 Q101 C102	V79-V98 HydrophobicContact CG2-CG1 3.79Å; F87-V98 HydrophobicContact CZ-CB 4.5Å; F87-V98 HydrophobicContact CZ-CG1 4.22Å; E94-V98 WeakPolarHBondContact O-CG2 3.48Å; E94-V98 PolarHBondContact O-N 2.72Å; V98-K100 VanDerWaalsContact C-N 3.3Å; V98-K100 PolarHBondContact O-N 3.06Å; V98-Q101 PolarHBondContact O-N 3.01Å; V98-C102 PolarHBondContact O-N 3.35Å; V98-C102 PolarHBondContact O-SG 3.15Å
99	R	95	Very high	95.5	Very high	27 Å²	27	69.2 Å²	69.2	10%	0.102	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-37.2	176.9	-75.3	-176.8	-70.1	177.1	-11.6	112.4	F87 F88 R89 A95 M96 A103 Y194	F87-R99 HydrophobicContact CE1-CG 3.73Å; F87-R99 HydrophobicContact CZ-CG 4.12Å; F88-R99 PolarHBondContact O-NH1 2.83Å; F88-R99 VanDerWaalsContact O-NH1 3.13Å; F88-R99 PolarHBondContact O-NH2 3.08Å; R89-R99 PolarHBondContact O-NH2 3.32Å; R89-R99 VanDerWaalsContact O-NH2 3.17Å; A95-R99 WeakPolarHBondContact O-CB 3.16Å; A95-R99 VanDerWaalsContact O-CG 3.25Å; A95-R99 WeakPolarHBondContact O-CG 3.31Å; A95-R99 PolarHBondContact O-N 3.27Å; A95-R99 PolarHBondContact O-NE 3.08Å; M96-R99 PolarHBondContact O-N 3.04Å; M96-R99 PolarHBondContact SD-NH2 2.9Å; R99-A103 PolarHBondContact O-N 2.91Å; R99-A103 VanDerWaalsContact O-N 3.13Å; R99-Y194 PolarHBondContact NH1-OH 3.24Å
100	K	95.7	Very high	95.8	Very high	93 Å²	93	64.7 Å²	64.7	40%	0.404	31%	0.31	S	S	.	.	H	α-helix	trans	-66.2	-44.9	175	-173.3	171.3	-178.3	168.5	0	111.1	M96 R97 V98 C102 A103 L104	M96-K100 WeakPolarHBondContact O-CB 3.46Å; M96-K100 PolarHBondContact O-N 3.17Å; R97-K100 PolarHBondContact O-N 3.25Å; V98-K100 VanDerWaalsContact C-N 3.3Å; V98-K100 PolarHBondContact O-N 3.06Å; K100-C102 PolarHBondContact O-N 3.19Å; K100-A103 PolarHBondContact O-N 2.87Å; K100-L104 HydrophobicContact CG-CD1 4.47Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 3.21Å
101	Q	97.2	Very high	96.2	Very high	116 Å²	116	65.8 Å²	65.8	54%	0.542	31%	0.307	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176	-72.6	173.3	-10.9	0	0	112.4	R97 V98 A103 L104 A105	R97-Q101 WeakPolarHBondContact O-CG 3.48Å; R97-Q101 PolarHBondContact O-N 3.32Å; V98-Q101 PolarHBondContact O-N 3.01Å; Q101-A103 VanDerWaalsContact C-N 3.34Å; Q101-A103 PolarHBondContact O-N 3.01Å; Q101-L104 PolarHBondContact O-N 3.48Å; Q101-A105 WeakPolarHBondContact O-CB 3.42Å; Q101-A105 PolarHBondContact O-N 3.46Å
102	C	97.9	Very high	96.5	Very high	8 Å²	8	62.8 Å²	62.8	5%	0.054	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-42.3	174.9	-64.5	0	0	0	0	111.9	V71 V98 K100 A105 A106	V71-C102 HydrophobicContact CG1-CB 4.09Å; V98-C102 PolarHBondContact O-N 3.35Å; V98-C102 PolarHBondContact O-SG 3.15Å; K100-C102 PolarHBondContact O-N 3.19Å; C102-A105 PolarHBondContact O-N 3.33Å; C102-A106 PolarHBondContact O-N 3.3Å
103	A	98	Very high	96.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-42	175.6	0	0	0	0	0	111.9	V71 R99 K100 Q101 A106 L107 F124	V71-A103 HydrophobicContact CG1-CB 4.31Å; R99-A103 PolarHBondContact O-N 2.91Å; R99-A103 VanDerWaalsContact O-N 3.13Å; K100-A103 PolarHBondContact O-N 2.87Å; Q101-A103 VanDerWaalsContact C-N 3.34Å; Q101-A103 PolarHBondContact O-N 3.01Å; A103-A106 PolarHBondContact O-N 3.35Å; A103-L107 WeakPolarHBondContact O-CG 3.25Å; A103-L107 PolarHBondContact O-N 2.96Å; A103-F124 HydrophobicContact CB-CZ 4.2Å
104	L	98.1	Very high	96.8	Very high	77 Å²	77	54.6 Å²	54.6	40%	0.403	25%	0.253	S	S	.	.	H	α-helix	trans	-67	-36.9	175.9	-68.2	172.6	0	0	0	112.5	K100 Q101 L107 R108 M136	K100-L104 HydrophobicContact CG-CD1 4.47Å; K100-L104 WeakPolarHBondContact O-CG 3.19Å; K100-L104 PolarHBondContact O-N 3.21Å; Q101-L104 PolarHBondContact O-N 3.48Å; L104-L107 PolarHBondContact O-N 3.15Å; L104-R108 WeakPolarHBondContact O-CG 3.27Å; L104-R108 PolarHBondContact O-N 3.08Å; L104-M136 HydrophobicContact CD2-CE 4.23Å; L104-M136 HydrophobicContact CD2-SD 3.97Å
105	A	98.4	Very high	96.9	Very high	19 Å²	19	51.8 Å²	51.8	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-49.1	173.2	0	0	0	0	0	111.1	Y74 Q101 C102 L107 R108 D109	Y74-A105 HydrophobicContact CD1-CB 4.09Å; Y74-A105 HydrophobicContact CE1-CB 4.45Å; Q101-A105 WeakPolarHBondContact O-CB 3.42Å; Q101-A105 PolarHBondContact O-N 3.46Å; C102-A105 PolarHBondContact O-N 3.33Å; A105-L107 VanDerWaalsContact C-N 3.33Å; A105-L107 PolarHBondContact O-N 2.95Å; A105-R108 WeakPolarHBondContact O-CB 3.23Å; A105-R108 PolarHBondContact O-N 3.36Å; A105-R108 VanDerWaalsContact O-N 3.11Å; A105-D109 PolarHBondContact O-N 3.21Å
106	A	98.6	Very high	97	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-40.4	175.3	0	0	0	0	0	112.5	V71 Y74 C102 A103 R108 D109 V110 F124	V71-A106 HydrophobicContact CG2-CB 4.12Å; Y74-A106 HydrophobicContact CD1-CB 4.38Å; Y74-A106 HydrophobicContact CD2-CB 3.87Å; Y74-A106 HydrophobicContact CE1-CB 4.21Å; Y74-A106 HydrophobicContact CE2-CB 3.69Å; Y74-A106 HydrophobicContact CG-CB 4.22Å; C102-A106 PolarHBondContact O-N 3.3Å; A103-A106 PolarHBondContact O-N 3.35Å; A106-R108 VanDerWaalsContact C-N 3.34Å; A106-R108 PolarHBondContact O-N 3.46Å; A106-D109 PolarHBondContact O-N 3.1Å; A106-V110 WeakPolarHBondContact O-CG2 3.03Å; A106-V110 PolarHBondContact O-N 2.92Å; A106-F124 HydrophobicContact CB-CD2 4.47Å; A106-F124 HydrophobicContact CB-CE2 3.7Å
107	L	98.7	Very high	97.1	Very high	4 Å²	4	61 Å²	61	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-65.5	-32.8	175.4	-71.6	175.8	0	0	0	113.2	A103 L104 A105 D109 V110 K111 F124 M136 I137 F140	A103-L107 WeakPolarHBondContact O-CG 3.25Å; A103-L107 PolarHBondContact O-N 2.96Å; L104-L107 PolarHBondContact O-N 3.15Å; A105-L107 VanDerWaalsContact C-N 3.33Å; A105-L107 PolarHBondContact O-N 2.95Å; L107-D109 VanDerWaalsContact C-N 3.31Å; L107-V110 WeakPolarHBondContact O-CB 3.27Å; L107-V110 PolarHBondContact O-N 3.32Å; L107-K111 PolarHBondContact O-N 3.26Å; L107-F124 HydrophobicContact CD2-CD2 3.91Å; L107-F124 HydrophobicContact CD2-CE2 3.7Å; L107-F124 HydrophobicContact CD2-CG 4.46Å; L107-F124 HydrophobicContact CD2-CZ 4.11Å; L107-F124 HydrophobicContact CG-CE2 3.81Å; L107-F124 HydrophobicContact CG-CZ 4.05Å; L107-M136 HydrophobicContact CD1-CE 3.7Å; L107-I137 HydrophobicContact CD1-CG1 4.39Å; L107-F140 HydrophobicContact CB-CD2 4.14Å; L107-F140 HydrophobicContact CB-CE1 4.42Å; L107-F140 HydrophobicContact CB-CE2 3.96Å; L107-F140 HydrophobicContact CB-CG 4.44Å; L107-F140 HydrophobicContact CB-CZ 4.11Å; L107-F140 HydrophobicContact CD1-CB 4.35Å; L107-F140 HydrophobicContact CD1-CD2 4.5Å; L107-F140 HydrophobicContact CD1-CG 4.2Å; L107-F140 HydrophobicContact CD2-CD1 3.77Å; L107-F140 HydrophobicContact CD2-CE1 3.83Å; L107-F140 HydrophobicContact CD2-CG 4.26Å; L107-F140 HydrophobicContact CD2-CZ 4.35Å; L107-F140 WeakPolarHBondContact O-CE2 3.5Å; L107-F140 WeakPolarHBondContact O-CZ 3.46Å
108	R	98.6	Very high	97	Very high	177 Å²	177	56.9 Å²	56.9	67%	0.668	29%	0.286	S	S	*	.	H	α-helix	trans	-62.9	-40.8	172.1	-73.6	-175.9	-67.5	168	0.9	111.4	L104 A105 A106 K111 S112	L104-R108 WeakPolarHBondContact O-CG 3.27Å; L104-R108 PolarHBondContact O-N 3.08Å; A105-R108 WeakPolarHBondContact O-CB 3.23Å; A105-R108 PolarHBondContact O-N 3.36Å; A105-R108 VanDerWaalsContact O-N 3.11Å; A106-R108 VanDerWaalsContact C-N 3.34Å; A106-R108 PolarHBondContact O-N 3.46Å; R108-K111 WeakPolarHBondContact O-CB 3.49Å; R108-K111 PolarHBondContact O-N 3.44Å; R108-S112 PolarHBondContact O-N 3.34Å
109	D	98.7	Very high	97	Very high	71 Å²	71	55.4 Å²	55.4	38%	0.38	28%	0.276	S	S	.	.	H	α-helix	trans	-71.8	-35.6	177.8	-63.1	-11	0	0	0	111.7	F69 Y74 A105 A106 L107 K111 S112 Y113	F69-D109 HydrophobicContact CD1-CB 4.01Å; F69-D109 HydrophobicContact CE1-CB 3.68Å; Y74-D109 WeakPolarHBondContact CE1-OD2 3.01Å; Y74-D109 VanDerWaalsContact CZ-OD2 3.3Å; Y74-D109 WeakPolarHBondContact OH-CB 3.5Å; Y74-D109 PolarHBondContact OH-OD2 3.41Å; A105-D109 PolarHBondContact O-N 3.21Å; A106-D109 PolarHBondContact O-N 3.1Å; L107-D109 VanDerWaalsContact C-N 3.31Å; D109-K111 VanDerWaalsContact C-N 3.32Å; D109-K111 PolarHBondContact O-N 3.18Å; D109-S112 PolarHBondContact O-N 3.47Å; D109-Y113 WeakPolarHBondContact O-CB 3.33Å; D109-Y113 PolarHBondContact O-N 3.18Å
110	V	98.8	Very high	97.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-55.7	-48	169	167.3	0	0	0	0	110.5	V37 F69 A106 L107 S112 Y113 L114 A122 F124 F140	V37-V110 HydrophobicContact CG2-CG1 3.92Å; F69-V110 HydrophobicContact CB-CG2 4.11Å; F69-V110 HydrophobicContact CD1-CG2 3.94Å; F69-V110 HydrophobicContact CD2-CG2 3.55Å; F69-V110 HydrophobicContact CE1-CG2 4.25Å; F69-V110 HydrophobicContact CE2-CG2 3.89Å; F69-V110 HydrophobicContact CG-CG2 3.58Å; F69-V110 HydrophobicContact CZ-CG2 4.22Å; A106-V110 WeakPolarHBondContact O-CG2 3.03Å; A106-V110 PolarHBondContact O-N 2.92Å; L107-V110 WeakPolarHBondContact O-CB 3.27Å; L107-V110 PolarHBondContact O-N 3.32Å; V110-S112 PolarHBondContact O-N 2.95Å; V110-Y113 PolarHBondContact O-N 3.39Å; V110-L114 HydrophobicContact CG1-CD1 3.87Å; V110-L114 HydrophobicContact CG1-CG 4.39Å; V110-L114 WeakPolarHBondContact O-CG 3.48Å; V110-L114 PolarHBondContact O-N 3.09Å; V110-A122 HydrophobicContact CB-CB 4.34Å; V110-A122 HydrophobicContact CG1-CB 3.64Å; V110-A122 HydrophobicContact CG2-CB 4.06Å; V110-F124 HydrophobicContact CG2-CD2 4.29Å; V110-F140 HydrophobicContact CB-CZ 4.41Å; V110-F140 HydrophobicContact CG1-CE1 3.98Å; V110-F140 HydrophobicContact CG1-CZ 4.19Å
111	K	98.4	Very high	97.2	Very high	96 Å²	96	53.8 Å²	53.8	42%	0.417	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-47.2	177.1	179.4	174.2	178.3	153.8	0	111.2	L107 R108 D109 Y113 T115 F140 N144	L107-K111 PolarHBondContact O-N 3.26Å; R108-K111 WeakPolarHBondContact O-CB 3.49Å; R108-K111 PolarHBondContact O-N 3.44Å; D109-K111 VanDerWaalsContact C-N 3.32Å; D109-K111 PolarHBondContact O-N 3.18Å; K111-Y113 VanDerWaalsContact C-N 3.34Å; K111-Y113 PolarHBondContact O-N 2.86Å; K111-T115 HydrophobicContact CG-CG2 4.47Å; K111-T115 WeakPolarHBondContact O-CB 3.1Å; K111-T115 WeakPolarHBondContact O-CG2 3.5Å; K111-T115 PolarHBondContact O-N 3.21Å; K111-T115 PolarHBondContact O-OG1 3.39Å; K111-F140 HydrophobicContact CB-CE2 4.07Å; K111-F140 HydrophobicContact CB-CZ 3.88Å; K111-N144 VanDerWaalsContact CD-OD1 3.23Å; K111-N144 WeakPolarHBondContact CD-OD1 3.43Å; K111-N144 WeakPolarHBondContact CE-OD1 3.24Å; K111-N144 PolarHBondContact NZ-OD1 2.74Å
112	S	98.3	Very high	97.3	Very high	35 Å²	35	48.3 Å²	48.3	25%	0.245	25%	0.246	C	C	.	.	H	α-helix	trans	-56.3	-49.9	177.1	-176.2	0	0	0	0	111.1	R108 D109 V110 L114 T115 K116 E117	R108-S112 PolarHBondContact O-N 3.34Å; D109-S112 PolarHBondContact O-N 3.47Å; V110-S112 PolarHBondContact O-N 2.95Å; S112-L114 PolarHBondContact O-N 3.15Å; S112-T115 PolarHBondContact O-N 3.32Å; S112-K116 WeakPolarHBondContact O-CA 3.34Å; S112-K116 VanDerWaalsContact O-CB 3.31Å; S112-K116 WeakPolarHBondContact O-CB 3.44Å; S112-K116 PolarHBondContact O-N 3.34Å; S112-E117 PolarHBondContact O-N 2.89Å; S112-E117 PolarHBondContact OG-OE1 3.2Å
113	Y	98.4	Very high	97.4	Very high	23 Å²	23	47.9 Å²	47.9	9%	0.09	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-48.7	-177	177.3	-111.7	0	0	0	112.8	P65 T66 K67 F69 D109 V110 K111 E117 G119 I121 A122	P65-Y113 PolarHBondContact O-OH 2.84Å; T66-Y113 WeakPolarHBondContact CA-OH 3.27Å; T66-Y113 PolarHBondContact N-OH 3.46Å; K67-Y113 HydrophobicContact CB-CD1 4.15Å; K67-Y113 HydrophobicContact CB-CD2 4.41Å; K67-Y113 HydrophobicContact CB-CE1 3.67Å; K67-Y113 HydrophobicContact CB-CE2 3.97Å; K67-Y113 HydrophobicContact CB-CG 4.5Å; K67-Y113 HydrophobicContact CD-CD2 4.02Å; K67-Y113 HydrophobicContact CD-CE2 4.11Å; K67-Y113 HydrophobicContact CD-CG 4.4Å; F69-Y113 HydrophobicContact CE2-CD1 4.02Å; F69-Y113 HydrophobicContact CE2-CG 4.38Å; F69-Y113 HydrophobicContact CZ-CD1 4.03Å; F69-Y113 AromaticContact CZ-CG 3.91Å; F69-Y113 HydrophobicContact CZ-CG 3.91Å; D109-Y113 WeakPolarHBondContact O-CB 3.33Å; D109-Y113 PolarHBondContact O-N 3.18Å; V110-Y113 PolarHBondContact O-N 3.39Å; K111-Y113 VanDerWaalsContact C-N 3.34Å; K111-Y113 PolarHBondContact O-N 2.86Å; Y113-E117 HydrophobicContact CD2-CB 4.07Å; Y113-E117 PolarHBondContact O-N 3.41Å; Y113-G119 VanDerWaalsContact CE1-CA 3.49Å; Y113-G119 PolarHBondContact O-N 3.45Å; Y113-I121 WeakPolarHBondContact CE1-O 3.41Å; Y113-A122 HydrophobicContact CD1-CB 4.48Å
114	L	96.5	Very high	97.4	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-74.6	-24.5	-176.6	-62.2	-178.6	0	0	0	113.7	P35 V37 V110 S112 A122 F146	P35-L114 HydrophobicContact CB-CB 4.05Å; P35-L114 HydrophobicContact CB-CD1 4.07Å; P35-L114 HydrophobicContact CB-CD2 3.99Å; P35-L114 HydrophobicContact CB-CG 4.25Å; P35-L114 HydrophobicContact CG-CB 4.41Å; V37-L114 HydrophobicContact CG2-CD1 3.9Å; V110-L114 HydrophobicContact CG1-CD1 3.87Å; V110-L114 HydrophobicContact CG1-CG 4.39Å; V110-L114 WeakPolarHBondContact O-CG 3.48Å; V110-L114 PolarHBondContact O-N 3.09Å; S112-L114 PolarHBondContact O-N 3.15Å; L114-A122 HydrophobicContact CD1-CB 3.96Å; L114-A122 HydrophobicContact CD2-CB 4.04Å; L114-A122 HydrophobicContact CG-CB 4.11Å; L114-F146 HydrophobicContact CB-CE1 3.83Å; L114-F146 HydrophobicContact CB-CE2 4.45Å; L114-F146 HydrophobicContact CB-CZ 3.79Å; L114-F146 HydrophobicContact CD1-CD1 4.17Å; L114-F146 HydrophobicContact CD1-CD2 3.97Å; L114-F146 HydrophobicContact CD1-CE1 4.17Å; L114-F146 HydrophobicContact CD1-CE2 3.97Å; L114-F146 HydrophobicContact CD1-CG 4.09Å; L114-F146 HydrophobicContact CD1-CZ 4.07Å
115	T	94.9	Very high	97.4	Very high	75 Å²	75	44.5 Å²	44.5	46%	0.46	23%	0.225	S	C	.	.	H	α-helix	trans	-105.2	-28.1	-175.9	59.9	0	0	0	0	114.4	K111 S112 F146	K111-T115 HydrophobicContact CG-CG2 4.47Å; K111-T115 WeakPolarHBondContact O-CB 3.1Å; K111-T115 WeakPolarHBondContact O-CG2 3.5Å; K111-T115 PolarHBondContact O-N 3.21Å; K111-T115 PolarHBondContact O-OG1 3.39Å; S112-T115 PolarHBondContact O-N 3.32Å; T115-F146 HydrophobicContact CG2-CE1 3.92Å; T115-F146 HydrophobicContact CG2-CZ 3.71Å
116	K	94.4	Very high	97.4	Very high	172 Å²	172	44.2 Å²	44.2	75%	0.748	22%	0.224	S	C	*	.	H	α-helix	trans	-118.3	-27.1	-171.2	-56.5	-178.5	-178.4	179.2	0	113.8	S112	S112-K116 WeakPolarHBondContact O-CA 3.34Å; S112-K116 VanDerWaalsContact O-CB 3.31Å; S112-K116 WeakPolarHBondContact O-CB 3.44Å; S112-K116 PolarHBondContact O-N 3.34Å
117	E	94.6	Very high	97.3	Very high	106 Å²	106	45.5 Å²	45.5	50%	0.495	23%	0.231	S	C	.	.	S	Bend	trans	-103.5	1.3	-172.4	-59.8	166.9	-135.2	0	0	113.1	S112 Y113 G119	S112-E117 PolarHBondContact O-N 2.89Å; S112-E117 PolarHBondContact OG-OE1 3.2Å; Y113-E117 HydrophobicContact CD2-CB 4.07Å; Y113-E117 PolarHBondContact O-N 3.41Å; E117-G119 VanDerWaalsContact C-N 3.32Å
118	G	91.9	Very high	97.3	Very high	55 Å²	55	45.3 Å²	45.3	57%	0.567	23%	0.23	S	C	*	.			trans	77.4	15.1	-179.5	0	0	0	0	0	114.4
119	G	96.2	Very high	97.2	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.01	20%	0.2	C	C	.	.			trans	-65.4	142.5	174.4	0	0	0	0	0	112.6	Y113 E117	Y113-G119 VanDerWaalsContact CE1-CA 3.49Å; Y113-G119 PolarHBondContact O-N 3.45Å; E117-G119 VanDerWaalsContact C-N 3.32Å
120	Q	96.9	Very high	97.1	Very high	84 Å²	84	35.6 Å²	35.6	39%	0.393	19%	0.193	S	C	.	.			trans	-106.7	-34.3	176.6	-66.5	-171.9	30.8	0	0	112.5	P35 T36 V64 P65	P35-Q120 WeakPolarHBondContact CA-O 3.33Å; P35-Q120 WeakPolarHBondContact CB-O 3.45Å; T36-Q120 PolarHBondContact N-O 3.41Å; V64-Q120 HydrophobicContact CG1-CB 4.15Å; P65-Q120 HydrophobicContact CG-CG 4.49Å; P65-Q120 PolarHBondContact O-N 3.34Å
121	I	98.6	Very high	97.1	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.3	-178.8	-59	173.4	0	0	0	110.8	T36 I38 L59 V64 P65 T66 K67 Y113 V123 I231	T36-I121 WeakPolarHBondContact O-CA 3.37Å; I38-I121 HydrophobicContact CD1-CG2 3.52Å; I38-I121 HydrophobicContact CG1-CG2 3.83Å; L59-I121 HydrophobicContact CD1-CD1 3.71Å; L59-I121 HydrophobicContact CD1-CG2 4.36Å; L59-I121 HydrophobicContact CD2-CD1 4.06Å; L59-I121 HydrophobicContact CG-CD1 4.4Å; V64-I121 HydrophobicContact CG1-CD1 3.55Å; V64-I121 HydrophobicContact CG1-CG1 4.04Å; P65-I121 PolarHBondContact O-N 3.09Å; P65-I121 VanDerWaalsContact O-N 3.08Å; T66-I121 VanDerWaalsContact CA-O 3.29Å; T66-I121 WeakPolarHBondContact CA-O 3.43Å; T66-I121 HydrophobicContact CG2-CB 3.88Å; T66-I121 HydrophobicContact CG2-CG2 3.82Å; K67-I121 PolarHBondContact N-O 3.31Å; K67-I121 VanDerWaalsContact N-O 3.13Å; Y113-I121 WeakPolarHBondContact CE1-O 3.41Å; I121-V123 HydrophobicContact CG2-CG2 4.41Å; I121-I231 HydrophobicContact CD1-CD1 4.18Å; I121-I231 HydrophobicContact CD1-CG1 3.64Å
122	A	98.8	Very high	97	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.3	171.2	0	0	0	0	0	110.2	T36 V37 I38 F69 V110 Y113 L114	T36-A122 PolarHBondContact O-N 3.05Å; V37-A122 CarbonylContact C-O 3.59Å; V37-A122 WeakPolarHBondContact CA-O 3.44Å; I38-A122 PolarHBondContact N-O 3.4Å; F69-A122 HydrophobicContact CD2-CB 4.02Å; F69-A122 HydrophobicContact CE2-CB 3.72Å; V110-A122 HydrophobicContact CB-CB 4.34Å; V110-A122 HydrophobicContact CG1-CB 3.64Å; V110-A122 HydrophobicContact CG2-CB 4.06Å; Y113-A122 HydrophobicContact CD1-CB 4.48Å; L114-A122 HydrophobicContact CD1-CB 3.96Å; L114-A122 HydrophobicContact CD2-CB 4.04Å; L114-A122 HydrophobicContact CG-CB 4.11Å
123	V	98.9	Very high	96.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	105.6	175.4	-174.6	0	0	0	0	109.3	I38 M40 T66 K67 V68 F69 I121 D125	I38-V123 HydrophobicContact CB-CG2 4.25Å; I38-V123 HydrophobicContact CD1-CG2 4.24Å; I38-V123 HydrophobicContact CG2-CG1 4.29Å; M40-V123 HydrophobicContact CG-CG1 4.07Å; M40-V123 HydrophobicContact SD-CG1 4.13Å; T66-V123 HydrophobicContact CG2-CG2 3.93Å; K67-V123 PolarHBondContact O-N 3.37Å; V68-V123 CarbonylContact C-O 3.51Å; V68-V123 WeakPolarHBondContact CA-O 3.4Å; V68-V123 HydrophobicContact CG2-CB 4.25Å; F69-V123 PolarHBondContact N-O 3.1Å; I121-V123 HydrophobicContact CG2-CG2 4.41Å; V123-D125 PolarHBondContact O-N 2.73Å
124	F	98.8	Very high	96.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	92.4	178.4	-167.7	-105.1	0	0	0	110.4	V37 I38 M40 F69 V71 A103 A106 L107 V110 A126 I137	V37-F124 HydrophobicContact CG1-CB 4.2Å; I38-F124 PolarHBondContact O-N 3.26Å; M40-F124 PolarHBondContact N-O 3.41Å; M40-F124 VanDerWaalsContact N-O 3.15Å; F69-F124 HydrophobicContact CB-CD2 4.46Å; V71-F124 HydrophobicContact CG2-CE1 4.11Å; V71-F124 HydrophobicContact CG2-CE2 3.78Å; V71-F124 HydrophobicContact CG2-CZ 3.54Å; A103-F124 HydrophobicContact CB-CZ 4.2Å; A106-F124 HydrophobicContact CB-CD2 4.47Å; A106-F124 HydrophobicContact CB-CE2 3.7Å; L107-F124 HydrophobicContact CD2-CD2 3.91Å; L107-F124 HydrophobicContact CD2-CE2 3.7Å; L107-F124 HydrophobicContact CD2-CG 4.46Å; L107-F124 HydrophobicContact CD2-CZ 4.11Å; L107-F124 HydrophobicContact CG-CE2 3.81Å; L107-F124 HydrophobicContact CG-CZ 4.05Å; V110-F124 HydrophobicContact CG2-CD2 4.29Å; F124-A126 HydrophobicContact CE1-CB 4.3Å; F124-A126 PolarHBondContact O-N 3.36Å; F124-I137 HydrophobicContact CD1-CD1 3.88Å; F124-I137 HydrophobicContact CE1-CD1 3.66Å; F124-I137 HydrophobicContact CE1-CG1 4.29Å
125	D	98.4	Very high	97	Very high	5 Å²	5	46 Å²	46	3%	0.027	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	99.8	-175.8	-177.4	18.4	0	0	0	111.3	M40 T49 V68 F69 N70 V71 V123	M40-D125 HydrophobicContact CG-CB 4.35Å; T49-D125 VanDerWaalsContact CA-OD2 3.29Å; T49-D125 WeakPolarHBondContact CA-OD2 3.16Å; T49-D125 VanDerWaalsContact CB-OD2 3.29Å; T49-D125 WeakPolarHBondContact CB-OD2 3.44Å; T49-D125 WeakPolarHBondContact CG2-OD2 3.44Å; T49-D125 PolarHBondContact OG1-OD2 2.87Å; V68-D125 HydrophobicContact CG1-CB 3.97Å; F69-D125 PolarHBondContact O-N 2.87Å; N70-D125 HydrophobicContact CB-CB 4.44Å; N70-D125 PolarHBondContact ND2-OD2 2.82Å; V71-D125 PolarHBondContact N-O 3.46Å; V123-D125 PolarHBondContact O-N 2.73Å
126	A	97.4	Very high	97.2	Very high	14 Å²	14	44.5 Å²	44.5	12%	0.116	22%	0.223	C	C	.	.	S	Bend	trans	-151	178	172.1	0	0	0	0	0	110.4	K48 V71 F124	K48-A126 WeakPolarHBondContact CD-O 3.46Å; K48-A126 WeakPolarHBondContact CE-O 3.45Å; V71-A126 HydrophobicContact CB-CB 3.94Å; V71-A126 HydrophobicContact CG2-CB 3.75Å; F124-A126 HydrophobicContact CE1-CB 4.3Å; F124-A126 PolarHBondContact O-N 3.36Å
127	T	96.9	Very high	97.4	Very high	26 Å²	26	36.3 Å²	36.3	16%	0.16	19%	0.187	C	C	.	.			trans	-68.6	-43.1	176.8	50.5	0	0	0	0	112.5	V41 G42 P44 T129 Y194	V41-T127 CarbonylContact C-O 3.21Å; V41-T127 WeakPolarHBondContact CA-O 3.49Å; G42-T127 PolarHBondContact N-O 3.16Å; G42-T127 WeakPolarHBondContact O-CA 3.08Å; P44-T127 HydrophobicContact CG-CG2 4.18Å; T127-T129 PolarHBondContact O-N 3.43Å; T127-Y194 HydrophobicContact CG2-CD1 4.19Å; T127-Y194 HydrophobicContact CG2-CE1 4Å; T127-Y194 WeakPolarHBondContact OG1-CE1 3.22Å
128	N	98.2	Very high	97.6	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.175	C	C	.	.			trans	44.5	36	178.9	-57.2	-42	0	0	0	113.9	V39 M40 V41 T130 R133 R134	V39-N128 HydrophobicContact CG1-CB 4.32Å; M40-N128 WeakPolarHBondContact O-CB 3.23Å; M40-N128 PolarHBondContact O-ND2 3.02Å; V41-N128 HydrophobicContact CG2-CB 4.25Å; N128-T130 VanDerWaalsContact C-N 3.34Å; N128-T130 PolarHBondContact O-N 3.17Å; N128-R133 HydrophobicContact CB-CG 4.38Å; N128-R133 WeakPolarHBondContact OD1-CG 3.27Å; N128-R134 HydrophobicContact CB-CG 4.4Å; N128-R134 WeakPolarHBondContact O-CG 3.43Å; N128-R134 PolarHBondContact O-NH1 2.6Å; N128-R134 VanDerWaalsContact O-NH1 3.08Å
129	T	97.2	Very high	97.9	Very high	6 Å²	6	35.9 Å²	35.9	4%	0.037	17%	0.171	C	C	.	.			trans	-74.4	-20.2	-169.7	43	0	0	0	0	113.4	L43 T127 R134 Y198 Q199	L43-T129 HydrophobicContact CD2-CG2 4.27Å; T127-T129 PolarHBondContact O-N 3.43Å; T129-R134 PolarHBondContact O-NH1 3.02Å; T129-Y198 HydrophobicContact CG2-CD2 3.54Å; T129-Y198 HydrophobicContact CG2-CE2 3.97Å; T129-Y198 HydrophobicContact CG2-CG 4.19Å; T129-Q199 PolarHBondContact O-N 3.32Å
130	T	97.2	Very high	98	Very high	38 Å²	38	37.1 Å²	37.1	23%	0.233	18%	0.176	C	C	.	.	S	Bend	trans	-98.4	146.9	-180	70.1	0	0	0	0	111.9	N128 E132 R133 R134	N128-T130 VanDerWaalsContact C-N 3.34Å; N128-T130 PolarHBondContact O-N 3.17Å; T130-E132 VanDerWaalsContact C-N 3.33Å; T130-E132 PolarHBondContact O-N 2.95Å; T130-R133 PolarHBondContact O-N 3.48Å; T130-R133 WeakPolarHBondContact OG1-CB 3.49Å; T130-R133 PolarHBondContact OG1-N 3.35Å; T130-R134 PolarHBondContact O-N 3.45Å
131	R	97.6	Very high	98	Very high	78 Å²	78	33.2 Å²	33.2	29%	0.294	16%	0.159	S	C	.	.	H	α-helix	trans	-60.7	-41.9	174.4	-72.5	173.7	179.9	168.7	-0.1	111.5	R133 R134 H135 Q199 C206	R131-R133 VanDerWaalsContact C-N 3.3Å; R131-R133 PolarHBondContact O-N 3.04Å; R131-R134 PolarHBondContact O-N 2.82Å; R131-R134 VanDerWaalsContact O-N 3.1Å; R131-H135 PolarHBondContact O-N 3.21Å; R131-H135 PolarHBondContact O-ND1 3.03Å; R131-Q199 HydrophobicContact CG-CB 4.07Å; R131-C206 PolarHBondContact NH2-SG 3.23Å; R131-C206 VanDerWaalsContact NH2-SG 3.42Å
132	E	96.5	Very high	98	Very high	140 Å²	140	41.1 Å²	41.1	65%	0.654	19%	0.193	S	C	*	.	H	α-helix	trans	-53.8	-47.3	177.7	-172.2	-159	156.8	0	0	111.5	T130 R134 H135 M136	T130-E132 VanDerWaalsContact C-N 3.33Å; T130-E132 PolarHBondContact O-N 2.95Å; E132-R134 VanDerWaalsContact C-N 3.35Å; E132-R134 PolarHBondContact O-N 3.38Å; E132-H135 PolarHBondContact O-N 3.02Å; E132-M136 PolarHBondContact O-N 3.04Å
133	R	97.3	Very high	97.9	Very high	45 Å²	45	47 Å²	47	17%	0.17	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-42.7	177.9	178.9	58.8	62.4	79.7	3.5	111.7	N128 T130 R131 M136 I137	N128-R133 HydrophobicContact CB-CG 4.38Å; N128-R133 WeakPolarHBondContact OD1-CG 3.27Å; T130-R133 PolarHBondContact O-N 3.48Å; T130-R133 WeakPolarHBondContact OG1-CB 3.49Å; T130-R133 PolarHBondContact OG1-N 3.35Å; R131-R133 VanDerWaalsContact C-N 3.3Å; R131-R133 PolarHBondContact O-N 3.04Å; R133-M136 WeakPolarHBondContact O-CB 3.18Å; R133-M136 PolarHBondContact O-N 3.04Å; R133-I137 HydrophobicContact CG-CD1 4.15Å; R133-I137 WeakPolarHBondContact O-CG1 3.46Å; R133-I137 PolarHBondContact O-N 2.89Å
134	R	98.5	Very high	97.8	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-38.3	179	-64.7	-167.5	-61.7	-94.9	13.3	112	N128 T129 T130 R131 E132 M136 I137 L138 F150 Q199 D207	N128-R134 HydrophobicContact CB-CG 4.4Å; N128-R134 WeakPolarHBondContact O-CG 3.43Å; N128-R134 PolarHBondContact O-NH1 2.6Å; N128-R134 VanDerWaalsContact O-NH1 3.08Å; T129-R134 PolarHBondContact O-NH1 3.02Å; T130-R134 PolarHBondContact O-N 3.45Å; R131-R134 PolarHBondContact O-N 2.82Å; R131-R134 VanDerWaalsContact O-N 3.1Å; E132-R134 VanDerWaalsContact C-N 3.35Å; E132-R134 PolarHBondContact O-N 3.38Å; R134-M136 PolarHBondContact O-N 3.31Å; R134-I137 PolarHBondContact O-N 3.44Å; R134-L138 WeakPolarHBondContact O-CG 3.39Å; R134-L138 PolarHBondContact O-N 3.15Å; R134-F150 HydrophobicContact CB-CE1 4.09Å; R134-F150 HydrophobicContact CG-CE1 4.05Å; R134-Q199 PolarHBondContact NH1-O 3.13Å; R134-Q199 PolarHBondContact NH2-O 3.27Å; R134-D207 IonicContact NH2-OD2 3.56Å
135	H	98.3	Very high	97.7	Very high	114 Å²	114	54.2 Å²	54.2	53%	0.528	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-40.4	174	-75.7	77.9	0	0	0	112.1	R131 E132 I137 L138 H139	R131-H135 PolarHBondContact O-N 3.21Å; R131-H135 PolarHBondContact O-ND1 3.03Å; E132-H135 PolarHBondContact O-N 3.02Å; H135-I137 VanDerWaalsContact C-N 3.31Å; H135-I137 PolarHBondContact O-N 3.37Å; H135-L138 PolarHBondContact O-N 3.02Å; H135-H139 WeakPolarHBondContact O-CB 3.36Å; H135-H139 PolarHBondContact O-N 3.19Å
136	M	98.3	Very high	97.7	Very high	45 Å²	45	54.8 Å²	54.8	22%	0.222	26%	0.261	C	S	.	.	H	α-helix	trans	-58.6	-43.1	173.2	-175.2	-161.9	81.1	0	0	111.7	L104 L107 E132 R133 R134 F140	L104-M136 HydrophobicContact CD2-CE 4.23Å; L104-M136 HydrophobicContact CD2-SD 3.97Å; L107-M136 HydrophobicContact CD1-CE 3.7Å; E132-M136 PolarHBondContact O-N 3.04Å; R133-M136 WeakPolarHBondContact O-CB 3.18Å; R133-M136 PolarHBondContact O-N 3.04Å; R134-M136 PolarHBondContact O-N 3.31Å; M136-F140 PolarHBondContact O-N 3.1Å
137	I	98.6	Very high	97.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.9	-40.2	178.6	-61.9	162.7	0	0	0	111.2	V39 L107 F124 R133 R134 H135 H139 F140 A141	V39-I137 HydrophobicContact CG1-CD1 3.9Å; V39-I137 HydrophobicContact CG1-CG2 4.48Å; V39-I137 HydrophobicContact CG2-CG2 3.64Å; L107-I137 HydrophobicContact CD1-CG1 4.39Å; F124-I137 HydrophobicContact CD1-CD1 3.88Å; F124-I137 HydrophobicContact CE1-CD1 3.66Å; F124-I137 HydrophobicContact CE1-CG1 4.29Å; R133-I137 HydrophobicContact CG-CD1 4.15Å; R133-I137 WeakPolarHBondContact O-CG1 3.46Å; R133-I137 PolarHBondContact O-N 2.89Å; R134-I137 PolarHBondContact O-N 3.44Å; H135-I137 VanDerWaalsContact C-N 3.31Å; H135-I137 PolarHBondContact O-N 3.37Å; I137-H139 VanDerWaalsContact C-N 3.35Å; I137-F140 WeakPolarHBondContact O-CB 3.43Å; I137-F140 PolarHBondContact O-N 2.78Å; I137-A141 WeakPolarHBondContact O-CB 3.49Å; I137-A141 PolarHBondContact O-N 3.34Å
138	L	98.5	Very high	97.7	Very high	44 Å²	44	56.1 Å²	56.1	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-43.2	174.6	-76.8	168.7	0	0	0	112	R134 H135 A141 K142 A148 F150 L210	R134-L138 WeakPolarHBondContact O-CG 3.39Å; R134-L138 PolarHBondContact O-N 3.15Å; H135-L138 PolarHBondContact O-N 3.02Å; L138-A141 PolarHBondContact O-N 3.46Å; L138-K142 WeakPolarHBondContact O-CB 3.02Å; L138-K142 PolarHBondContact O-N 3.36Å; L138-A148 HydrophobicContact CD2-CB 3.9Å; L138-F150 HydrophobicContact CD1-CZ 4.28Å; L138-F150 HydrophobicContact CD2-CE2 3.79Å; L138-F150 HydrophobicContact CD2-CZ 3.77Å; L138-F150 HydrophobicContact CG-CE2 4.35Å; L138-F150 HydrophobicContact CG-CZ 3.86Å; L138-L210 HydrophobicContact CD1-CD1 4.25Å; L138-L210 HydrophobicContact CD1-CD2 3.78Å; L138-L210 HydrophobicContact CD2-CD2 4.05Å
139	H	98.4	Very high	97.8	Very high	107 Å²	107	56.1 Å²	56.1	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-61.6	-48.3	176	-178.5	61.1	0	0	0	110.9	H135 I137 A141 K142 E143	H135-H139 WeakPolarHBondContact O-CB 3.36Å; H135-H139 PolarHBondContact O-N 3.19Å; I137-H139 VanDerWaalsContact C-N 3.35Å; H139-A141 VanDerWaalsContact C-N 3.34Å; H139-A141 PolarHBondContact O-N 2.85Å; H139-K142 PolarHBondContact O-N 3.04Å; H139-E143 IonicContact CD2-OE1 2.72Å; H139-E143 IonicContact CE1-OE1 3.74Å; H139-E143 PolarHBondContact CE1-OE1 2.91Å; H139-E143 IonicContact NE2-OE1 3.17Å; H139-E143 PolarHBondContact NE2-OE1 2.94Å; H139-E143 IonicContact NE2-OE2 3.86Å; H139-E143 WeakPolarHBondContact O-CG 3.45Å; H139-E143 PolarHBondContact O-N 3.38Å
140	F	98.6	Very high	97.9	Very high	27 Å²	27	55.9 Å²	55.9	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-55.4	-45.9	173	166.4	-91	0	0	0	112.5	L107 V110 K111 M136 I137 N144 F146	L107-F140 HydrophobicContact CB-CD2 4.14Å; L107-F140 HydrophobicContact CB-CE1 4.42Å; L107-F140 HydrophobicContact CB-CE2 3.96Å; L107-F140 HydrophobicContact CB-CG 4.44Å; L107-F140 HydrophobicContact CB-CZ 4.11Å; L107-F140 HydrophobicContact CD1-CB 4.35Å; L107-F140 HydrophobicContact CD1-CD2 4.5Å; L107-F140 HydrophobicContact CD1-CG 4.2Å; L107-F140 HydrophobicContact CD2-CD1 3.77Å; L107-F140 HydrophobicContact CD2-CE1 3.83Å; L107-F140 HydrophobicContact CD2-CG 4.26Å; L107-F140 HydrophobicContact CD2-CZ 4.35Å; L107-F140 WeakPolarHBondContact O-CE2 3.5Å; L107-F140 WeakPolarHBondContact O-CZ 3.46Å; V110-F140 HydrophobicContact CB-CZ 4.41Å; V110-F140 HydrophobicContact CG1-CE1 3.98Å; V110-F140 HydrophobicContact CG1-CZ 4.19Å; K111-F140 HydrophobicContact CB-CE2 4.07Å; K111-F140 HydrophobicContact CB-CZ 3.88Å; M136-F140 PolarHBondContact O-N 3.1Å; I137-F140 WeakPolarHBondContact O-CB 3.43Å; I137-F140 PolarHBondContact O-N 2.78Å; F140-N144 PolarHBondContact O-N 2.82Å; F140-N144 PolarHBondContact O-ND2 2.87Å; F140-F146 HydrophobicContact CE1-CD2 4.02Å; F140-F146 HydrophobicContact CE1-CE2 4.03Å; F140-F146 HydrophobicContact CZ-CD2 4.49Å; F140-F146 HydrophobicContact CZ-CE2 4.05Å
141	A	98.1	Very high	97.9	Very high	3 Å²	3	54 Å²	54	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-45.3	179.3	0	0	0	0	0	111.2	I137 L138 H139 E143 N144 D145 F146 A148	I137-A141 WeakPolarHBondContact O-CB 3.49Å; I137-A141 PolarHBondContact O-N 3.34Å; L138-A141 PolarHBondContact O-N 3.46Å; H139-A141 VanDerWaalsContact C-N 3.34Å; H139-A141 PolarHBondContact O-N 2.85Å; A141-E143 PolarHBondContact O-N 2.86Å; A141-N144 CarbonylContact O-C 3.58Å; A141-N144 PolarHBondContact O-N 2.81Å; A141-D145 PolarHBondContact O-N 2.92Å; A141-D145 VanDerWaalsContact O-N 3.17Å; A141-F146 HydrophobicContact CB-CB 4.22Å; A141-F146 PolarHBondContact O-N 3.25Å; A141-A148 HydrophobicContact CB-CB 4.28Å
142	K	96.8	Very high	98	Very high	169 Å²	169	50.3 Å²	50.3	74%	0.735	24%	0.239	S	C	*	.	H	α-helix	trans	-62.2	-43.1	179	-174.8	176.8	179.9	179.9	0	112.8	L138 H139 N144 D145	L138-K142 WeakPolarHBondContact O-CB 3.02Å; L138-K142 PolarHBondContact O-N 3.36Å; H139-K142 PolarHBondContact O-N 3.04Å; K142-N144 PolarHBondContact O-N 3.06Å; K142-D145 PolarHBondContact O-N 3.44Å
143	E	97.9	Very high	98	Very high	124 Å²	124	44 Å²	44	58%	0.579	21%	0.21	S	C	*	.	H	α-helix	trans	-67	-18.2	179.2	-73.2	-172.3	146.7	0	0	114	H139 A141	H139-E143 IonicContact CD2-OE1 2.72Å; H139-E143 IonicContact CE1-OE1 3.74Å; H139-E143 PolarHBondContact CE1-OE1 2.91Å; H139-E143 IonicContact NE2-OE1 3.17Å; H139-E143 PolarHBondContact NE2-OE1 2.94Å; H139-E143 IonicContact NE2-OE2 3.86Å; H139-E143 WeakPolarHBondContact O-CG 3.45Å; H139-E143 PolarHBondContact O-N 3.38Å; A141-E143 PolarHBondContact O-N 2.86Å
144	N	96.9	Very high	98	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.139	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	13.7	-178.5	-63.4	-84.6	0	0	0	112.5	K111 F140 A141 K142 F146	K111-N144 VanDerWaalsContact CD-OD1 3.23Å; K111-N144 WeakPolarHBondContact CD-OD1 3.43Å; K111-N144 WeakPolarHBondContact CE-OD1 3.24Å; K111-N144 PolarHBondContact NZ-OD1 2.74Å; F140-N144 PolarHBondContact O-N 2.82Å; F140-N144 PolarHBondContact O-ND2 2.87Å; A141-N144 CarbonylContact O-C 3.58Å; A141-N144 PolarHBondContact O-N 2.81Å; K142-N144 PolarHBondContact O-N 3.06Å; N144-F146 HydrophobicContact CB-CD1 4.39Å; N144-F146 HydrophobicContact CB-CD2 3.71Å; N144-F146 HydrophobicContact CB-CE1 4.13Å; N144-F146 HydrophobicContact CB-CE2 3.41Å; N144-F146 VanDerWaalsContact CB-CE2 3.41Å; N144-F146 HydrophobicContact CB-CG 4.19Å; N144-F146 HydrophobicContact CB-CZ 3.63Å; N144-F146 WeakPolarHBondContact O-CD1 3.2Å; N144-F146 VanDerWaalsContact O-CE1 3.26Å; N144-F146 WeakPolarHBondContact O-CE1 3.49Å; N144-F146 PolarHBondContact O-N 3.15Å
145	D	96.2	Very high	97.6	Very high	125 Å²	125	43.3 Å²	43.3	67%	0.668	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	32.8	-179.2	-62.1	-60.3	0	0	0	114.1	S34 A141 K142	S34-D145 VanDerWaalsContact CB-O 3.24Å; S34-D145 WeakPolarHBondContact CB-O 3.36Å; S34-D145 PolarHBondContact OG-O 2.88Å; A141-D145 PolarHBondContact O-N 2.92Å; A141-D145 VanDerWaalsContact O-N 3.17Å; K142-D145 PolarHBondContact O-N 3.44Å
146	F	97.6	Very high	97.1	Very high	17 Å²	17	43.8 Å²	43.8	8%	0.075	22%	0.217	C	C	.	.			trans	-93.5	145.5	173.6	-53.4	-32.6	0	0	0	111.2	P35 V37 L114 T115 F140 A141 N144	P35-F146 HydrophobicContact CB-CD1 4.12Å; P35-F146 HydrophobicContact CB-CE1 4.48Å; P35-F146 HydrophobicContact CG-CD1 4.34Å; P35-F146 HydrophobicContact CG-CE1 4.44Å; P35-F146 WeakPolarHBondContact O-CA 3.46Å; V37-F146 HydrophobicContact CG2-CB 4.13Å; V37-F146 HydrophobicContact CG2-CD2 3.96Å; V37-F146 HydrophobicContact CG2-CG 4.36Å; L114-F146 HydrophobicContact CB-CE1 3.83Å; L114-F146 HydrophobicContact CB-CE2 4.45Å; L114-F146 HydrophobicContact CB-CZ 3.79Å; L114-F146 HydrophobicContact CD1-CD1 4.17Å; L114-F146 HydrophobicContact CD1-CD2 3.97Å; L114-F146 HydrophobicContact CD1-CE1 4.17Å; L114-F146 HydrophobicContact CD1-CE2 3.97Å; L114-F146 HydrophobicContact CD1-CG 4.09Å; L114-F146 HydrophobicContact CD1-CZ 4.07Å; T115-F146 HydrophobicContact CG2-CE1 3.92Å; T115-F146 HydrophobicContact CG2-CZ 3.71Å; F140-F146 HydrophobicContact CE1-CD2 4.02Å; F140-F146 HydrophobicContact CE1-CE2 4.03Å; F140-F146 HydrophobicContact CZ-CD2 4.49Å; F140-F146 HydrophobicContact CZ-CE2 4.05Å; A141-F146 HydrophobicContact CB-CB 4.22Å; A141-F146 PolarHBondContact O-N 3.25Å; N144-F146 HydrophobicContact CB-CD1 4.39Å; N144-F146 HydrophobicContact CB-CD2 3.71Å; N144-F146 HydrophobicContact CB-CE1 4.13Å; N144-F146 HydrophobicContact CB-CE2 3.41Å; N144-F146 VanDerWaalsContact CB-CE2 3.41Å; N144-F146 HydrophobicContact CB-CG 4.19Å; N144-F146 HydrophobicContact CB-CZ 3.63Å; N144-F146 WeakPolarHBondContact O-CD1 3.2Å; N144-F146 VanDerWaalsContact O-CE1 3.26Å; N144-F146 WeakPolarHBondContact O-CE1 3.49Å; N144-F146 PolarHBondContact O-N 3.15Å
147	K	97.8	Very high	96.7	Very high	52 Å²	52	44.9 Å²	44.9	23%	0.226	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	153.5	164.9	-65.9	173.5	178.5	171.2	0	109.9	P35 T36 V37 D229	P35-K147 PolarHBondContact O-N 3.36Å; T36-K147 HydrophobicContact CG2-CB 4.23Å; V37-K147 PolarHBondContact N-O 2.71Å; K147-D229 WeakPolarHBondContact CD-OD2 3.49Å; K147-D229 IonicContact NZ-OD2 2.8Å; K147-D229 PolarHBondContact NZ-OD2 3.2Å
148	A	98.4	Very high	96.2	Very high	16 Å²	16	49.5 Å²	49.5	13%	0.132	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.9	172.9	0	0	0	0	0	109.9	V37 L138 A141 F150	V37-A148 WeakPolarHBondContact O-CA 3.36Å; L138-A148 HydrophobicContact CD2-CB 3.9Å; A141-A148 HydrophobicContact CB-CB 4.28Å; A148-F150 HydrophobicContact CB-CE2 4.1Å
149	F	98.8	Very high	95.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	119.1	176.9	-176.1	-116.3	0	0	0	110.1	T36 V37 I38 V39 I151 S211 I213 Q232 I235 V236	T36-F149 HydrophobicContact CG2-CB 4.12Å; V37-F149 PolarHBondContact O-N 2.67Å; I38-F149 CarbonylContact C-O 3.47Å; I38-F149 VanDerWaalsContact CA-O 3.26Å; I38-F149 WeakPolarHBondContact CA-O 3.47Å; V39-F149 PolarHBondContact N-O 2.99Å; F149-I151 HydrophobicContact CD1-CG1 4.18Å; F149-I151 HydrophobicContact CE1-CD1 4.43Å; F149-I151 HydrophobicContact CE1-CG1 4.01Å; F149-S211 WeakPolarHBondContact CA-O 3.3Å; F149-S211 WeakPolarHBondContact CD2-O 3.23Å; F149-I213 HydrophobicContact CE1-CG2 3.91Å; F149-I213 HydrophobicContact CZ-CB 4.19Å; F149-I213 HydrophobicContact CZ-CG2 3.73Å; F149-Q232 HydrophobicContact CB-CG 4.18Å; F149-Q232 HydrophobicContact CD1-CG 4.38Å; F149-Q232 HydrophobicContact CD2-CB 4.26Å; F149-Q232 HydrophobicContact CD2-CG 3.79Å; F149-Q232 HydrophobicContact CE2-CB 4.24Å; F149-Q232 HydrophobicContact CE2-CG 4.28Å; F149-Q232 HydrophobicContact CG-CG 3.86Å; F149-I235 HydrophobicContact CD1-CD1 4.41Å; F149-I235 HydrophobicContact CD1-CG2 4.44Å; F149-I235 HydrophobicContact CE1-CB 4.32Å; F149-I235 HydrophobicContact CE1-CG2 3.81Å; F149-V236 HydrophobicContact CZ-CG2 3.93Å
150	F	98.9	Very high	95.2	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.3	-174.8	-63.1	-100.4	0	0	0	111.4	V39 V41 R134 L138 A148 L201 L210 S211 L212 I213	V39-F150 HydrophobicContact CB-CD1 3.61Å; V39-F150 HydrophobicContact CB-CE1 3.72Å; V39-F150 HydrophobicContact CB-CG 4.27Å; V39-F150 HydrophobicContact CB-CZ 4.45Å; V39-F150 HydrophobicContact CG1-CD1 3.8Å; V39-F150 HydrophobicContact CG1-CE1 3.71Å; V39-F150 HydrophobicContact CG2-CD1 4.35Å; V39-F150 HydrophobicContact CG2-CE1 4.05Å; V39-F150 HydrophobicContact CG2-CZ 4.34Å; V39-F150 WeakPolarHBondContact O-CA 3.39Å; V41-F150 HydrophobicContact CG2-CD1 3.9Å; R134-F150 HydrophobicContact CB-CE1 4.09Å; R134-F150 HydrophobicContact CG-CE1 4.05Å; L138-F150 HydrophobicContact CD1-CZ 4.28Å; L138-F150 HydrophobicContact CD2-CE2 3.79Å; L138-F150 HydrophobicContact CD2-CZ 3.77Å; L138-F150 HydrophobicContact CG-CE2 4.35Å; L138-F150 HydrophobicContact CG-CZ 3.86Å; A148-F150 HydrophobicContact CB-CE2 4.1Å; F150-L201 HydrophobicContact CB-CD1 3.82Å; F150-L201 HydrophobicContact CG-CD1 4.49Å; F150-L210 HydrophobicContact CD2-CB 4.45Å; F150-L210 HydrophobicContact CD2-CD1 4.36Å; F150-L210 HydrophobicContact CE2-CD1 4.05Å; F150-L210 HydrophobicContact CZ-CD1 4.41Å; F150-S211 PolarHBondContact N-O 2.97Å; F150-L212 HydrophobicContact CB-CB 3.8Å; F150-L212 CarbonylContact O-C 3.58Å; F150-L212 VanDerWaalsContact O-CA 3.22Å; F150-L212 WeakPolarHBondContact O-CA 3.48Å; F150-I213 PolarHBondContact O-N 2.71Å
151	I	98.8	Very high	94.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	104.9	171.1	-56.9	174.1	0	0	0	107.5	I38 V39 M40 V41 I51 L55 F149 I213 V215 I235 L239	I38-I151 HydrophobicContact CG2-CD1 3.44Å; I38-I151 VanDerWaalsContact CG2-CD1 3.44Å; I38-I151 HydrophobicContact CG2-CG1 3.9Å; V39-I151 PolarHBondContact O-N 3.29Å; M40-I151 CarbonylContact C-O 3.56Å; M40-I151 WeakPolarHBondContact CA-O 3.32Å; M40-I151 HydrophobicContact CE-CB 3.98Å; M40-I151 HydrophobicContact CE-CG2 3.81Å; M40-I151 HydrophobicContact SD-CB 3.92Å; M40-I151 HydrophobicContact SD-CD1 4.22Å; M40-I151 HydrophobicContact SD-CG2 4.36Å; V41-I151 PolarHBondContact N-O 3.15Å; I51-I151 HydrophobicContact CG2-CG2 4.36Å; L55-I151 HydrophobicContact CD2-CD1 3.79Å; F149-I151 HydrophobicContact CD1-CG1 4.18Å; F149-I151 HydrophobicContact CE1-CD1 4.43Å; F149-I151 HydrophobicContact CE1-CG1 4.01Å; I151-I213 WeakPolarHBondContact CA-O 3.36Å; I151-I213 HydrophobicContact CB-CG2 4.2Å; I151-I213 HydrophobicContact CG1-CG2 3.75Å; I151-I213 HydrophobicContact CG2-CG2 4.14Å; I151-V215 HydrophobicContact CG2-CG2 4.43Å; I151-I235 HydrophobicContact CD1-CG2 4.05Å; I151-L239 HydrophobicContact CD1-CD1 4.06Å; I151-L239 HydrophobicContact CG1-CD1 4.4Å; I151-L239 HydrophobicContact CG2-CD1 4.15Å
152	E	98.7	Very high	94.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.5	175.4	-172.4	173.6	-125.5	0	0	110.6	V41 V154 Y198 P200 L201 I213 K214 V215	V41-E152 HydrophobicContact CB-CB 3.89Å; V41-E152 HydrophobicContact CB-CG 3.92Å; V41-E152 HydrophobicContact CG1-CB 4.32Å; V41-E152 HydrophobicContact CG1-CG 3.87Å; V41-E152 WeakPolarHBondContact CG1-OE1 3.21Å; V41-E152 VanDerWaalsContact O-CA 3.31Å; V41-E152 WeakPolarHBondContact O-CA 3.41Å; E152-V154 HydrophobicContact CG-CG2 3.91Å; E152-Y198 PolarHBondContact OE1-OH 3.06Å; E152-P200 VanDerWaalsContact OE1-CA 3.29Å; E152-P200 WeakPolarHBondContact OE1-CA 3.49Å; E152-L201 HydrophobicContact CB-CD1 3.76Å; E152-L201 PolarHBondContact OE1-N 2.88Å; E152-L201 WeakPolarHBondContact OE2-CB 3.17Å; E152-L201 PolarHBondContact OE2-N 3.24Å; E152-I213 PolarHBondContact N-O 3.42Å; E152-K214 HydrophobicContact CB-CG 4.19Å; E152-K214 CarbonylContact O-C 3.49Å; E152-K214 WeakPolarHBondContact O-CA 3.33Å; E152-K214 VanDerWaalsContact OE2-CE 3.3Å; E152-K214 WeakPolarHBondContact OE2-CE 3.46Å; E152-K214 WeakPolarHBondContact OE2-CG 3.49Å; E152-K214 IonicContact OE2-NZ 3.43Å; E152-K214 PolarHBondContact OE2-NZ 3.31Å; E152-V215 PolarHBondContact O-N 2.64Å
153	S	96.9	Very high	93.7	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.2	173	-174.6	0	0	0	0	110.2	V41 R46	V41-S153 PolarHBondContact O-N 3.17Å; R46-S153 WeakPolarHBondContact O-CB 3.27Å; R46-S153 PolarHBondContact O-OG 3.35Å
154	V	96.1	Very high	93	Very high	27 Å²	27	40.6 Å²	40.6	16%	0.164	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.9	179.6	-172.7	0	0	0	0	108.3	E152 V215 I216 D217	E152-V154 HydrophobicContact CG-CG2 3.91Å; V154-V215 PolarHBondContact N-O 2.74Å; V154-I216 HydrophobicContact CB-CG1 4.49Å; V154-I216 CarbonylContact O-C 3.5Å; V154-I216 WeakPolarHBondContact O-CA 3.46Å; V154-D217 PolarHBondContact O-N 3.33Å
155	C	91.8	Very high	92.5	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.027	23%	0.233	C	C	.	.			trans	-152	119.9	175.7	-178.4	0	0	0	0	107.8	R46	R46-C155 WeakPolarHBondContact CD-O 3.17Å; R46-C155 PolarHBondContact NE-O 2.72Å; R46-C155 PolarHBondContact NH2-O 2.83Å
156	D	87.6	Confident	91.9	Very high	124 Å²	124	37.9 Å²	37.9	66%	0.663	22%	0.223	S	C	*	.			trans	-104.8	-3.7	-179.2	-60.6	-32.7	0	0	0	112	P158	D156-P158 VanDerWaalsContact O-CD 3.27Å; D156-P158 WeakPolarHBondContact O-CD 3.48Å
157	D	89.3	Confident	91.1	Very high	69 Å²	69	41.9 Å²	41.9	37%	0.369	24%	0.242	S	C	.	.			trans	-69.6	111.1	175	-174.3	-23.4	0	0	0	111.6	T159 V160 V161	D157-T159 PolarHBondContact O-N 2.95Å; D157-T159 WeakPolarHBondContact OD1-CA 3.32Å; D157-T159 WeakPolarHBondContact OD1-CB 3.44Å; D157-T159 PolarHBondContact OD1-N 3.17Å; D157-T159 PolarHBondContact OD1-OG1 3Å; D157-T159 VanDerWaalsContact OD1-OG1 3.1Å; D157-V160 HydrophobicContact CB-CB 4.24Å; D157-V160 HydrophobicContact CB-CG2 4Å; D157-V160 PolarHBondContact O-N 2.86Å; D157-V161 WeakPolarHBondContact O-CG2 3.41Å; D157-V161 PolarHBondContact O-N 2.92Å
158	P	88.8	Confident	90.3	Very high	97 Å²	97	40.3 Å²	40.3	63%	0.63	24%	0.237	S	C	*	.	H	α-helix	trans	-63.8	-26.7	-177.7	27.4	-35.1	0	0	0	113.1	D156 V161 A162	D156-P158 VanDerWaalsContact O-CD 3.27Å; D156-P158 WeakPolarHBondContact O-CD 3.48Å; P158-V161 PolarHBondContact O-N 3.37Å; P158-A162 WeakPolarHBondContact O-CB 3.42Å; P158-A162 PolarHBondContact O-N 2.85Å
159	T	89.2	Confident	89.5	Confident	101 Å²	101	41.4 Å²	41.4	62%	0.62	24%	0.238	S	C	*	.	H	α-helix	trans	-67	-44.9	178.9	-44.5	0	0	0	0	110.5	D157 V161 A162 S163	D157-T159 PolarHBondContact O-N 2.95Å; D157-T159 WeakPolarHBondContact OD1-CA 3.32Å; D157-T159 WeakPolarHBondContact OD1-CB 3.44Å; D157-T159 PolarHBondContact OD1-N 3.17Å; D157-T159 PolarHBondContact OD1-OG1 3Å; D157-T159 VanDerWaalsContact OD1-OG1 3.1Å; T159-V161 VanDerWaalsContact C-N 3.33Å; T159-A162 PolarHBondContact O-N 2.8Å; T159-S163 WeakPolarHBondContact O-CB 3.36Å; T159-S163 PolarHBondContact O-N 2.96Å
160	V	86.4	Confident	88.7	Confident	37 Å²	37	43.1 Å²	43.1	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-41.9	176	173.5	0	0	0	0	110.5	D157 S163 N164 V218	D157-V160 HydrophobicContact CB-CB 4.24Å; D157-V160 HydrophobicContact CB-CG2 4Å; D157-V160 PolarHBondContact O-N 2.86Å; V160-S163 PolarHBondContact O-N 3.11Å; V160-N164 WeakPolarHBondContact O-CB 3.43Å; V160-N164 PolarHBondContact O-N 3.34Å; V160-N164 PolarHBondContact O-ND2 2.99Å; V160-V218 HydrophobicContact CB-CG2 4.48Å; V160-V218 HydrophobicContact CG1-CG2 3.62Å; V160-V218 HydrophobicContact CG2-CG2 4.17Å
161	V	87.3	Confident	87.9	Confident	8 Å²	8	47.2 Å²	47.2	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-49.1	177.9	179.5	0	0	0	0	111	A45 R46 D157 P158 T159 S163 N164 I165 I191	A45-V161 HydrophobicContact CB-CG1 4.24Å; R46-V161 VanDerWaalsContact NH1-CG1 3.31Å; D157-V161 WeakPolarHBondContact O-CG2 3.41Å; D157-V161 PolarHBondContact O-N 2.92Å; P158-V161 PolarHBondContact O-N 3.37Å; T159-V161 VanDerWaalsContact C-N 3.33Å; V161-S163 PolarHBondContact O-N 3.08Å; V161-N164 PolarHBondContact O-N 2.78Å; V161-I165 HydrophobicContact CG1-CD1 3.89Å; V161-I165 VanDerWaalsContact O-CG1 3.28Å; V161-I165 WeakPolarHBondContact O-CG1 3.44Å; V161-I165 PolarHBondContact O-N 3.38Å; V161-I191 HydrophobicContact CG1-CD1 4.05Å
162	A	87.2	Confident	87.3	Confident	42 Å²	42	48.2 Å²	48.2	35%	0.347	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-46.1	178.4	0	0	0	0	0	111.3	P158 T159 N164 I165 M166	P158-A162 WeakPolarHBondContact O-CB 3.42Å; P158-A162 PolarHBondContact O-N 2.85Å; T159-A162 PolarHBondContact O-N 2.8Å; A162-N164 PolarHBondContact O-N 3.29Å; A162-I165 PolarHBondContact O-N 3.47Å; A162-M166 WeakPolarHBondContact O-CG 3.39Å; A162-M166 PolarHBondContact O-N 3.35Å
163	S	86.3	Confident	86.7	Confident	64 Å²	64	52.4 Å²	52.4	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-57.9	-47.4	175.8	177	0	0	0	0	111.8	T159 V160 V161 I165 M166 E167	T159-S163 WeakPolarHBondContact O-CB 3.36Å; T159-S163 PolarHBondContact O-N 2.96Å; V160-S163 PolarHBondContact O-N 3.11Å; V161-S163 PolarHBondContact O-N 3.08Å; S163-I165 VanDerWaalsContact C-N 3.31Å; S163-I165 PolarHBondContact O-N 3.2Å; S163-M166 PolarHBondContact O-N 3.25Å; S163-E167 WeakPolarHBondContact O-CB 3.34Å; S163-E167 PolarHBondContact O-N 3.32Å
164	N	84.9	Confident	86.3	Confident	35 Å²	35	52.6 Å²	52.6	19%	0.187	31%	0.311	C	S	.	.	H	α-helix	trans	-61.5	-36.5	176.6	-74.2	-28	0	0	0	112.8	A45 V160 V161 A162 V168	A45-N164 HydrophobicContact CB-CB 4.29Å; A45-N164 PolarHBondContact O-ND2 2.92Å; V160-N164 WeakPolarHBondContact O-CB 3.43Å; V160-N164 PolarHBondContact O-N 3.34Å; V160-N164 PolarHBondContact O-ND2 2.99Å; V161-N164 PolarHBondContact O-N 2.78Å; A162-N164 PolarHBondContact O-N 3.29Å; N164-V168 WeakPolarHBondContact O-CG2 3.46Å; N164-V168 PolarHBondContact O-N 3.04Å
165	I	84.8	Confident	86	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.7	-47.6	177.3	-65.2	165.5	0	0	0	109.8	A45 V161 A162 S163 E167 K169 I170 M184 F187 M188 I191	A45-I165 HydrophobicContact CB-CD1 4.29Å; A45-I165 HydrophobicContact CB-CG1 3.59Å; V161-I165 HydrophobicContact CG1-CD1 3.89Å; V161-I165 VanDerWaalsContact O-CG1 3.28Å; V161-I165 WeakPolarHBondContact O-CG1 3.44Å; V161-I165 PolarHBondContact O-N 3.38Å; A162-I165 PolarHBondContact O-N 3.47Å; S163-I165 VanDerWaalsContact C-N 3.31Å; S163-I165 PolarHBondContact O-N 3.2Å; I165-E167 PolarHBondContact O-N 3.32Å; I165-K169 HydrophobicContact CG2-CB 4.18Å; I165-K169 WeakPolarHBondContact O-CA 3.48Å; I165-K169 WeakPolarHBondContact O-CB 3.48Å; I165-K169 PolarHBondContact O-N 3.3Å; I165-I170 HydrophobicContact CG2-CG2 4.13Å; I165-I170 PolarHBondContact O-N 3.25Å; I165-M184 HydrophobicContact CB-CE 3.75Å; I165-M184 HydrophobicContact CB-SD 3.97Å; I165-M184 HydrophobicContact CD1-SD 3.82Å; I165-M184 HydrophobicContact CG2-CE 3.49Å; I165-M184 VanDerWaalsContact CG2-CE 3.49Å; I165-M184 HydrophobicContact CG2-SD 3.54Å; I165-M184 VanDerWaalsContact CG2-SD 3.54Å; I165-F187 HydrophobicContact CD1-CD1 3.74Å; I165-F187 HydrophobicContact CD1-CE1 4.4Å; I165-F187 HydrophobicContact CG1-CD1 3.67Å; I165-F187 HydrophobicContact CG1-CE1 4.01Å; I165-F187 HydrophobicContact CG1-CG 4.41Å; I165-F187 HydrophobicContact CG2-CB 4.2Å; I165-F187 HydrophobicContact CG2-CD1 4.32Å; I165-F187 HydrophobicContact CG2-CG 4.25Å; I165-M188 HydrophobicContact CD1-CG 4.47Å; I165-M188 HydrophobicContact CD1-SD 3.7Å; I165-I191 HydrophobicContact CD1-CD1 4.02Å
166	M	84.6	Confident	85.8	Confident	93 Å²	93	57.7 Å²	57.7	46%	0.458	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-39.4	-179.2	-69.9	-57.3	-67	0	0	113.1	A162 S163 I170 M184	A162-M166 WeakPolarHBondContact O-CG 3.39Å; A162-M166 PolarHBondContact O-N 3.35Å; S163-M166 PolarHBondContact O-N 3.25Å; M166-I170 HydrophobicContact CE-CD1 3.8Å; M166-I170 WeakPolarHBondContact O-CD1 3.24Å; M166-I170 WeakPolarHBondContact O-CG1 3.12Å; M166-I170 HydrophobicContact SD-CD1 4.05Å; M166-I170 HydrophobicContact SD-CG2 4.45Å; M166-M184 HydrophobicContact CG-CE 3.51Å; M166-M184 HydrophobicContact SD-CE 3.26Å; M166-M184 WeakPolarHBondContact SD-CE 3.4Å
167	E	80.3	Confident	85.8	Confident	101 Å²	101	57.3 Å²	57.3	47%	0.472	33%	0.328	S	S	.	.	H	α-helix	trans	-76.1	-41.2	-176	-166.1	-174	160.9	0	0	111.9	S163 I165 A424	S163-E167 WeakPolarHBondContact O-CB 3.34Å; S163-E167 PolarHBondContact O-N 3.32Å; I165-E167 PolarHBondContact O-N 3.32Å; E167-A424 PolarHBondContact OE1-N 3.37Å
168	V	81	Confident	85.8	Confident	20 Å²	20	56.5 Å²	56.5	12%	0.121	33%	0.327	C	S	.	.	H	α-helix	trans	-130.2	-9.6	-165.1	-54.8	0	0	0	0	116.6	N164 A424 Y425	N164-V168 WeakPolarHBondContact O-CG2 3.46Å; N164-V168 PolarHBondContact O-N 3.04Å; V168-A424 HydrophobicContact CG1-CB 3.3Å; V168-Y425 HydrophobicContact CB-CE2 4.07Å; V168-Y425 WeakPolarHBondContact CB-OH 3.5Å; V168-Y425 HydrophobicContact CG1-CE2 4.34Å
169	K	82.4	Confident	86	Confident	38 Å²	38	55.7 Å²	55.7	17%	0.165	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-37.7	-176.1	-57.1	-54.1	176.4	-160.9	0	112.8	I165 S171 S172 Y175 F187 Y425	I165-K169 HydrophobicContact CG2-CB 4.18Å; I165-K169 WeakPolarHBondContact O-CA 3.48Å; I165-K169 WeakPolarHBondContact O-CB 3.48Å; I165-K169 PolarHBondContact O-N 3.3Å; K169-S171 PolarHBondContact O-N 3.26Å; K169-S172 WeakPolarHBondContact O-CB 3.25Å; K169-S172 PolarHBondContact O-N 3.05Å; K169-Y175 VanDerWaalsContact O-CD2 3.28Å; K169-Y175 WeakPolarHBondContact O-CD2 3.1Å; K169-F187 HydrophobicContact CB-CD2 3.96Å; K169-F187 HydrophobicContact CB-CE2 3.73Å; K169-F187 HydrophobicContact CB-CZ 4.08Å; K169-F187 HydrophobicContact CD-CE2 4.04Å; K169-F187 HydrophobicContact CD-CZ 3.97Å; K169-F187 HydrophobicContact CG-CD2 4.46Å; K169-F187 HydrophobicContact CG-CE1 4.22Å; K169-F187 HydrophobicContact CG-CE2 3.8Å; K169-F187 HydrophobicContact CG-CZ 3.66Å; K169-Y425 PolarHBondContact NZ-OH 3.13Å; K169-Y425 VanDerWaalsContact NZ-OH 3.12Å
170	I	81.9	Confident	86	Confident	37 Å²	37	54.1 Å²	54.1	19%	0.19	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.6	174	64.9	174.3	0	0	0	112.3	I165 M166 S172 A183	I165-I170 HydrophobicContact CG2-CG2 4.13Å; I165-I170 PolarHBondContact O-N 3.25Å; M166-I170 HydrophobicContact CE-CD1 3.8Å; M166-I170 WeakPolarHBondContact O-CD1 3.24Å; M166-I170 WeakPolarHBondContact O-CG1 3.12Å; M166-I170 HydrophobicContact SD-CD1 4.05Å; M166-I170 HydrophobicContact SD-CG2 4.45Å; I170-S172 VanDerWaalsContact C-N 3.25Å; I170-S172 PolarHBondContact O-N 3.05Å; I170-A183 HydrophobicContact CB-CB 4.4Å; I170-A183 HydrophobicContact CG2-CB 4.04Å
171	S	82.4	Confident	86.2	Confident	87 Å²	87	55.8 Å²	55.8	61%	0.608	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	3.6	174.4	57.5	0	0	0	0	113.6	K169	K169-S171 PolarHBondContact O-N 3.26Å
172	S	85.6	Confident	86.4	Confident	20 Å²	20	60.5 Å²	60.5	14%	0.14	35%	0.35	C	S	.	.	S	Bend	trans	-66.5	146.2	175.5	179.2	0	0	0	0	110.9	K169 I170 D174 Y175	K169-S172 WeakPolarHBondContact O-CB 3.25Å; K169-S172 PolarHBondContact O-N 3.05Å; I170-S172 VanDerWaalsContact C-N 3.25Å; I170-S172 PolarHBondContact O-N 3.05Å; S172-D174 PolarHBondContact O-N 3.42Å; S172-D174 PolarHBondContact OG-N 3.23Å; S172-Y175 PolarHBondContact O-N 3.14Å
173	P	86.4	Confident	86.6	Confident	89 Å²	89	58.6 Å²	58.6	58%	0.578	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-55.6	-21.1	171.8	-25.6	34.2	0	0	0	114.5	Y175	P173-Y175 PolarHBondContact O-N 3.19Å
174	D	87.6	Confident	86.9	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.064	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.3	-28.3	174	-71.1	-40.1	0	0	0	112.8	R75 R76 Y82 S172 R190	R75-D174 IonicContact CZ-OD1 3.97Å; R75-D174 IonicContact CZ-OD2 3.5Å; R75-D174 IonicContact NH1-OD1 3.32Å; R75-D174 PolarHBondContact NH1-OD1 3.16Å; R75-D174 IonicContact NH1-OD2 3.38Å; R75-D174 IonicContact NH2-OD1 2.82Å; R75-D174 PolarHBondContact NH2-OD1 2.74Å; R75-D174 IonicContact NH2-OD2 3.4Å; R75-D174 PolarHBondContact NH2-OD2 2.91Å; R76-D174 WeakPolarHBondContact CD-OD1 3.49Å; R76-D174 WeakPolarHBondContact CG-OD1 3.41Å; R76-D174 IonicContact NH1-OD2 3.16Å; Y82-D174 HydrophobicContact CD1-CB 3.95Å; Y82-D174 VanDerWaalsContact CD1-O 3.26Å; Y82-D174 WeakPolarHBondContact CD1-O 3.49Å; Y82-D174 HydrophobicContact CG-CB 4.07Å; S172-D174 PolarHBondContact O-N 3.42Å; S172-D174 PolarHBondContact OG-N 3.23Å; D174-R190 IonicContact OD2-NH1 3.15Å
175	Y	90.5	Very high	87.2	Confident	5 Å²	5	59.6 Å²	59.6	2%	0.02	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-115	19.5	-173	-63.8	-76.4	0	0	0	113.1	Y82 K169 S172 P173 D177 C178 A183 D186 F187	Y82-Y175 HydrophobicContact CD1-CE1 4.48Å; Y82-Y175 HydrophobicContact CE1-CD1 4.48Å; Y82-Y175 AromaticContact CE1-CE1 3.77Å; Y82-Y175 HydrophobicContact CE1-CE1 3.77Å; Y82-Y175 AromaticContact CE1-CZ 3.87Å; K169-Y175 VanDerWaalsContact O-CD2 3.28Å; K169-Y175 WeakPolarHBondContact O-CD2 3.1Å; S172-Y175 PolarHBondContact O-N 3.14Å; P173-Y175 PolarHBondContact O-N 3.19Å; Y175-D177 PolarHBondContact O-N 2.8Å; Y175-D177 VanDerWaalsContact O-N 3.12Å; Y175-C178 HydrophobicContact CD1-CB 4.33Å; Y175-C178 PolarHBondContact O-N 2.58Å; Y175-A183 HydrophobicContact CD1-CB 3.54Å; Y175-A183 HydrophobicContact CE1-CB 4.22Å; Y175-A183 HydrophobicContact CG-CB 3.79Å; Y175-D186 HydrophobicContact CE1-CB 3.97Å; Y175-D186 VanDerWaalsContact CE1-OD2 3.23Å; Y175-D186 WeakPolarHBondContact CE1-OD2 3.22Å; Y175-D186 PolarHBondContact OH-OD2 3.38Å; Y175-F187 AromaticContact CE2-CD2 3.68Å; Y175-F187 HydrophobicContact CE2-CD2 3.68Å; Y175-F187 HydrophobicContact CE2-CE2 4.33Å; Y175-F187 AromaticContact CZ-CD2 3.83Å; Y175-F187 WeakPolarHBondContact OH-CD2 3.4Å
176	K	87.7	Confident	87.7	Confident	133 Å²	133	60.4 Å²	60.4	58%	0.578	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.9	-177.8	68.6	179.6	-176.5	-178.2	0	113.9
177	D	87.6	Confident	88.1	Confident	116 Å²	116	56.3 Å²	56.3	62%	0.62	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	11.1	-176.7	-54.6	-49.5	0	0	0	112.3	Q81 Y175	Q81-D177 PolarHBondContact NE2-OD2 3.43Å; Y175-D177 PolarHBondContact O-N 2.8Å; Y175-D177 VanDerWaalsContact O-N 3.12Å
178	C	89.1	Confident	88.7	Confident	52 Å²	52	55.2 Å²	55.2	35%	0.351	31%	0.313	S	S	.	.	S	Bend	trans	-115.4	147.2	-178.2	-60.1	0	0	0	0	110.8	Y175 E182 A183	Y175-C178 HydrophobicContact CD1-CB 4.33Å; Y175-C178 PolarHBondContact O-N 2.58Å; C178-E182 HydrophobicContact CB-CB 4.44Å; C178-A183 HydrophobicContact CB-CB 4.16Å
179	N	92.2	Very high	89.4	Confident	80 Å²	80	57.8 Å²	57.8	43%	0.428	32%	0.323	S	S	.	.			trans	-77	166	165.9	68.1	57.2	0	0	0	111.2	A181 E182 A183	N179-A181 VanDerWaalsContact C-N 3.27Å; N179-A181 PolarHBondContact O-N 3.14Å; N179-A181 PolarHBondContact OD1-N 2.66Å; N179-A181 VanDerWaalsContact OD1-N 3.09Å; N179-E182 PolarHBondContact N-OE2 3.45Å; N179-E182 PolarHBondContact ND2-OE1 3Å; N179-E182 PolarHBondContact ND2-OE2 2.93Å; N179-E182 PolarHBondContact O-N 2.8Å; N179-E182 WeakPolarHBondContact OD1-CG 3Å; N179-E182 PolarHBondContact OD1-N 3.28Å; N179-A183 WeakPolarHBondContact O-CB 3.21Å; N179-A183 PolarHBondContact O-N 2.72Å
180	S	90.1	Very high	90	Very high	67 Å²	67	57.5 Å²	57.5	47%	0.469	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-33.7	-175.5	-54	0	0	0	0	113.9	M184	S180-M184 VanDerWaalsContact O-CB 3.27Å; S180-M184 WeakPolarHBondContact O-CB 3.41Å; S180-M184 PolarHBondContact O-N 3.33Å
181	A	90.8	Very high	90.5	Very high	73 Å²	73	55.9 Å²	55.9	60%	0.603	31%	0.313	S	S	*	.	H	α-helix	trans	-73.5	-45.5	-178.8	0	0	0	0	0	111.5	N179 M184 D185	N179-A181 VanDerWaalsContact C-N 3.27Å; N179-A181 PolarHBondContact O-N 3.14Å; N179-A181 PolarHBondContact OD1-N 2.66Å; N179-A181 VanDerWaalsContact OD1-N 3.09Å; A181-M184 PolarHBondContact O-N 3.18Å; A181-D185 PolarHBondContact O-N 2.98Å
182	E	91.8	Very high	91.1	Very high	106 Å²	106	55.8 Å²	55.8	50%	0.495	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.8	-71.9	165.2	-170.3	0	0	111.7	C178 N179 M184 D185 D186	C178-E182 HydrophobicContact CB-CB 4.44Å; N179-E182 PolarHBondContact N-OE2 3.45Å; N179-E182 PolarHBondContact ND2-OE1 3Å; N179-E182 PolarHBondContact ND2-OE2 2.93Å; N179-E182 PolarHBondContact O-N 2.8Å; N179-E182 WeakPolarHBondContact OD1-CG 3Å; N179-E182 PolarHBondContact OD1-N 3.28Å; E182-M184 VanDerWaalsContact C-N 3.32Å; E182-M184 PolarHBondContact O-N 2.64Å; E182-D185 PolarHBondContact O-N 3.37Å; E182-D186 WeakPolarHBondContact O-CB 3.36Å; E182-D186 PolarHBondContact O-N 3.08Å
183	A	91.6	Very high	91.5	Very high	2 Å²	2	55.6 Å²	55.6	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-40.9	177.6	0	0	0	0	0	111.7	I170 Y175 C178 N179 F187	I170-A183 HydrophobicContact CB-CB 4.4Å; I170-A183 HydrophobicContact CG2-CB 4.04Å; Y175-A183 HydrophobicContact CD1-CB 3.54Å; Y175-A183 HydrophobicContact CE1-CB 4.22Å; Y175-A183 HydrophobicContact CG-CB 3.79Å; C178-A183 HydrophobicContact CB-CB 4.16Å; N179-A183 WeakPolarHBondContact O-CB 3.21Å; N179-A183 PolarHBondContact O-N 2.72Å; A183-F187 VanDerWaalsContact O-CB 3.23Å; A183-F187 WeakPolarHBondContact O-CB 3.11Å; A183-F187 PolarHBondContact O-N 3.1Å
184	M	90.9	Very high	91.9	Very high	41 Å²	41	52.4 Å²	52.4	20%	0.202	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-49.8	175.6	178.3	62.7	70.8	0	0	111.6	I165 M166 S180 A181 E182 F187 M188	I165-M184 HydrophobicContact CB-CE 3.75Å; I165-M184 HydrophobicContact CB-SD 3.97Å; I165-M184 HydrophobicContact CD1-SD 3.82Å; I165-M184 HydrophobicContact CG2-CE 3.49Å; I165-M184 VanDerWaalsContact CG2-CE 3.49Å; I165-M184 HydrophobicContact CG2-SD 3.54Å; I165-M184 VanDerWaalsContact CG2-SD 3.54Å; M166-M184 HydrophobicContact CG-CE 3.51Å; M166-M184 HydrophobicContact SD-CE 3.26Å; M166-M184 WeakPolarHBondContact SD-CE 3.4Å; S180-M184 VanDerWaalsContact O-CB 3.27Å; S180-M184 WeakPolarHBondContact O-CB 3.41Å; S180-M184 PolarHBondContact O-N 3.33Å; A181-M184 PolarHBondContact O-N 3.18Å; E182-M184 VanDerWaalsContact C-N 3.32Å; E182-M184 PolarHBondContact O-N 2.64Å; M184-F187 PolarHBondContact O-N 3.28Å; M184-M188 WeakPolarHBondContact O-CG 3.32Å; M184-M188 PolarHBondContact O-N 2.8Å; M184-M188 HydrophobicContact SD-CG 4.26Å
185	D	92.8	Very high	92.2	Very high	80 Å²	80	56.3 Å²	56.3	43%	0.428	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-47.4	179.1	173.6	68.7	0	0	0	112	A181 E182 F187 M188 K189	A181-D185 PolarHBondContact O-N 2.98Å; E182-D185 PolarHBondContact O-N 3.37Å; D185-F187 VanDerWaalsContact C-N 3.33Å; D185-F187 PolarHBondContact O-N 2.98Å; D185-M188 PolarHBondContact O-N 3.24Å; D185-K189 WeakPolarHBondContact O-CG 3.23Å; D185-K189 PolarHBondContact O-N 3.3Å; D185-K189 VanDerWaalsContact OD1-CE 3.27Å; D185-K189 WeakPolarHBondContact OD1-CE 3.38Å; D185-K189 IonicContact OD1-NZ 3.51Å; D185-K189 PolarHBondContact OD1-NZ 3.4Å; D185-K189 VanDerWaalsContact OD2-CE 3.31Å; D185-K189 WeakPolarHBondContact OD2-CE 3.49Å; D185-K189 IonicContact OD2-NZ 2.74Å; D185-K189 PolarHBondContact OD2-NZ 3.28Å
186	D	94.5	Very high	92.1	Very high	17 Å²	17	60.4 Å²	60.4	9%	0.091	33%	0.333	C	S	.	.	H	α-helix	trans	-60	-43.3	175.4	-179.2	83	0	0	0	111.7	Y82 S84 Y85 Y175 E182 M188 K189 R190	Y82-D186 WeakPolarHBondContact CE1-OD2 3.13Å; Y82-D186 PolarHBondContact OH-OD2 2.79Å; S84-D186 VanDerWaalsContact CA-OD1 3.26Å; S84-D186 WeakPolarHBondContact CA-OD1 3.41Å; Y85-D186 WeakPolarHBondContact CD1-OD1 3.44Å; Y85-D186 PolarHBondContact N-OD1 2.83Å; Y175-D186 HydrophobicContact CE1-CB 3.97Å; Y175-D186 VanDerWaalsContact CE1-OD2 3.23Å; Y175-D186 WeakPolarHBondContact CE1-OD2 3.22Å; Y175-D186 PolarHBondContact OH-OD2 3.38Å; E182-D186 WeakPolarHBondContact O-CB 3.36Å; E182-D186 PolarHBondContact O-N 3.08Å; D186-M188 PolarHBondContact O-N 3.18Å; D186-K189 PolarHBondContact O-N 3.44Å; D186-R190 WeakPolarHBondContact O-CB 3.34Å; D186-R190 PolarHBondContact O-N 3.2Å
187	F	93.6	Very high	92.2	Very high	7 Å²	7	56.3 Å²	56.3	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-67.1	-36.7	-179.3	-157.3	-82	0	0	0	112.3	P44 A45 I165 K169 Y175 A183 M184 D185 R190 I191	P44-F187 HydrophobicContact CB-CE1 3.74Å; P44-F187 HydrophobicContact CB-CZ 3.78Å; A45-F187 HydrophobicContact CB-CE1 3.69Å; A45-F187 HydrophobicContact CB-CZ 4.41Å; I165-F187 HydrophobicContact CD1-CD1 3.74Å; I165-F187 HydrophobicContact CD1-CE1 4.4Å; I165-F187 HydrophobicContact CG1-CD1 3.67Å; I165-F187 HydrophobicContact CG1-CE1 4.01Å; I165-F187 HydrophobicContact CG1-CG 4.41Å; I165-F187 HydrophobicContact CG2-CB 4.2Å; I165-F187 HydrophobicContact CG2-CD1 4.32Å; I165-F187 HydrophobicContact CG2-CG 4.25Å; K169-F187 HydrophobicContact CB-CD2 3.96Å; K169-F187 HydrophobicContact CB-CE2 3.73Å; K169-F187 HydrophobicContact CB-CZ 4.08Å; K169-F187 HydrophobicContact CD-CE2 4.04Å; K169-F187 HydrophobicContact CD-CZ 3.97Å; K169-F187 HydrophobicContact CG-CD2 4.46Å; K169-F187 HydrophobicContact CG-CE1 4.22Å; K169-F187 HydrophobicContact CG-CE2 3.8Å; K169-F187 HydrophobicContact CG-CZ 3.66Å; Y175-F187 AromaticContact CE2-CD2 3.68Å; Y175-F187 HydrophobicContact CE2-CD2 3.68Å; Y175-F187 HydrophobicContact CE2-CE2 4.33Å; Y175-F187 AromaticContact CZ-CD2 3.83Å; Y175-F187 WeakPolarHBondContact OH-CD2 3.4Å; A183-F187 VanDerWaalsContact O-CB 3.23Å; A183-F187 WeakPolarHBondContact O-CB 3.11Å; A183-F187 PolarHBondContact O-N 3.1Å; M184-F187 PolarHBondContact O-N 3.28Å; D185-F187 VanDerWaalsContact C-N 3.33Å; D185-F187 PolarHBondContact O-N 2.98Å; F187-R190 WeakPolarHBondContact O-CB 3.2Å; F187-R190 PolarHBondContact O-N 2.81Å; F187-I191 HydrophobicContact CD1-CD1 3.83Å; F187-I191 HydrophobicContact CD1-CG1 4.1Å; F187-I191 HydrophobicContact CE1-CD1 3.93Å; F187-I191 HydrophobicContact CE1-CG1 4.04Å; F187-I191 WeakPolarHBondContact O-CG1 3.43Å; F187-I191 PolarHBondContact O-N 2.85Å
188	M	92.4	Very high	92.7	Very high	78 Å²	78	53.1 Å²	53.1	38%	0.384	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-46.1	173.7	-73.1	-59.1	-64.1	0	0	111.3	I165 M184 D185 D186 R190 I191 N192	I165-M188 HydrophobicContact CD1-CG 4.47Å; I165-M188 HydrophobicContact CD1-SD 3.7Å; M184-M188 WeakPolarHBondContact O-CG 3.32Å; M184-M188 PolarHBondContact O-N 2.8Å; M184-M188 HydrophobicContact SD-CG 4.26Å; D185-M188 PolarHBondContact O-N 3.24Å; D186-M188 PolarHBondContact O-N 3.18Å; M188-R190 VanDerWaalsContact C-N 3.26Å; M188-R190 PolarHBondContact O-N 3.28Å; M188-I191 WeakPolarHBondContact O-CB 3Å; M188-I191 PolarHBondContact O-N 2.8Å; M188-I191 HydrophobicContact SD-CD1 4.06Å; M188-N192 PolarHBondContact O-N 3.44Å; M188-N192 VanDerWaalsContact O-N 3.1Å; M188-N192 PolarHBondContact O-OD1 2.9Å
189	K	94.8	Very high	93.1	Very high	74 Å²	74	54.3 Å²	54.3	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-36.6	174.2	-69.1	170.4	-178.4	163.9	0	112.1	Y85 D185 D186 N192 C193	Y85-K189 HydrophobicContact CD1-CB 3.74Å; Y85-K189 HydrophobicContact CD1-CD 3.86Å; Y85-K189 HydrophobicContact CD1-CG 4.44Å; Y85-K189 HydrophobicContact CD2-CB 3.67Å; Y85-K189 HydrophobicContact CE1-CB 4.06Å; Y85-K189 HydrophobicContact CE1-CD 3.5Å; Y85-K189 HydrophobicContact CE1-CG 4.36Å; Y85-K189 HydrophobicContact CE2-CB 3.97Å; Y85-K189 HydrophobicContact CE2-CD 4.49Å; Y85-K189 HydrophobicContact CG-CB 3.54Å; D185-K189 WeakPolarHBondContact O-CG 3.23Å; D185-K189 PolarHBondContact O-N 3.3Å; D185-K189 VanDerWaalsContact OD1-CE 3.27Å; D185-K189 WeakPolarHBondContact OD1-CE 3.38Å; D185-K189 IonicContact OD1-NZ 3.51Å; D185-K189 PolarHBondContact OD1-NZ 3.4Å; D185-K189 VanDerWaalsContact OD2-CE 3.31Å; D185-K189 WeakPolarHBondContact OD2-CE 3.49Å; D185-K189 IonicContact OD2-NZ 2.74Å; D185-K189 PolarHBondContact OD2-NZ 3.28Å; D186-K189 PolarHBondContact O-N 3.44Å; K189-N192 PolarHBondContact O-N 3.01Å; K189-C193 PolarHBondContact O-N 2.97Å; K189-C193 PolarHBondContact O-SG 3.49Å
190	R	94.9	Very high	93.3	Very high	32 Å²	32	53.2 Å²	53.2	12%	0.121	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-40.1	172.6	174.2	-179.8	178.8	175.7	2.5	112.1	F88 D174 D186 F187 M188 C193 Y194	F88-R190 HydrophobicContact CB-CG 4.25Å; F88-R190 HydrophobicContact CD2-CB 4.35Å; F88-R190 VanDerWaalsContact CD2-CD 3.47Å; F88-R190 HydrophobicContact CD2-CG 3.53Å; F88-R190 VanDerWaalsContact CE2-CD 3.46Å; F88-R190 HydrophobicContact CE2-CG 4.08Å; F88-R190 HydrophobicContact CG-CG 3.97Å; D174-R190 IonicContact OD2-NH1 3.15Å; D186-R190 WeakPolarHBondContact O-CB 3.34Å; D186-R190 PolarHBondContact O-N 3.2Å; F187-R190 WeakPolarHBondContact O-CB 3.2Å; F187-R190 PolarHBondContact O-N 2.81Å; M188-R190 VanDerWaalsContact C-N 3.26Å; M188-R190 PolarHBondContact O-N 3.28Å; R190-C193 WeakPolarHBondContact O-CB 3.27Å; R190-C193 PolarHBondContact O-N 3.27Å; R190-Y194 HydrophobicContact CG-CE2 4.25Å; R190-Y194 VanDerWaalsContact O-CD2 3.23Å; R190-Y194 WeakPolarHBondContact O-CD2 3.4Å
191	I	94.1	Very high	93.7	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-48.9	174.9	-71.2	165	0	0	0	110	P44 A45 V161 I165 F187 M188 C193 Y194 E195	P44-I191 HydrophobicContact CB-CG1 3.89Å; P44-I191 HydrophobicContact CG-CG1 4.24Å; A45-I191 HydrophobicContact CB-CD1 4.34Å; V161-I191 HydrophobicContact CG1-CD1 4.05Å; I165-I191 HydrophobicContact CD1-CD1 4.02Å; F187-I191 HydrophobicContact CD1-CD1 3.83Å; F187-I191 HydrophobicContact CD1-CG1 4.1Å; F187-I191 HydrophobicContact CE1-CD1 3.93Å; F187-I191 HydrophobicContact CE1-CG1 4.04Å; F187-I191 WeakPolarHBondContact O-CG1 3.43Å; F187-I191 PolarHBondContact O-N 2.85Å; M188-I191 WeakPolarHBondContact O-CB 3Å; M188-I191 PolarHBondContact O-N 2.8Å; M188-I191 HydrophobicContact SD-CD1 4.06Å; I191-C193 PolarHBondContact O-N 2.96Å; I191-C193 VanDerWaalsContact O-N 3.16Å; I191-Y194 PolarHBondContact O-N 3.29Å; I191-E195 HydrophobicContact CG2-CG 4.27Å; I191-E195 PolarHBondContact O-N 3.46Å
192	N	94.1	Very high	94.1	Very high	84 Å²	84	48.7 Å²	48.7	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-57.2	-33.5	-179.6	-60.9	-5.8	0	0	0	112.4	M188 K189 Y194 E195	M188-N192 PolarHBondContact O-N 3.44Å; M188-N192 VanDerWaalsContact O-N 3.1Å; M188-N192 PolarHBondContact O-OD1 2.9Å; K189-N192 PolarHBondContact O-N 3.01Å; N192-Y194 PolarHBondContact O-N 2.89Å; N192-E195 PolarHBondContact O-N 2.97Å
193	C	94.4	Very high	94.3	Very high	16 Å²	16	44.1 Å²	44.1	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-33.1	174.2	-65.1	0	0	0	0	113.2	F88 K189 R190 I191	F88-C193 HydrophobicContact CB-CB 4.34Å; K189-C193 PolarHBondContact O-N 2.97Å; K189-C193 PolarHBondContact O-SG 3.49Å; R190-C193 WeakPolarHBondContact O-CB 3.27Å; R190-C193 PolarHBondContact O-N 3.27Å; I191-C193 PolarHBondContact O-N 2.96Å; I191-C193 VanDerWaalsContact O-N 3.16Å
194	Y	94	Very high	94.5	Very high	22 Å²	22	49.6 Å²	49.6	9%	0.086	27%	0.267	C	S	.	.	H	α-helix	trans	-84.8	-29.4	179	-73.2	-83.6	0	0	0	112.7	P44 F88 R99 T127 R190 I191 N192 A196 S197 Y198	P44-Y194 HydrophobicContact CG-CD2 3.65Å; P44-Y194 HydrophobicContact CG-CE2 3.99Å; P44-Y194 HydrophobicContact CG-CG 4.33Å; F88-Y194 HydrophobicContact CB-CE2 4.09Å; F88-Y194 HydrophobicContact CD1-CE2 4.08Å; F88-Y194 AromaticContact CD1-CZ 3.93Å; F88-Y194 WeakPolarHBondContact CD1-OH 3.46Å; F88-Y194 HydrophobicContact CG-CE2 4.19Å; R99-Y194 PolarHBondContact NH1-OH 3.24Å; T127-Y194 HydrophobicContact CG2-CD1 4.19Å; T127-Y194 HydrophobicContact CG2-CE1 4Å; T127-Y194 WeakPolarHBondContact OG1-CE1 3.22Å; R190-Y194 HydrophobicContact CG-CE2 4.25Å; R190-Y194 VanDerWaalsContact O-CD2 3.23Å; R190-Y194 WeakPolarHBondContact O-CD2 3.4Å; I191-Y194 PolarHBondContact O-N 3.29Å; N192-Y194 PolarHBondContact O-N 2.89Å; Y194-A196 VanDerWaalsContact C-N 3.33Å; Y194-A196 PolarHBondContact O-N 3.22Å; Y194-S197 PolarHBondContact O-N 3.2Å; Y194-S197 PolarHBondContact O-OG 3.47Å; Y194-Y198 WeakPolarHBondContact O-CB 3.43Å; Y194-Y198 PolarHBondContact O-N 2.87Å; Y194-Y198 VanDerWaalsContact O-N 3.08Å
195	E	93.3	Very high	94.8	Very high	94 Å²	94	54.9 Å²	54.9	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-42.8	-178.2	-72.3	178	166.8	0	0	112.2	L43 I191 N192 S197 Y198	L43-E195 HydrophobicContact CD1-CG 3.83Å; L43-E195 HydrophobicContact CD2-CG 4.14Å; I191-E195 HydrophobicContact CG2-CG 4.27Å; I191-E195 PolarHBondContact O-N 3.46Å; N192-E195 PolarHBondContact O-N 2.97Å; E195-S197 PolarHBondContact O-N 3.42Å; E195-Y198 PolarHBondContact O-N 3.45Å; E195-Y198 VanDerWaalsContact O-N 3.13Å
196	A	88.4	Confident	94.9	Very high	92 Å²	92	54.8 Å²	54.8	76%	0.76	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.3	-178.6	0	0	0	0	0	114.4	Y194	Y194-A196 VanDerWaalsContact C-N 3.33Å; Y194-A196 PolarHBondContact O-N 3.22Å
197	S	91.2	Very high	95	Very high	47 Å²	47	54.3 Å²	54.3	33%	0.329	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	6.1	-178.5	60.2	0	0	0	0	113.1	Y194 E195 Q199	Y194-S197 PolarHBondContact O-N 3.2Å; Y194-S197 PolarHBondContact O-OG 3.47Å; E195-S197 PolarHBondContact O-N 3.42Å; S197-Q199 PolarHBondContact O-N 3.5Å
198	Y	97	Very high	95.2	Very high	48 Å²	48	60.9 Å²	60.9	19%	0.188	32%	0.316	C	S	.	.			trans	-72.8	120.9	-177.1	-179.9	-147.8	0	0	0	110.7	L43 T129 E152 Y194 E195 P200	L43-Y198 HydrophobicContact CD1-CD1 4.08Å; L43-Y198 HydrophobicContact CD1-CE1 4.31Å; L43-Y198 HydrophobicContact CD2-CD1 3.93Å; L43-Y198 HydrophobicContact CD2-CG 4.02Å; L43-Y198 HydrophobicContact CG-CD1 3.85Å; L43-Y198 HydrophobicContact CG-CE1 4.04Å; L43-Y198 HydrophobicContact CG-CG 4.37Å; T129-Y198 HydrophobicContact CG2-CD2 3.54Å; T129-Y198 HydrophobicContact CG2-CE2 3.97Å; T129-Y198 HydrophobicContact CG2-CG 4.19Å; E152-Y198 PolarHBondContact OE1-OH 3.06Å; Y194-Y198 WeakPolarHBondContact O-CB 3.43Å; Y194-Y198 PolarHBondContact O-N 2.87Å; Y194-Y198 VanDerWaalsContact O-N 3.08Å; E195-Y198 PolarHBondContact O-N 3.45Å; E195-Y198 VanDerWaalsContact O-N 3.13Å; Y198-P200 HydrophobicContact CD1-CG 4.14Å; Y198-P200 HydrophobicContact CD2-CG 4.47Å; Y198-P200 HydrophobicContact CE1-CB 4.48Å; Y198-P200 HydrophobicContact CE1-CG 3.78Å; Y198-P200 HydrophobicContact CE2-CB 4.31Å; Y198-P200 HydrophobicContact CE2-CG 4.14Å; Y198-P200 HydrophobicContact CG-CG 4.49Å; Y198-P200 WeakPolarHBondContact O-CD 3.37Å
199	Q	97.6	Very high	95.5	Very high	77 Å²	77	62.6 Å²	62.6	36%	0.36	33%	0.327	S	S	.	.			trans	-116.2	92.6	174.1	-64.7	171.4	-38.8	0	0	107.2	T129 R131 R134 S197	T129-Q199 PolarHBondContact O-N 3.32Å; R131-Q199 HydrophobicContact CG-CB 4.07Å; R134-Q199 PolarHBondContact NH1-O 3.13Å; R134-Q199 PolarHBondContact NH2-O 3.27Å; S197-Q199 PolarHBondContact O-N 3.5Å
200	P	97.9	Very high	95.6	Very high	58 Å²	58	60.4 Å²	60.4	38%	0.377	32%	0.319	S	S	.	.			trans	-53.9	155.8	177.5	-22.1	30.6	0	0	0	111.3	E152 Y198	E152-P200 VanDerWaalsContact OE1-CA 3.29Å; E152-P200 WeakPolarHBondContact OE1-CA 3.49Å; Y198-P200 HydrophobicContact CD1-CG 4.14Å; Y198-P200 HydrophobicContact CD2-CG 4.47Å; Y198-P200 HydrophobicContact CE1-CB 4.48Å; Y198-P200 HydrophobicContact CE1-CG 3.78Å; Y198-P200 HydrophobicContact CE2-CB 4.31Å; Y198-P200 HydrophobicContact CE2-CG 4.14Å; Y198-P200 HydrophobicContact CG-CG 4.49Å; Y198-P200 WeakPolarHBondContact O-CD 3.37Å
201	L	98.4	Very high	95.8	Very high	6 Å²	6	59 Å²	59	3%	0.031	31%	0.314	C	S	.	.			trans	-59.7	140.6	172.4	-67.1	169.3	0	0	0	110.2	V41 F150 E152 D207 L212 K214	V41-L201 HydrophobicContact CG2-CD1 4.41Å; F150-L201 HydrophobicContact CB-CD1 3.82Å; F150-L201 HydrophobicContact CG-CD1 4.49Å; E152-L201 HydrophobicContact CB-CD1 3.76Å; E152-L201 PolarHBondContact OE1-N 2.88Å; E152-L201 WeakPolarHBondContact OE2-CB 3.17Å; E152-L201 PolarHBondContact OE2-N 3.24Å; L201-D207 WeakPolarHBondContact CA-OD2 3.44Å; L201-D207 HydrophobicContact CD2-CB 4.37Å; L201-L212 HydrophobicContact CB-CD2 4.09Å; L201-L212 HydrophobicContact CD1-CB 4.22Å; L201-L212 HydrophobicContact CD1-CD2 3.95Å; L201-L212 HydrophobicContact CD2-CD2 4.36Å; L201-L212 HydrophobicContact CG-CD2 4.36Å; L201-K214 WeakPolarHBondContact O-CE 3.32Å; L201-K214 PolarHBondContact O-NZ 3.11Å
202	D	97.8	Very high	96	Very high	38 Å²	38	58.9 Å²	58.9	20%	0.203	31%	0.313	C	S	.	.			trans	-127.4	81.1	-178.5	-176.8	-0.7	0	0	0	110	D204 K205 C206 D207	D202-D204 PolarHBondContact O-N 3.08Å; D202-D204 PolarHBondContact OD1-N 2.82Å; D202-K205 CarbonylContact O-C 3.56Å; D202-K205 PolarHBondContact O-N 2.7Å; D202-K205 PolarHBondContact OD1-N 3.37Å; D202-K205 WeakPolarHBondContact OD2-CB 3.5Å; D202-C206 PolarHBondContact O-N 3.07Å; D202-D207 PolarHBondContact N-OD2 3.27Å; D202-D207 WeakPolarHBondContact O-CA 3.35Å; D202-D207 WeakPolarHBondContact O-CB 3.26Å; D202-D207 PolarHBondContact O-N 3.06Å
203	P	96.5	Very high	96.3	Very high	10 Å²	10	54.9 Å²	54.9	7%	0.065	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.2	-176.8	26.9	-33.2	0	0	0	113.3	R208 L212 L223 N225	P203-R208 WeakPolarHBondContact O-CA 3.41Å; P203-R208 WeakPolarHBondContact O-CB 3.23Å; P203-L212 HydrophobicContact CB-CD1 4.41Å; P203-L212 HydrophobicContact CB-CD2 4.45Å; P203-L223 HydrophobicContact CB-CD2 4.06Å; P203-L223 HydrophobicContact CG-CD1 3.69Å; P203-L223 HydrophobicContact CG-CD2 3.52Å; P203-L223 HydrophobicContact CG-CG 4.29Å; P203-N225 HydrophobicContact CB-CB 4.13Å
204	D	96.3	Very high	96.4	Very high	117 Å²	117	55.1 Å²	55.1	63%	0.626	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-25.1	176.8	-61.4	-41.7	0	0	0	111.7	D202 R208	D202-D204 PolarHBondContact O-N 3.08Å; D202-D204 PolarHBondContact OD1-N 2.82Å; D204-R208 PolarHBondContact O-NE 2.92Å; D204-R208 PolarHBondContact O-NH2 3.35Å
205	K	96.3	Very high	96.6	Very high	152 Å²	152	54.6 Å²	54.6	66%	0.661	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	-93	-176.5	-50.2	174.9	-174.6	171.4	0	112.4	D202 D207 R208	D202-K205 CarbonylContact O-C 3.56Å; D202-K205 PolarHBondContact O-N 2.7Å; D202-K205 PolarHBondContact OD1-N 3.37Å; D202-K205 WeakPolarHBondContact OD2-CB 3.5Å; K205-D207 VanDerWaalsContact C-N 3.32Å; K205-D207 PolarHBondContact O-N 2.8Å; K205-R208 WeakPolarHBondContact O-CB 3.2Å; K205-R208 PolarHBondContact O-N 3.26Å
206	C	95.3	Very high	96.7	Very high	79 Å²	79	51 Å²	51	53%	0.534	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-27.4	-165.2	-62.1	0	0	0	0	114	R131 D202	R131-C206 PolarHBondContact NH2-SG 3.23Å; R131-C206 VanDerWaalsContact NH2-SG 3.42Å; D202-C206 PolarHBondContact O-N 3.07Å
207	D	97.9	Very high	96.7	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.032	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	18.5	-175	-58.9	-67.2	0	0	0	111.7	R134 L201 D202 K205 D209 L210 L212	R134-D207 IonicContact NH2-OD2 3.56Å; L201-D207 WeakPolarHBondContact CA-OD2 3.44Å; L201-D207 HydrophobicContact CD2-CB 4.37Å; D202-D207 PolarHBondContact N-OD2 3.27Å; D202-D207 WeakPolarHBondContact O-CA 3.35Å; D202-D207 WeakPolarHBondContact O-CB 3.26Å; D202-D207 PolarHBondContact O-N 3.06Å; K205-D207 VanDerWaalsContact C-N 3.32Å; K205-D207 PolarHBondContact O-N 2.8Å; D207-D209 PolarHBondContact O-N 3.41Å; D207-L210 HydrophobicContact CB-CD1 3.86Å; D207-L210 HydrophobicContact CB-CG 4.17Å; D207-L210 WeakPolarHBondContact O-CB 3.25Å; D207-L210 PolarHBondContact O-N 3.15Å; D207-L210 VanDerWaalsContact OD1-CD1 3.31Å; D207-L210 WeakPolarHBondContact OD1-CD1 3.19Å; D207-L212 HydrophobicContact CB-CD2 4.31Å
208	R	97.3	Very high	96.6	Very high	146 Å²	146	49.8 Å²	49.8	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-35.8	-176.7	-174.5	-174.2	-60	174.9	1.6	113.8	P203 D204 K205 N225 R226	P203-R208 WeakPolarHBondContact O-CA 3.41Å; P203-R208 WeakPolarHBondContact O-CB 3.23Å; D204-R208 PolarHBondContact O-NE 2.92Å; D204-R208 PolarHBondContact O-NH2 3.35Å; K205-R208 WeakPolarHBondContact O-CB 3.2Å; K205-R208 PolarHBondContact O-N 3.26Å; R208-N225 PolarHBondContact O-ND2 3.38Å; R208-R226 WeakPolarHBondContact O-CD 3.37Å
209	D	97.4	Very high	96.2	Very high	113 Å²	113	48.7 Å²	48.7	60%	0.604	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.2	-177.7	-70.1	-53.4	0	0	0	114	D207 R226	D207-D209 PolarHBondContact O-N 3.41Å; D209-R226 VanDerWaalsContact CA-NH1 3.34Å; D209-R226 PolarHBondContact O-NH1 3.31Å; D209-R226 IonicContact OD1-CZ 2.65Å; D209-R226 IonicContact OD1-NH1 2.84Å; D209-R226 PolarHBondContact OD1-NH1 3.02Å
210	L	98.4	Very high	95.9	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.152	28%	0.277	C	S	.	.	S	Bend	trans	-84.3	139.3	-177.5	-56.9	-170.9	0	0	0	112.2	L138 F150 D207 L212 N225	L138-L210 HydrophobicContact CD1-CD1 4.25Å; L138-L210 HydrophobicContact CD1-CD2 3.78Å; L138-L210 HydrophobicContact CD2-CD2 4.05Å; F150-L210 HydrophobicContact CD2-CB 4.45Å; F150-L210 HydrophobicContact CD2-CD1 4.36Å; F150-L210 HydrophobicContact CE2-CD1 4.05Å; F150-L210 HydrophobicContact CZ-CD1 4.41Å; D207-L210 HydrophobicContact CB-CD1 3.86Å; D207-L210 HydrophobicContact CB-CG 4.17Å; D207-L210 WeakPolarHBondContact O-CB 3.25Å; D207-L210 PolarHBondContact O-N 3.15Å; D207-L210 VanDerWaalsContact OD1-CD1 3.31Å; D207-L210 WeakPolarHBondContact OD1-CD1 3.19Å; L210-L212 HydrophobicContact CB-CD2 4.19Å; L210-L212 PolarHBondContact O-N 2.86Å; L210-N225 PolarHBondContact O-ND2 3.42Å
211	S	98.6	Very high	95.8	Very high	3 Å²	3	60 Å²	60	2%	0.021	29%	0.287	C	S	.	.			trans	-78	115.3	169.3	-58.5	0	0	0	0	109.8	F149 F150 N225 R226 Q228	F149-S211 WeakPolarHBondContact CA-O 3.3Å; F149-S211 WeakPolarHBondContact CD2-O 3.23Å; F150-S211 PolarHBondContact N-O 2.97Å; S211-N225 WeakPolarHBondContact CA-O 3.29Å; S211-R226 VanDerWaalsContact CB-O 3.23Å; S211-R226 WeakPolarHBondContact CB-O 3.44Å; S211-R226 PolarHBondContact OG-O 3.45Å; S211-Q228 WeakPolarHBondContact OG-CG 2.97Å; S211-Q228 PolarHBondContact OG-NE2 3.24Å; S211-Q228 VanDerWaalsContact OG-NE2 3.14Å
212	L	98.8	Very high	95.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	160.8	-173.2	62.8	80.7	0	0	0	113.7	F150 L201 P203 D207 L210 K214 L223 V224 N225	F150-L212 HydrophobicContact CB-CB 3.8Å; F150-L212 CarbonylContact O-C 3.58Å; F150-L212 VanDerWaalsContact O-CA 3.22Å; F150-L212 WeakPolarHBondContact O-CA 3.48Å; L201-L212 HydrophobicContact CB-CD2 4.09Å; L201-L212 HydrophobicContact CD1-CB 4.22Å; L201-L212 HydrophobicContact CD1-CD2 3.95Å; L201-L212 HydrophobicContact CD2-CD2 4.36Å; L201-L212 HydrophobicContact CG-CD2 4.36Å; P203-L212 HydrophobicContact CB-CD1 4.41Å; P203-L212 HydrophobicContact CB-CD2 4.45Å; D207-L212 HydrophobicContact CB-CD2 4.31Å; L210-L212 HydrophobicContact CB-CD2 4.19Å; L210-L212 PolarHBondContact O-N 2.86Å; L212-K214 HydrophobicContact CD1-CG 4.41Å; L212-L223 HydrophobicContact CD1-CD2 4.2Å; L212-V224 WeakPolarHBondContact O-CA 3.47Å; L212-N225 HydrophobicContact CD1-CB 3.86Å; L212-N225 HydrophobicContact CG-CB 3.94Å; L212-N225 PolarHBondContact N-O 3.16Å; L212-N225 PolarHBondContact O-N 3.48Å
213	I	98.8	Very high	95.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131	162.5	-179	172.8	0	0	0	109.4	F149 F150 I151 E152 V215 F222 L223 V224 V236 L239	F149-I213 HydrophobicContact CE1-CG2 3.91Å; F149-I213 HydrophobicContact CZ-CB 4.19Å; F149-I213 HydrophobicContact CZ-CG2 3.73Å; F150-I213 PolarHBondContact O-N 2.71Å; I151-I213 WeakPolarHBondContact CA-O 3.36Å; I151-I213 HydrophobicContact CB-CG2 4.2Å; I151-I213 HydrophobicContact CG1-CG2 3.75Å; I151-I213 HydrophobicContact CG2-CG2 4.14Å; E152-I213 PolarHBondContact N-O 3.42Å; I213-V215 HydrophobicContact CD1-CG2 4.39Å; I213-V215 HydrophobicContact CG1-CG2 4.34Å; I213-F222 HydrophobicContact CD1-CD1 3.73Å; I213-F222 HydrophobicContact CD1-CE1 4.43Å; I213-F222 HydrophobicContact CG1-CD1 4.27Å; I213-L223 CarbonylContact C-O 3.54Å; I213-L223 VanDerWaalsContact CA-O 3.29Å; I213-L223 WeakPolarHBondContact CA-O 3.39Å; I213-V224 HydrophobicContact CB-CG2 4.41Å; I213-V224 HydrophobicContact CD1-CG2 4.07Å; I213-V224 HydrophobicContact CG1-CG2 3.97Å; I213-V236 HydrophobicContact CB-CG2 4.5Å; I213-V236 HydrophobicContact CD1-CB 4.44Å; I213-V236 HydrophobicContact CD1-CG1 4.18Å; I213-V236 HydrophobicContact CD1-CG2 4.18Å; I213-L239 HydrophobicContact CD1-CB 4.31Å; I213-L239 HydrophobicContact CD1-CD1 3.93Å; I213-L239 HydrophobicContact CG2-CD1 3.85Å
214	K	98.4	Very high	95.8	Very high	21 Å²	21	65.1 Å²	65.1	9%	0.091	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.2	164.5	-67.1	171.3	168.2	-91.4	0	108.9	E152 L201 L212 I216 F222 L223	E152-K214 HydrophobicContact CB-CG 4.19Å; E152-K214 CarbonylContact O-C 3.49Å; E152-K214 WeakPolarHBondContact O-CA 3.33Å; E152-K214 VanDerWaalsContact OE2-CE 3.3Å; E152-K214 WeakPolarHBondContact OE2-CE 3.46Å; E152-K214 WeakPolarHBondContact OE2-CG 3.49Å; E152-K214 IonicContact OE2-NZ 3.43Å; E152-K214 PolarHBondContact OE2-NZ 3.31Å; L201-K214 WeakPolarHBondContact O-CE 3.32Å; L201-K214 PolarHBondContact O-NZ 3.11Å; L212-K214 HydrophobicContact CD1-CG 4.41Å; K214-I216 HydrophobicContact CB-CD1 4.45Å; K214-I216 HydrophobicContact CB-CG1 4.27Å; K214-F222 VanDerWaalsContact O-CA 3.28Å; K214-F222 WeakPolarHBondContact O-CA 3.33Å; K214-L223 HydrophobicContact CB-CB 4.15Å; K214-L223 HydrophobicContact CD-CB 4.27Å; K214-L223 HydrophobicContact CD-CD1 4.28Å; K214-L223 PolarHBondContact N-O 3.02Å; K214-L223 PolarHBondContact O-N 3.37Å
215	V	97.4	Very high	95.9	Very high	10 Å²	10	61.1 Å²	61.1	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.5	171.4	-175.6	0	0	0	0	107.3	I151 E152 V154 I213 F222 L239	I151-V215 HydrophobicContact CG2-CG2 4.43Å; E152-V215 PolarHBondContact O-N 2.64Å; V154-V215 PolarHBondContact N-O 2.74Å; I213-V215 HydrophobicContact CD1-CG2 4.39Å; I213-V215 HydrophobicContact CG1-CG2 4.34Å; V215-F222 HydrophobicContact CB-CD1 4.44Å; V215-F222 HydrophobicContact CB-CE1 4.29Å; V215-F222 HydrophobicContact CG1-CD1 4.38Å; V215-F222 HydrophobicContact CG1-CE1 3.83Å; V215-F222 HydrophobicContact CG2-CD1 4.05Å; V215-F222 HydrophobicContact CG2-CE1 3.94Å; V215-L239 HydrophobicContact CG2-CD1 4.45Å
216	I	95.1	Very high	96	Very high	18 Å²	18	60.5 Å²	60.5	9%	0.092	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131	-171.8	-56.5	169.7	0	0	0	108.9	V154 K214 V218 G219 R220 R221	V154-I216 HydrophobicContact CB-CG1 4.49Å; V154-I216 CarbonylContact O-C 3.5Å; V154-I216 WeakPolarHBondContact O-CA 3.46Å; K214-I216 HydrophobicContact CB-CD1 4.45Å; K214-I216 HydrophobicContact CB-CG1 4.27Å; I216-V218 PolarHBondContact O-N 3.31Å; I216-G219 PolarHBondContact O-N 2.88Å; I216-R220 PolarHBondContact O-N 2.8Å; I216-R220 VanDerWaalsContact O-N 3.12Å; I216-R221 HydrophobicContact CB-CB 4.25Å; I216-R221 WeakPolarHBondContact CB-O 3.46Å; I216-R221 PolarHBondContact N-O 3.34Å; I216-R221 PolarHBondContact O-N 2.78Å; I216-R221 VanDerWaalsContact O-N 3.16Å
217	D	89.6	Confident	96.1	Very high	62 Å²	62	59.7 Å²	59.7	33%	0.332	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	56.9	178.5	-57.1	-37.5	0	0	0	111.9	V154 G219 R220	V154-D217 PolarHBondContact O-N 3.33Å; D217-G219 VanDerWaalsContact C-N 3.28Å; D217-G219 PolarHBondContact O-N 2.78Å; D217-R220 HydrophobicContact CB-CB 4.07Å; D217-R220 WeakPolarHBondContact O-CB 3.08Å; D217-R220 PolarHBondContact O-N 3.15Å
218	V	87.2	Confident	96	Very high	53 Å²	53	64.6 Å²	64.6	32%	0.321	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	38.1	173.7	-158.3	0	0	0	0	112.9	V160 I216 V244	V160-V218 HydrophobicContact CB-CG2 4.48Å; V160-V218 HydrophobicContact CG1-CG2 3.62Å; V160-V218 HydrophobicContact CG2-CG2 4.17Å; I216-V218 PolarHBondContact O-N 3.31Å; V218-V244 HydrophobicContact CG1-CB 4.24Å; V218-V244 HydrophobicContact CG1-CG1 3.83Å; V218-V244 HydrophobicContact CG1-CG2 3.38Å
219	G	89.8	Confident	95.9	Very high	24 Å²	24	59.4 Å²	59.4	25%	0.247	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	10.3	177.3	0	0	0	0	0	114.3	I216 D217 R221 F222	I216-G219 PolarHBondContact O-N 2.88Å; D217-G219 VanDerWaalsContact C-N 3.28Å; D217-G219 PolarHBondContact O-N 2.78Å; G219-R221 VanDerWaalsContact C-N 3.29Å; G219-R221 PolarHBondContact O-N 3.06Å; G219-F222 VanDerWaalsContact CA-CZ 3.47Å; G219-F222 WeakPolarHBondContact O-CE2 3.41Å; G219-F222 WeakPolarHBondContact O-CZ 3.36Å
220	R	90.6	Very high	95.7	Very high	218 Å²	218	60.2 Å²	60.2	82%	0.823	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-33.6	172.7	-171.5	174.9	-177.2	173.6	1.5	112.5	I216 D217	I216-R220 PolarHBondContact O-N 2.8Å; I216-R220 VanDerWaalsContact O-N 3.12Å; D217-R220 HydrophobicContact CB-CB 4.07Å; D217-R220 WeakPolarHBondContact O-CB 3.08Å; D217-R220 PolarHBondContact O-N 3.15Å
221	R	95.5	Very high	95.6	Very high	155 Å²	155	60.2 Å²	60.2	59%	0.585	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	148.1	177	-175.2	170.5	63.6	118.3	-4.3	111	I216 G219	I216-R221 HydrophobicContact CB-CB 4.25Å; I216-R221 WeakPolarHBondContact CB-O 3.46Å; I216-R221 PolarHBondContact N-O 3.34Å; I216-R221 PolarHBondContact O-N 2.78Å; I216-R221 VanDerWaalsContact O-N 3.16Å; G219-R221 VanDerWaalsContact C-N 3.29Å; G219-R221 PolarHBondContact O-N 3.06Å
222	F	97.4	Very high	95.6	Very high	50 Å²	50	60 Å²	60	22%	0.219	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144.3	176.5	-57.7	-90.4	0	0	0	110.4	I213 K214 V215 G219 L239 M240	I213-F222 HydrophobicContact CD1-CD1 3.73Å; I213-F222 HydrophobicContact CD1-CE1 4.43Å; I213-F222 HydrophobicContact CG1-CD1 4.27Å; K214-F222 VanDerWaalsContact O-CA 3.28Å; K214-F222 WeakPolarHBondContact O-CA 3.33Å; V215-F222 HydrophobicContact CB-CD1 4.44Å; V215-F222 HydrophobicContact CB-CE1 4.29Å; V215-F222 HydrophobicContact CG1-CD1 4.38Å; V215-F222 HydrophobicContact CG1-CE1 3.83Å; V215-F222 HydrophobicContact CG2-CD1 4.05Å; V215-F222 HydrophobicContact CG2-CE1 3.94Å; G219-F222 VanDerWaalsContact CA-CZ 3.47Å; G219-F222 WeakPolarHBondContact O-CE2 3.41Å; G219-F222 WeakPolarHBondContact O-CZ 3.36Å; F222-L239 HydrophobicContact CE1-CB 4.47Å; F222-L239 WeakPolarHBondContact CZ-O 3.22Å; F222-M240 HydrophobicContact CD1-CG 4.32Å; F222-M240 HydrophobicContact CD2-CG 3.99Å; F222-M240 HydrophobicContact CE1-CG 4.28Å; F222-M240 HydrophobicContact CE2-CB 4.35Å; F222-M240 HydrophobicContact CE2-CG 3.96Å; F222-M240 HydrophobicContact CG-CG 4.17Å; F222-M240 HydrophobicContact CZ-CB 4.4Å; F222-M240 HydrophobicContact CZ-CG 4.12Å
223	L	98.2	Very high	95.6	Very high	50 Å²	50	63.1 Å²	63.1	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	117.5	163.8	-170.9	169	0	0	0	107.2	P203 L212 I213 K214 N225	P203-L223 HydrophobicContact CB-CD2 4.06Å; P203-L223 HydrophobicContact CG-CD1 3.69Å; P203-L223 HydrophobicContact CG-CD2 3.52Å; P203-L223 HydrophobicContact CG-CG 4.29Å; L212-L223 HydrophobicContact CD1-CD2 4.2Å; I213-L223 CarbonylContact C-O 3.54Å; I213-L223 VanDerWaalsContact CA-O 3.29Å; I213-L223 WeakPolarHBondContact CA-O 3.39Å; K214-L223 HydrophobicContact CB-CB 4.15Å; K214-L223 HydrophobicContact CD-CB 4.27Å; K214-L223 HydrophobicContact CD-CD1 4.28Å; K214-L223 PolarHBondContact N-O 3.02Å; K214-L223 PolarHBondContact O-N 3.37Å; L223-N225 HydrophobicContact CD2-CB 4.4Å
224	V	98.6	Very high	95.5	Very high	61 Å²	61	64.8 Å²	64.8	37%	0.37	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.1	-179.1	-176.4	0	0	0	0	108.7	L212 I213 V227 V236	L212-V224 WeakPolarHBondContact O-CA 3.47Å; I213-V224 HydrophobicContact CB-CG2 4.41Å; I213-V224 HydrophobicContact CD1-CG2 4.07Å; I213-V224 HydrophobicContact CG1-CG2 3.97Å; V224-V227 HydrophobicContact CG1-CG2 3.5Å; V224-V236 HydrophobicContact CG1-CG1 4.41Å; V224-V236 HydrophobicContact CG1-CG2 3.97Å; V224-V236 HydrophobicContact CG2-CG1 3.78Å; V224-V236 HydrophobicContact CG2-CG2 4.37Å
225	N	98.6	Very high	95.5	Very high	33 Å²	33	63.9 Å²	63.9	18%	0.176	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134	179.8	-174.1	54.4	0	0	0	111.1	P203 R208 L210 S211 L212 L223 V227	P203-N225 HydrophobicContact CB-CB 4.13Å; R208-N225 PolarHBondContact O-ND2 3.38Å; L210-N225 PolarHBondContact O-ND2 3.42Å; S211-N225 WeakPolarHBondContact CA-O 3.29Å; L212-N225 HydrophobicContact CD1-CB 3.86Å; L212-N225 HydrophobicContact CG-CB 3.94Å; L212-N225 PolarHBondContact N-O 3.16Å; L212-N225 PolarHBondContact O-N 3.48Å; L223-N225 HydrophobicContact CD2-CB 4.4Å; N225-V227 PolarHBondContact O-N 3.37Å
226	R	97.7	Very high	95.5	Very high	140 Å²	140	64.1 Å²	64.1	53%	0.528	31%	0.308	S	S	.	.			trans	42.9	60.2	173.5	-57.2	-169.1	86.5	176.9	21	115.6	R208 D209 S211 Q228	R208-R226 WeakPolarHBondContact O-CD 3.37Å; D209-R226 VanDerWaalsContact CA-NH1 3.34Å; D209-R226 PolarHBondContact O-NH1 3.31Å; D209-R226 IonicContact OD1-CZ 2.65Å; D209-R226 IonicContact OD1-NH1 2.84Å; D209-R226 PolarHBondContact OD1-NH1 3.02Å; S211-R226 VanDerWaalsContact CB-O 3.23Å; S211-R226 WeakPolarHBondContact CB-O 3.44Å; S211-R226 PolarHBondContact OG-O 3.45Å; R226-Q228 PolarHBondContact O-N 3.47Å
227	V	98.1	Very high	95.6	Very high	62 Å²	62	68.8 Å²	68.8	38%	0.376	33%	0.325	S	S	.	.			trans	-60.6	124	168.8	179.3	0	0	0	0	109.4	V224 N225 Q232 V236	V224-V227 HydrophobicContact CG1-CG2 3.5Å; N225-V227 PolarHBondContact O-N 3.37Å; V227-Q232 HydrophobicContact CG1-CB 3.79Å; V227-V236 HydrophobicContact CG2-CG2 4.39Å
228	Q	95.1	Very high	96	Very high	108 Å²	108	65.9 Å²	65.9	51%	0.505	31%	0.309	S	S	.	.			trans	-94.2	-27.9	-173	-69	171.5	-20.2	0	0	113.9	S211 R226 Q232	S211-Q228 WeakPolarHBondContact OG-CG 2.97Å; S211-Q228 PolarHBondContact OG-NE2 3.24Å; S211-Q228 VanDerWaalsContact OG-NE2 3.14Å; R226-Q228 PolarHBondContact O-N 3.47Å; Q228-Q232 VanDerWaalsContact OE1-NE2 3.12Å
229	D	93.9	Very high	96.5	Very high	38 Å²	38	63.6 Å²	63.6	20%	0.203	30%	0.295	C	S	.	.	S	Bend	trans	-154.8	175.5	-172.4	58.8	33.5	0	0	0	112.8	K147 I231 Q232 S233	K147-D229 WeakPolarHBondContact CD-OD2 3.49Å; K147-D229 IonicContact NZ-OD2 2.8Å; K147-D229 PolarHBondContact NZ-OD2 3.2Å; D229-I231 VanDerWaalsContact C-N 3.28Å; D229-I231 PolarHBondContact O-N 3.35Å; D229-I231 WeakPolarHBondContact OD1-CG2 3.35Å; D229-I231 PolarHBondContact OD1-N 3.47Å; D229-Q232 PolarHBondContact O-N 3.21Å; D229-Q232 WeakPolarHBondContact OD1-CB 3.41Å; D229-Q232 WeakPolarHBondContact OD1-CG 3.31Å; D229-Q232 PolarHBondContact OD1-N 3.45Å; D229-S233 PolarHBondContact O-N 3.42Å; D229-S233 VanDerWaalsContact O-N 3.1Å
230	H	95.1	Very high	96.8	Very high	130 Å²	130	67.3 Å²	67.3	60%	0.602	31%	0.308	S	S	*	.	H	α-helix	trans	-59	-37.4	179.3	170.9	-101.3	0	0	0	112.7	S233 R234	H230-S233 WeakPolarHBondContact O-CB 3.43Å; H230-S233 PolarHBondContact O-N 2.96Å; H230-R234 VanDerWaalsContact CE1-CG 3.4Å; H230-R234 WeakPolarHBondContact CE1-CG 3.2Å; H230-R234 WeakPolarHBondContact O-CB 3.41Å; H230-R234 WeakPolarHBondContact O-CG 3.26Å; H230-R234 PolarHBondContact O-N 2.89Å
231	I	96.1	Very high	97	Very high	28 Å²	28	58.2 Å²	58.2	14%	0.144	28%	0.276	C	S	.	.	H	α-helix	trans	-71.5	-37.6	-176.1	-163.3	55.6	0	0	0	111.5	L59 V64 I121 D229 R234 I235	L59-I231 HydrophobicContact CD2-CD1 3.76Å; V64-I231 HydrophobicContact CG1-CD1 4.43Å; V64-I231 HydrophobicContact CG2-CD1 4.22Å; I121-I231 HydrophobicContact CD1-CD1 4.18Å; I121-I231 HydrophobicContact CD1-CG1 3.64Å; D229-I231 VanDerWaalsContact C-N 3.28Å; D229-I231 PolarHBondContact O-N 3.35Å; D229-I231 WeakPolarHBondContact OD1-CG2 3.35Å; D229-I231 PolarHBondContact OD1-N 3.47Å; I231-R234 HydrophobicContact CD1-CB 4.43Å; I231-R234 WeakPolarHBondContact O-CB 3.28Å; I231-R234 PolarHBondContact O-N 3.41Å; I231-I235 HydrophobicContact CG1-CD1 4.45Å; I231-I235 WeakPolarHBondContact O-CD1 3.48Å; I231-I235 WeakPolarHBondContact O-CG1 3.36Å; I231-I235 PolarHBondContact O-N 3.3Å
232	Q	98	Very high	96.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-41.5	170.8	-68.7	176.5	15.1	0	0	111.4	F149 V227 Q228 D229 R234 I235 V236	F149-Q232 HydrophobicContact CB-CG 4.18Å; F149-Q232 HydrophobicContact CD1-CG 4.38Å; F149-Q232 HydrophobicContact CD2-CB 4.26Å; F149-Q232 HydrophobicContact CD2-CG 3.79Å; F149-Q232 HydrophobicContact CE2-CB 4.24Å; F149-Q232 HydrophobicContact CE2-CG 4.28Å; F149-Q232 HydrophobicContact CG-CG 3.86Å; V227-Q232 HydrophobicContact CG1-CB 3.79Å; Q228-Q232 VanDerWaalsContact OE1-NE2 3.12Å; D229-Q232 PolarHBondContact O-N 3.21Å; D229-Q232 WeakPolarHBondContact OD1-CB 3.41Å; D229-Q232 WeakPolarHBondContact OD1-CG 3.31Å; D229-Q232 PolarHBondContact OD1-N 3.45Å; Q232-R234 VanDerWaalsContact C-N 3.34Å; Q232-R234 PolarHBondContact O-N 3.09Å; Q232-I235 PolarHBondContact O-N 2.92Å; Q232-V236 WeakPolarHBondContact O-CG2 3.13Å; Q232-V236 PolarHBondContact O-N 3.49Å
233	S	97.9	Very high	96.3	Very high	64 Å²	64	51.1 Å²	51.1	45%	0.448	25%	0.25	S	S	.	.	H	α-helix	trans	-60.8	-42.4	175.4	-168.9	0	0	0	0	112.3	D229 H230 V236 Y237	D229-S233 PolarHBondContact O-N 3.42Å; D229-S233 VanDerWaalsContact O-N 3.1Å; H230-S233 WeakPolarHBondContact O-CB 3.43Å; H230-S233 PolarHBondContact O-N 2.96Å; S233-V236 PolarHBondContact O-N 3.21Å; S233-Y237 WeakPolarHBondContact O-CB 3.39Å; S233-Y237 PolarHBondContact O-N 3.27Å
234	R	96.9	Very high	95.5	Very high	36 Å²	36	52.3 Å²	52.3	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-44.9	174.8	-73.5	-87.7	-51.3	-97.9	11	112	Y58 H230 I231 Q232 Y237 Y238 E371	Y58-R234 PolarHBondContact OH-NE 3.34Å; Y58-R234 PolarHBondContact OH-NH2 3.15Å; H230-R234 VanDerWaalsContact CE1-CG 3.4Å; H230-R234 WeakPolarHBondContact CE1-CG 3.2Å; H230-R234 WeakPolarHBondContact O-CB 3.41Å; H230-R234 WeakPolarHBondContact O-CG 3.26Å; H230-R234 PolarHBondContact O-N 2.89Å; I231-R234 HydrophobicContact CD1-CB 4.43Å; I231-R234 WeakPolarHBondContact O-CB 3.28Å; I231-R234 PolarHBondContact O-N 3.41Å; Q232-R234 VanDerWaalsContact C-N 3.34Å; Q232-R234 PolarHBondContact O-N 3.09Å; R234-Y237 PolarHBondContact O-N 3.37Å; R234-Y238 WeakPolarHBondContact O-CB 3.07Å; R234-Y238 PolarHBondContact O-N 3.33Å; R234-E371 IonicContact CZ-OE1 3.16Å; R234-E371 IonicContact CZ-OE2 2.79Å; R234-E371 IonicContact NE-OE1 3.77Å; R234-E371 PolarHBondContact NE-OE1 2.97Å; R234-E371 VanDerWaalsContact NE-OE1 3.16Å; R234-E371 IonicContact NH1-OE2 2.74Å; R234-E371 IonicContact NH2-OE1 3.81Å; R234-E371 PolarHBondContact NH2-OE1 3Å; R234-E371 IonicContact NH2-OE2 3.65Å; R234-E371 PolarHBondContact NH2-OE2 3.23Å
235	I	98.4	Very high	94.6	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-46.9	177	-67.9	158.3	0	0	0	110.1	I38 L55 L59 F149 I151 I231 Q232 Y237 Y238 L239	I38-I235 HydrophobicContact CD1-CD1 3.56Å; I38-I235 HydrophobicContact CD1-CG1 4.47Å; I38-I235 HydrophobicContact CG1-CD1 4.42Å; L55-I235 HydrophobicContact CD1-CB 4.39Å; L55-I235 HydrophobicContact CD1-CG1 4.1Å; L55-I235 HydrophobicContact CD1-CG2 3.99Å; L55-I235 HydrophobicContact CD2-CG1 4.39Å; L55-I235 HydrophobicContact CD2-CG2 3.76Å; L59-I235 HydrophobicContact CD2-CG1 4.35Å; F149-I235 HydrophobicContact CD1-CD1 4.41Å; F149-I235 HydrophobicContact CD1-CG2 4.44Å; F149-I235 HydrophobicContact CE1-CB 4.32Å; F149-I235 HydrophobicContact CE1-CG2 3.81Å; I151-I235 HydrophobicContact CD1-CG2 4.05Å; I231-I235 HydrophobicContact CG1-CD1 4.45Å; I231-I235 WeakPolarHBondContact O-CD1 3.48Å; I231-I235 WeakPolarHBondContact O-CG1 3.36Å; I231-I235 PolarHBondContact O-N 3.3Å; Q232-I235 PolarHBondContact O-N 2.92Å; I235-Y237 PolarHBondContact O-N 3.17Å; I235-Y238 PolarHBondContact O-N 2.87Å; I235-L239 HydrophobicContact CG2-CD1 3.93Å; I235-L239 HydrophobicContact CG2-CG 4.32Å; I235-L239 VanDerWaalsContact O-CG 3.26Å; I235-L239 WeakPolarHBondContact O-CG 3.39Å; I235-L239 PolarHBondContact O-N 2.83Å
236	V	98.3	Very high	93.9	Very high	15 Å²	15	59.4 Å²	59.4	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-57.7	-50	176.4	171.2	0	0	0	0	110.6	F149 I213 V224 V227 Q232 S233 Y238 L239 M240	F149-V236 HydrophobicContact CZ-CG2 3.93Å; I213-V236 HydrophobicContact CB-CG2 4.5Å; I213-V236 HydrophobicContact CD1-CB 4.44Å; I213-V236 HydrophobicContact CD1-CG1 4.18Å; I213-V236 HydrophobicContact CD1-CG2 4.18Å; V224-V236 HydrophobicContact CG1-CG1 4.41Å; V224-V236 HydrophobicContact CG1-CG2 3.97Å; V224-V236 HydrophobicContact CG2-CG1 3.78Å; V224-V236 HydrophobicContact CG2-CG2 4.37Å; V227-V236 HydrophobicContact CG2-CG2 4.39Å; Q232-V236 WeakPolarHBondContact O-CG2 3.13Å; Q232-V236 PolarHBondContact O-N 3.49Å; S233-V236 PolarHBondContact O-N 3.21Å; V236-Y238 VanDerWaalsContact C-N 3.32Å; V236-Y238 PolarHBondContact O-N 3.32Å; V236-L239 PolarHBondContact O-N 2.99Å; V236-M240 HydrophobicContact CG1-SD 3.89Å; V236-M240 VanDerWaalsContact O-CG 3.3Å; V236-M240 WeakPolarHBondContact O-CG 3.29Å; V236-M240 PolarHBondContact O-N 3.06Å; V236-M240 VanDerWaalsContact O-N 3.07Å
237	Y	97.5	Very high	93.7	Very high	117 Å²	117	53.2 Å²	53.2	46%	0.459	28%	0.275	S	S	.	.	H	α-helix	trans	-57.5	-44.2	178.1	175.5	-118.4	0	0	0	112.1	S233 R234 I235 M240 N241 M375	S233-Y237 WeakPolarHBondContact O-CB 3.39Å; S233-Y237 PolarHBondContact O-N 3.27Å; R234-Y237 PolarHBondContact O-N 3.37Å; I235-Y237 PolarHBondContact O-N 3.17Å; Y237-M240 PolarHBondContact O-N 3.21Å; Y237-N241 WeakPolarHBondContact CD2-ND2 3.47Å; Y237-N241 WeakPolarHBondContact CE2-ND2 3.38Å; Y237-N241 PolarHBondContact O-N 3.11Å; Y237-N241 PolarHBondContact O-ND2 3.06Å; Y237-M375 HydrophobicContact CD1-SD 4.19Å; Y237-M375 HydrophobicContact CE1-CB 4.4Å; Y237-M375 HydrophobicContact CE1-CG 3.71Å; Y237-M375 HydrophobicContact CE1-SD 3.87Å
238	Y	97.9	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-47.9	176.4	-177.6	-105.9	0	0	0	112.4	K54 L55 Y58 R234 I235 V236 M240 N241 I242 M375 E378 Y398	K54-Y238 WeakPolarHBondContact CG-OH 3.32Å; L55-Y238 HydrophobicContact CD1-CD1 3.66Å; L55-Y238 HydrophobicContact CD1-CE1 4.26Å; L55-Y238 HydrophobicContact CD1-CG 4.41Å; Y58-Y238 HydrophobicContact CD1-CD1 4.09Å; Y58-Y238 AromaticContact CD1-CD2 3.63Å; Y58-Y238 HydrophobicContact CD1-CD2 3.63Å; Y58-Y238 HydrophobicContact CD1-CE1 4.46Å; Y58-Y238 HydrophobicContact CD1-CE2 4.04Å; Y58-Y238 AromaticContact CD1-CG 3.64Å; Y58-Y238 HydrophobicContact CD1-CG 3.64Å; Y58-Y238 AromaticContact CD2-CD2 3.91Å; Y58-Y238 HydrophobicContact CD2-CD2 3.91Å; Y58-Y238 AromaticContact CD2-CE2 3.85Å; Y58-Y238 HydrophobicContact CD2-CE2 3.85Å; Y58-Y238 AromaticContact CE1-CD2 3.85Å; Y58-Y238 HydrophobicContact CE1-CD2 3.85Å; Y58-Y238 AromaticContact CE1-CG 3.87Å; Y58-Y238 HydrophobicContact CE1-CG 3.87Å; Y58-Y238 HydrophobicContact CE2-CD2 4.13Å; Y58-Y238 HydrophobicContact CE2-CE2 4.47Å; Y58-Y238 HydrophobicContact CG-CD1 4.48Å; Y58-Y238 AromaticContact CG-CD2 3.64Å; Y58-Y238 HydrophobicContact CG-CD2 3.64Å; Y58-Y238 HydrophobicContact CG-CE1 4.44Å; Y58-Y238 AromaticContact CG-CE2 3.59Å; Y58-Y238 HydrophobicContact CG-CE2 3.59Å; Y58-Y238 HydrophobicContact CG-CG 4.08Å; R234-Y238 WeakPolarHBondContact O-CB 3.07Å; R234-Y238 PolarHBondContact O-N 3.33Å; I235-Y238 PolarHBondContact O-N 2.87Å; V236-Y238 VanDerWaalsContact C-N 3.32Å; V236-Y238 PolarHBondContact O-N 3.32Å; Y238-M240 PolarHBondContact O-N 2.98Å; Y238-N241 PolarHBondContact O-N 3.29Å; Y238-I242 HydrophobicContact CD1-CG2 4.24Å; Y238-I242 HydrophobicContact CD2-CG2 4.44Å; Y238-I242 HydrophobicContact CE1-CD1 4.43Å; Y238-I242 HydrophobicContact CE1-CG2 3.72Å; Y238-I242 HydrophobicContact CE2-CG2 3.96Å; Y238-I242 PolarHBondContact O-N 2.9Å; Y238-M375 HydrophobicContact CD2-CE 3.53Å; Y238-M375 HydrophobicContact CD2-SD 3.85Å; Y238-M375 HydrophobicContact CE2-CE 3.77Å; Y238-E378 HydrophobicContact CE2-CG 4.32Å; Y238-Y398 PolarHBondContact OH-OH 2.89Å
239	L	96.8	Very high	93.7	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-29.5	-179.6	-67.5	174.4	0	0	0	112.9	I51 I151 I213 V215 F222 I235 V236 N241 I242	I51-L239 HydrophobicContact CG2-CD2 3.59Å; I151-L239 HydrophobicContact CD1-CD1 4.06Å; I151-L239 HydrophobicContact CG1-CD1 4.4Å; I151-L239 HydrophobicContact CG2-CD1 4.15Å; I213-L239 HydrophobicContact CD1-CB 4.31Å; I213-L239 HydrophobicContact CD1-CD1 3.93Å; I213-L239 HydrophobicContact CG2-CD1 3.85Å; V215-L239 HydrophobicContact CG2-CD1 4.45Å; F222-L239 HydrophobicContact CE1-CB 4.47Å; F222-L239 WeakPolarHBondContact CZ-O 3.22Å; I235-L239 HydrophobicContact CG2-CD1 3.93Å; I235-L239 HydrophobicContact CG2-CG 4.32Å; I235-L239 VanDerWaalsContact O-CG 3.26Å; I235-L239 WeakPolarHBondContact O-CG 3.39Å; I235-L239 PolarHBondContact O-N 2.83Å; V236-L239 PolarHBondContact O-N 2.99Å; L239-N241 VanDerWaalsContact C-N 3.3Å; L239-I242 HydrophobicContact CD2-CD1 3.96Å; L239-I242 WeakPolarHBondContact O-CG1 3.49Å
240	M	95.9	Very high	93.9	Very high	103 Å²	103	44.7 Å²	44.7	51%	0.507	23%	0.231	S	C	.	.	H	α-helix	trans	-74	-18.7	176.6	-69.3	175.8	71.4	0	0	113.7	F222 V236 Y237 Y238	F222-M240 HydrophobicContact CD1-CG 4.32Å; F222-M240 HydrophobicContact CD2-CG 3.99Å; F222-M240 HydrophobicContact CE1-CG 4.28Å; F222-M240 HydrophobicContact CE2-CB 4.35Å; F222-M240 HydrophobicContact CE2-CG 3.96Å; F222-M240 HydrophobicContact CG-CG 4.17Å; F222-M240 HydrophobicContact CZ-CB 4.4Å; F222-M240 HydrophobicContact CZ-CG 4.12Å; V236-M240 HydrophobicContact CG1-SD 3.89Å; V236-M240 VanDerWaalsContact O-CG 3.3Å; V236-M240 WeakPolarHBondContact O-CG 3.29Å; V236-M240 PolarHBondContact O-N 3.06Å; V236-M240 VanDerWaalsContact O-N 3.07Å; Y237-M240 PolarHBondContact O-N 3.21Å; Y238-M240 PolarHBondContact O-N 2.98Å
241	N	94.8	Very high	94.1	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.144	20%	0.203	C	C	.	.	H	α-helix	trans	-104.2	-13.9	-176.9	-72.9	-74.5	0	0	0	113.9	Y237 Y238 L239 E378 R379	Y237-N241 WeakPolarHBondContact CD2-ND2 3.47Å; Y237-N241 WeakPolarHBondContact CE2-ND2 3.38Å; Y237-N241 PolarHBondContact O-N 3.11Å; Y237-N241 PolarHBondContact O-ND2 3.06Å; Y238-N241 PolarHBondContact O-N 3.29Å; L239-N241 VanDerWaalsContact C-N 3.3Å; N241-E378 CarbonylContact O-C 3.54Å; N241-R379 WeakPolarHBondContact O-CA 3.46Å; N241-R379 PolarHBondContact O-N 2.85Å
242	I	92.3	Very high	94.2	Very high	22 Å²	22	37.2 Å²	37.2	11%	0.113	20%	0.196	C	C	.	.			trans	-82.5	146.3	177	61.1	173	0	0	0	111.9	K54 Y238 L239 E378	K54-I242 HydrophobicContact CD-CD1 4.36Å; K54-I242 HydrophobicContact CD-CG2 4.15Å; Y238-I242 HydrophobicContact CD1-CG2 4.24Å; Y238-I242 HydrophobicContact CD2-CG2 4.44Å; Y238-I242 HydrophobicContact CE1-CD1 4.43Å; Y238-I242 HydrophobicContact CE1-CG2 3.72Å; Y238-I242 HydrophobicContact CE2-CG2 3.96Å; Y238-I242 PolarHBondContact O-N 2.9Å; L239-I242 HydrophobicContact CD2-CD1 3.96Å; L239-I242 WeakPolarHBondContact O-CG1 3.49Å; I242-E378 HydrophobicContact CG2-CB 4.17Å; I242-E378 HydrophobicContact CG2-CG 4.28Å
243	H	85.9	Confident	94.3	Very high	34 Å²	34	37.4 Å²	37.4	16%	0.157	20%	0.197	C	C	.	.			trans	-136.4	167	166.9	66.7	77.4	0	0	0	112.1	Y50 Q245 R247 R379 Q380	Y50-H243 PolarHBondContact OH-O 2.74Å; H243-Q245 PolarHBondContact ND1-N 3.44Å; H243-R247 PolarHBondContact CD2-NH1 2.94Å; H243-R247 VanDerWaalsContact CD2-NH1 3.31Å; H243-R247 PolarHBondContact CE1-NH1 2.93Å; H243-R247 PolarHBondContact NE2-NH1 3.08Å; H243-R379 PolarHBondContact NE2-O 3.02Å; H243-Q380 PolarHBondContact NE2-O 3.15Å
244	V	81.4	Confident	94.3	Very high	75 Å²	75	34.6 Å²	34.6	46%	0.455	18%	0.176	S	C	.	.			trans	-104.2	-4.5	-179	-54.2	0	0	0	0	113.7	Y50 V218	Y50-V244 HydrophobicContact CE1-CG1 4Å; V218-V244 HydrophobicContact CG1-CB 4.24Å; V218-V244 HydrophobicContact CG1-CG1 3.83Å; V218-V244 HydrophobicContact CG1-CG2 3.38Å
245	Q	80.5	Confident	94.4	Very high	113 Å²	113	32.9 Å²	32.9	53%	0.528	17%	0.17	S	C	.	.	S	Bend	trans	-58.2	133.7	179.7	-60.5	179.3	8.3	0	0	110.6	H243 R247	H243-Q245 PolarHBondContact ND1-N 3.44Å; Q245-R247 PolarHBondContact O-N 2.81Å
246	P	84.4	Confident	94.4	Very high	129 Å²	129	32.9 Å²	32.9	84%	0.838	17%	0.17	S	C	*	.			trans	-58.1	133.9	175.6	-23.7	33.4	0	0	0	111.1
247	R	91.6	Very high	94.4	Very high	11 Å²	11	32.6 Å²	32.6	4%	0.042	17%	0.168	C	C	.	.			trans	-154.1	166.2	-179.7	59.2	174.6	174	-152	-4.7	110.6	H243 Q245 L377 E378 Q380 E381 P422	H243-R247 PolarHBondContact CD2-NH1 2.94Å; H243-R247 VanDerWaalsContact CD2-NH1 3.31Å; H243-R247 PolarHBondContact CE1-NH1 2.93Å; H243-R247 PolarHBondContact NE2-NH1 3.08Å; Q245-R247 PolarHBondContact O-N 2.81Å; R247-L377 PolarHBondContact NH1-O 3.4Å; R247-E378 PolarHBondContact NH1-O 3.02Å; R247-E378 PolarHBondContact NH2-O 3.02Å; R247-E378 IonicContact NH2-OE2 2.69Å; R247-E378 PolarHBondContact NH2-OE2 3.21Å; R247-Q380 WeakPolarHBondContact CD-O 3.19Å; R247-Q380 PolarHBondContact NH1-O 2.82Å; R247-E381 HydrophobicContact CB-CB 4.43Å; R247-E381 WeakPolarHBondContact CD-O 3.49Å; R247-P422 HydrophobicContact CG-CG 4.27Å; R247-P422 WeakPolarHBondContact O-CD 3.43Å
248	T	95.9	Very high	94.5	Very high	22 Å²	22	30.8 Å²	30.8	14%	0.135	16%	0.164	C	C	.	.			trans	-123.7	130.7	174.3	-53.5	0	0	0	0	111.2	Y250 N382 V383 K419 L420	T248-Y250 HydrophobicContact CG2-CD2 3.97Å; T248-Y250 HydrophobicContact CG2-CE1 4.07Å; T248-Y250 HydrophobicContact CG2-CE2 3.34Å; T248-Y250 VanDerWaalsContact CG2-CZ 3.44Å; T248-N382 PolarHBondContact N-OD1 3.02Å; T248-N382 VanDerWaalsContact N-OD1 3.12Å; T248-N382 WeakPolarHBondContact O-CA 3.42Å; T248-V383 PolarHBondContact O-N 2.58Å; T248-K419 HydrophobicContact CG2-CD 4.23Å; T248-K419 HydrophobicContact CG2-CG 3.56Å; T248-L420 WeakPolarHBondContact CA-O 3.41Å
249	I	98	Very high	94.5	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.9	173.4	-57.9	170.7	0	0	0	107.6	L251 L377 V383 F399 L420	I249-L251 HydrophobicContact CG2-CD2 3.69Å; I249-L251 HydrophobicContact CG2-CG 4.16Å; I249-L377 HydrophobicContact CG2-CD2 4.31Å; I249-V383 CarbonylContact C-O 3.59Å; I249-V383 WeakPolarHBondContact CA-O 3.31Å; I249-F399 HydrophobicContact CD1-CE1 3.6Å; I249-F399 HydrophobicContact CD1-CE2 4.29Å; I249-F399 HydrophobicContact CD1-CZ 3.46Å; I249-F399 VanDerWaalsContact CD1-CZ 3.46Å; I249-L420 HydrophobicContact CB-CB 4.14Å; I249-L420 PolarHBondContact N-O 2.85Å; I249-L420 WeakPolarHBondContact O-CA 3.36Å; I249-L420 WeakPolarHBondContact O-CB 3.43Å; I249-L420 PolarHBondContact O-N 3.32Å
250	Y	98.8	Very high	94.6	Very high	6 Å²	6	33.5 Å²	33.5	2%	0.024	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.1	175.2	-61.3	-93.4	0	0	0	108.4	T248 F285 Q289 L291 V383 L384 V385 V417 K419	T248-Y250 HydrophobicContact CG2-CD2 3.97Å; T248-Y250 HydrophobicContact CG2-CE1 4.07Å; T248-Y250 HydrophobicContact CG2-CE2 3.34Å; T248-Y250 VanDerWaalsContact CG2-CZ 3.44Å; Y250-F285 AromaticContact CD1-CE1 3.91Å; Y250-F285 HydrophobicContact CD1-CE1 3.91Å; Y250-F285 HydrophobicContact CD1-CZ 4.18Å; Y250-F285 AromaticContact CE1-CE1 3.87Å; Y250-F285 HydrophobicContact CE1-CE1 3.87Å; Y250-F285 AromaticContact CE1-CZ 3.86Å; Y250-F285 HydrophobicContact CE1-CZ 3.86Å; Y250-Q289 HydrophobicContact CE1-CG 4.17Å; Y250-Q289 PolarHBondContact OH-OE1 2.85Å; Y250-L291 HydrophobicContact CD2-CD1 4.19Å; Y250-L291 HydrophobicContact CE2-CD1 3.3Å; Y250-V383 PolarHBondContact N-O 3.17Å; Y250-L384 CarbonylContact O-C 3.58Å; Y250-L384 WeakPolarHBondContact O-CA 3.43Å; Y250-V385 PolarHBondContact O-N 3Å; Y250-V417 HydrophobicContact CD1-CG1 3.73Å; Y250-V417 HydrophobicContact CG-CG1 4.44Å; Y250-K419 HydrophobicContact CD1-CB 4.09Å; Y250-K419 HydrophobicContact CD1-CG 4.16Å; Y250-K419 HydrophobicContact CE1-CB 4.06Å; Y250-K419 HydrophobicContact CE1-CD 3.88Å; Y250-K419 HydrophobicContact CE1-CG 3.73Å
251	L	98.9	Very high	94.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.4	175.4	-50.1	178.3	0	0	0	109.3	I249 V385 L392 L395 L418 L420	I249-L251 HydrophobicContact CG2-CD2 3.69Å; I249-L251 HydrophobicContact CG2-CG 4.16Å; L251-V385 HydrophobicContact CD2-CB 3.72Å; L251-V385 HydrophobicContact CD2-CG2 3.81Å; L251-L392 HydrophobicContact CB-CD1 3.31Å; L251-L392 HydrophobicContact CD1-CD1 3.8Å; L251-L392 HydrophobicContact CG-CD1 4.14Å; L251-L395 HydrophobicContact CD1-CB 4.19Å; L251-L395 HydrophobicContact CD2-CD1 4.4Å; L251-L418 HydrophobicContact CB-CB 4.43Å; L251-L418 PolarHBondContact N-O 3.27Å; L251-L418 PolarHBondContact O-N 3.38Å; L251-L420 HydrophobicContact CD1-CD1 3.56Å; L251-L420 HydrophobicContact CD1-CG 4.47Å; L251-L420 HydrophobicContact CG-CD1 4.06Å
252	C	98.8	Very high	94.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	166.5	170.6	68.4	0	0	0	0	110.6	F278 V385 I386 C387 V417	C252-F278 HydrophobicContact CB-CZ 4.47Å; C252-V385 PolarHBondContact N-O 3.25Å; C252-I386 WeakPolarHBondContact O-CA 3.36Å; C252-C387 PolarHBondContact O-N 2.97Å; C252-V417 HydrophobicContact CB-CG2 4.29Å
253	R	98.9	Very high	95.1	Very high	5 Å²	5	36.4 Å²	36.4	2%	0.019	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	164.4	168.8	-67.5	169.4	60.1	-171.5	-2.3	109.6	C387 L392 C412 L414 T441	R253-C387 CarbonylContact C-O 3.58Å; R253-C387 VanDerWaalsContact CA-O 3.23Å; R253-C387 WeakPolarHBondContact CA-O 3.39Å; R253-L392 HydrophobicContact CG-CD2 3.76Å; R253-C412 WeakPolarHBondContact CD-O 3.28Å; R253-C412 PolarHBondContact NH1-O 3.29Å; R253-C412 VanDerWaalsContact NH1-O 3.08Å; R253-L414 HydrophobicContact CB-CD2 4.16Å; R253-L414 VanDerWaalsContact CZ-CD2 3.48Å; R253-T441 PolarHBondContact NH1-OG1 3.35Å; R253-T441 PolarHBondContact NH2-OG1 3.24Å
254	H	98.8	Very high	95.7	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.023	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-48.7	155.6	157.8	57.7	85.4	0	0	0	111.4	N260 S303 T304 C387 H388 L414	H254-N260 PolarHBondContact CE1-OD1 3.21Å; H254-S303 WeakPolarHBondContact CB-OG 3.37Å; H254-S303 VanDerWaalsContact CG-OG 3.25Å; H254-T304 HydrophobicContact CB-CG2 3.85Å; H254-C387 PolarHBondContact CD2-O 3.2Å; H254-C387 VanDerWaalsContact CD2-O 3.3Å; H254-C387 PolarHBondContact N-O 3.42Å; H254-H388 AromaticContact CD2-CE1 3.71Å; H254-H388 AromaticContact CD2-CG 3.95Å; H254-H388 AromaticContact CD2-ND1 3.17Å; H254-H388 PolarHBondContact CD2-ND1 2.99Å; H254-H388 AromaticContact NE2-ND1 3.37Å; H254-H388 PolarHBondContact NE2-ND1 3.34Å; H254-L414 WeakPolarHBondContact O-CD2 3.37Å
255	G	98.8	Very high	96.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-57.5	156.4	164.8	0	0	0	0	0	111.5	N257 L271 T307	G255-N257 PolarHBondContact O-N 2.89Å; G255-L271 WeakPolarHBondContact O-CD2 3.42Å; G255-T307 PolarHBondContact N-OG1 2.74Å
256	E	98.9	Very high	97.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-47.6	129.6	176.1	-176.5	-173.5	-106.5	0	0	110.9	N260 L261 S272 R274 G275 L414 H415 S438 V439	E256-N260 HydrophobicContact CG-CB 4.02Å; E256-L261 HydrophobicContact CG-CD2 4.37Å; E256-L261 HydrophobicContact CG-CG 4.48Å; E256-L261 WeakPolarHBondContact OE2-CD2 3.41Å; E256-S272 PolarHBondContact O-N 3.03Å; E256-S272 PolarHBondContact O-OG 2.96Å; E256-S272 PolarHBondContact OE2-OG 3.38Å; E256-R274 VanDerWaalsContact CD-NH2 3.31Å; E256-R274 IonicContact OE1-CZ 3.56Å; E256-R274 IonicContact OE1-NE 2.74Å; E256-R274 IonicContact OE1-NH2 3.27Å; E256-R274 PolarHBondContact OE1-NH2 2.98Å; E256-R274 IonicContact OE2-CZ 3.37Å; E256-R274 IonicContact OE2-NE 3.69Å; E256-R274 PolarHBondContact OE2-NE 2.89Å; E256-R274 IonicContact OE2-NH2 3.06Å; E256-R274 PolarHBondContact OE2-NH2 3.19Å; E256-R274 VanDerWaalsContact OE2-NH2 3.15Å; E256-G275 VanDerWaalsContact O-CA 3.31Å; E256-G275 WeakPolarHBondContact O-CA 3.48Å; E256-L414 HydrophobicContact CB-CD1 4.15Å; E256-L414 HydrophobicContact CG-CD1 4.25Å; E256-H415 PolarHBondContact N-NE2 3.36Å; E256-S438 WeakPolarHBondContact OE1-CA 3.26Å; E256-V439 HydrophobicContact CG-CG2 4.5Å; E256-V439 PolarHBondContact OE1-N 2.86Å
257	N	98.7	Very high	97.7	Very high	10 Å²	10	25.5 Å²	25.5	5%	0.053	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-108.8	170.8	177.8	72.3	8.3	0	0	0	111.8	G255 Y259 N260 L261 S269 G270	G255-N257 PolarHBondContact O-N 2.89Å; N257-Y259 VanDerWaalsContact C-N 3.25Å; N257-Y259 PolarHBondContact O-N 3.42Å; N257-Y259 PolarHBondContact OD1-N 2.92Å; N257-N260 PolarHBondContact N-OD1 2.96Å; N257-N260 WeakPolarHBondContact O-CB 3.4Å; N257-N260 PolarHBondContact O-N 3.37Å; N257-N260 VanDerWaalsContact O-N 3.14Å; N257-N260 WeakPolarHBondContact OD1-CB 3.26Å; N257-N260 PolarHBondContact OD1-N 2.98Å; N257-N260 PolarHBondContact OD1-ND2 3.27Å; N257-N260 VanDerWaalsContact OD1-ND2 3.1Å; N257-N260 PolarHBondContact OD1-OD1 3.21Å; N257-N260 VanDerWaalsContact OD1-OD1 3.08Å; N257-L261 PolarHBondContact O-N 3.34Å; N257-S269 VanDerWaalsContact CG-OG 3.27Å; N257-S269 PolarHBondContact ND2-OG 3.32Å; N257-G270 VanDerWaalsContact CA-O 3.31Å; N257-G270 WeakPolarHBondContact CA-O 3.22Å; N257-G270 VanDerWaalsContact CB-O 3.23Å; N257-G270 WeakPolarHBondContact CB-O 3.4Å
258	E	98.6	Very high	98	Very high	79 Å²	79	29.1 Å²	29.1	37%	0.369	16%	0.161	S	C	.	.	H	α-helix	trans	-60.1	-34.6	-178.1	-61.5	-59	156.5	0	0	112.7	L261 Q262 G270 S272	E258-L261 WeakPolarHBondContact O-CB 3.24Å; E258-L261 PolarHBondContact O-N 3.43Å; E258-Q262 WeakPolarHBondContact O-CG 3.49Å; E258-Q262 PolarHBondContact O-N 3.46Å; E258-G270 PolarHBondContact N-O 3.02Å; E258-G270 VanDerWaalsContact N-O 3.1Å; E258-S272 WeakPolarHBondContact OE1-CA 3.43Å
259	Y	98.5	Very high	98.1	Very high	41 Å²	41	28.8 Å²	28.8	16%	0.161	16%	0.16	C	C	.	.	H	α-helix	trans	-72.2	-29.9	177.7	-77.8	9	0	0	0	113.1	N257 L261 Q262 G263 K264 S269 E331	N257-Y259 VanDerWaalsContact C-N 3.25Å; N257-Y259 PolarHBondContact O-N 3.42Å; N257-Y259 PolarHBondContact OD1-N 2.92Å; Y259-L261 VanDerWaalsContact C-N 3.32Å; Y259-L261 PolarHBondContact O-N 3.25Å; Y259-Q262 CarbonylContact O-C 3.56Å; Y259-Q262 PolarHBondContact O-N 3.34Å; Y259-G263 PolarHBondContact O-N 3.22Å; Y259-K264 HydrophobicContact CD1-CD 4.25Å; Y259-K264 HydrophobicContact CD2-CB 4.14Å; Y259-K264 HydrophobicContact CE1-CD 4.33Å; Y259-K264 HydrophobicContact CG-CB 3.99Å; Y259-K264 HydrophobicContact CG-CD 4.45Å; Y259-K264 PolarHBondContact O-N 2.84Å; Y259-S269 WeakPolarHBondContact CB-OG 3.42Å; Y259-S269 PolarHBondContact N-OG 2.98Å; Y259-E331 HydrophobicContact CE2-CB 4.15Å; Y259-E331 HydrophobicContact CE2-CG 3.94Å
260	N	98.2	Very high	98.2	Very high	21 Å²	21	29.4 Å²	29.4	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-43.8	171.2	-59.7	156.1	0	0	0	110.7	H254 E256 N257 Q262 G263 L414 V439 T441	H254-N260 PolarHBondContact CE1-OD1 3.21Å; E256-N260 HydrophobicContact CG-CB 4.02Å; N257-N260 PolarHBondContact N-OD1 2.96Å; N257-N260 WeakPolarHBondContact O-CB 3.4Å; N257-N260 PolarHBondContact O-N 3.37Å; N257-N260 VanDerWaalsContact O-N 3.14Å; N257-N260 WeakPolarHBondContact OD1-CB 3.26Å; N257-N260 PolarHBondContact OD1-N 2.98Å; N257-N260 PolarHBondContact OD1-ND2 3.27Å; N257-N260 VanDerWaalsContact OD1-ND2 3.1Å; N257-N260 PolarHBondContact OD1-OD1 3.21Å; N257-N260 VanDerWaalsContact OD1-OD1 3.08Å; N260-Q262 PolarHBondContact O-N 2.83Å; N260-G263 PolarHBondContact O-N 3.18Å; N260-G263 VanDerWaalsContact O-N 3.13Å; N260-L414 HydrophobicContact CB-CD1 4.38Å; N260-V439 HydrophobicContact CB-CG2 3.78Å; N260-T441 HydrophobicContact CB-CG2 4.42Å
261	L	98.1	Very high	98.2	Very high	76 Å²	76	29.5 Å²	29.5	40%	0.398	17%	0.168	S	C	.	.	H	α-helix	trans	-60.1	-36.3	176.5	-66.5	178.6	0	0	0	112.6	E256 N257 E258 Y259 G263 V439	E256-L261 HydrophobicContact CG-CD2 4.37Å; E256-L261 HydrophobicContact CG-CG 4.48Å; E256-L261 WeakPolarHBondContact OE2-CD2 3.41Å; N257-L261 PolarHBondContact O-N 3.34Å; E258-L261 WeakPolarHBondContact O-CB 3.24Å; E258-L261 PolarHBondContact O-N 3.43Å; Y259-L261 VanDerWaalsContact C-N 3.32Å; Y259-L261 PolarHBondContact O-N 3.25Å; L261-G263 VanDerWaalsContact C-N 3.34Å; L261-V439 HydrophobicContact CD2-CG1 4.09Å
262	Q	98	Very high	98.2	Very high	98 Å²	98	29.6 Å²	29.6	46%	0.458	17%	0.168	S	C	.	.	H	α-helix	trans	-84.7	-6.2	179.8	-63.3	171.5	30.6	0	0	113.3	E258 Y259 N260 K264 T333	E258-Q262 WeakPolarHBondContact O-CG 3.49Å; E258-Q262 PolarHBondContact O-N 3.46Å; Y259-Q262 CarbonylContact O-C 3.56Å; Y259-Q262 PolarHBondContact O-N 3.34Å; N260-Q262 PolarHBondContact O-N 2.83Å; Q262-K264 VanDerWaalsContact C-N 3.26Å; Q262-K264 HydrophobicContact CB-CD 4.23Å; Q262-K264 HydrophobicContact CB-CG 4.1Å; Q262-K264 PolarHBondContact O-N 2.97Å; Q262-T333 WeakPolarHBondContact O-CG2 3.41Å
263	G	97.3	Very high	98.2	Very high	38 Å²	38	33.6 Å²	33.6	39%	0.392	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	14.8	-174.9	0	0	0	0	0	114.8	Y259 N260 L261 T333	Y259-G263 PolarHBondContact O-N 3.22Å; N260-G263 PolarHBondContact O-N 3.18Å; N260-G263 VanDerWaalsContact O-N 3.13Å; L261-G263 VanDerWaalsContact C-N 3.34Å; G263-T333 WeakPolarHBondContact O-CA 3.39Å
264	K	98.1	Very high	98.1	Very high	60 Å²	60	36.5 Å²	36.5	26%	0.261	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-83.1	145.4	-179.7	-69.2	179.7	168.4	-165.7	0	112.1	Y259 Q262 E331 L332 T333	Y259-K264 HydrophobicContact CD1-CD 4.25Å; Y259-K264 HydrophobicContact CD2-CB 4.14Å; Y259-K264 HydrophobicContact CE1-CD 4.33Å; Y259-K264 HydrophobicContact CG-CB 3.99Å; Y259-K264 HydrophobicContact CG-CD 4.45Å; Y259-K264 PolarHBondContact O-N 2.84Å; Q262-K264 VanDerWaalsContact C-N 3.26Å; Q262-K264 HydrophobicContact CB-CD 4.23Å; Q262-K264 HydrophobicContact CB-CG 4.1Å; Q262-K264 PolarHBondContact O-N 2.97Å; K264-E331 WeakPolarHBondContact CD-O 2.96Å; K264-E331 WeakPolarHBondContact CE-O 3.38Å; K264-E331 WeakPolarHBondContact CG-O 3.49Å; K264-L332 CarbonylContact C-O 3.6Å; K264-L332 WeakPolarHBondContact CA-O 3.39Å; K264-T333 HydrophobicContact CG-CG2 3.88Å
265	I	97.3	Very high	98.1	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.128	21%	0.206	C	C	.	.			trans	-98.5	157.6	174.4	70.3	172.1	0	0	0	111.4	A326 C329 E331 L332 Y334 I337	I265-A326 HydrophobicContact CD1-CB 3.64Å; I265-A326 HydrophobicContact CG1-CB 4.23Å; I265-C329 HydrophobicContact CD1-CB 4.46Å; I265-C329 WeakPolarHBondContact CG1-O 3.41Å; I265-E331 WeakPolarHBondContact O-CA 3.24Å; I265-E331 PolarHBondContact O-N 2.76Å; I265-L332 PolarHBondContact N-O 3.36Å; I265-Y334 HydrophobicContact CG2-CD2 4.14Å; I265-Y334 HydrophobicContact CG2-CE1 4.42Å; I265-Y334 HydrophobicContact CG2-CE2 3.57Å; I265-I337 HydrophobicContact CD1-CD1 3.53Å; I265-I337 HydrophobicContact CG1-CD1 4.21Å
266	G	95.8	Very high	98.1	Very high	23 Å²	23	42 Å²	42	24%	0.237	23%	0.231	C	C	.	.	S	Bend	trans	68.8	-152.1	177.3	0	0	0	0	0	114.3	E330	G266-E330 WeakPolarHBondContact CA-OE1 3.35Å; G266-E330 WeakPolarHBondContact CA-OE2 3.1Å
267	G	96.2	Very high	98.1	Very high	15 Å²	15	48.3 Å²	48.3	16%	0.155	26%	0.259	C	S	.	.	S	Bend	trans	68	-174.3	177.6	0	0	0	0	0	115.2	E330	G267-E330 PolarHBondContact N-OE2 2.73Å
268	D	98.2	Very high	98.2	Very high	86 Å²	86	47.9 Å²	47.9	46%	0.46	26%	0.256	S	S	.	.			trans	-128.5	41.9	-176.5	-166.1	30.5	0	0	0	113	L301 K302	D268-L301 HydrophobicContact CB-CD2 4.34Å; D268-L301 WeakPolarHBondContact OD1-CA 3.49Å; D268-L301 WeakPolarHBondContact OD1-CB 3.47Å; D268-K302 VanDerWaalsContact OD1-CB 3.3Å; D268-K302 WeakPolarHBondContact OD1-CB 3.46Å; D268-K302 PolarHBondContact OD1-N 3.38Å
269	S	98.3	Very high	98.2	Very high	15 Å²	15	44.2 Å²	44.2	11%	0.105	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-69.8	147.5	179.7	68.4	0	0	0	0	112.9	N257 Y259	N257-S269 VanDerWaalsContact CG-OG 3.27Å; N257-S269 PolarHBondContact ND2-OG 3.32Å; Y259-S269 WeakPolarHBondContact CB-OG 3.42Å; Y259-S269 PolarHBondContact N-OG 2.98Å
270	G	98.5	Very high	98.2	Very high	14 Å²	14	47.3 Å²	47.3	14%	0.144	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-77.9	170	177.6	0	0	0	0	0	113.7	N257 E258	N257-G270 VanDerWaalsContact CA-O 3.31Å; N257-G270 WeakPolarHBondContact CA-O 3.22Å; N257-G270 VanDerWaalsContact CB-O 3.23Å; N257-G270 WeakPolarHBondContact CB-O 3.4Å; E258-G270 PolarHBondContact N-O 3.02Å; E258-G270 VanDerWaalsContact N-O 3.1Å
271	L	98.8	Very high	98.2	Very high	9 Å²	9	47.6 Å²	47.6	5%	0.047	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-62	138	177.8	-65.3	-177.9	0	0	0	112.9	G255 K276 A279 Q306	G255-L271 WeakPolarHBondContact O-CD2 3.42Å; L271-K276 HydrophobicContact CB-CG 3.99Å; L271-K276 HydrophobicContact CD1-CG 4.35Å; L271-A279 HydrophobicContact CD1-CB 4.38Å; L271-Q306 HydrophobicContact CD1-CB 3.62Å; L271-Q306 HydrophobicContact CG-CB 3.86Å
272	S	98.8	Very high	98.2	Very high	1 Å²	1	44 Å²	44	1%	0.007	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-68.4	173.3	167	85	0	0	0	0	111.1	E256 E258 R274 G275 K276	E256-S272 PolarHBondContact O-N 3.03Å; E256-S272 PolarHBondContact O-OG 2.96Å; E256-S272 PolarHBondContact OE2-OG 3.38Å; E258-S272 WeakPolarHBondContact OE1-CA 3.43Å; S272-R274 PolarHBondContact O-N 3.31Å; S272-R274 PolarHBondContact OG-N 3.02Å; S272-G275 PolarHBondContact O-N 3.45Å; S272-G275 PolarHBondContact OG-N 3.38Å; S272-G275 VanDerWaalsContact OG-N 3.08Å; S272-K276 WeakPolarHBondContact O-CG 3.08Å; S272-K276 PolarHBondContact O-N 2.84Å
273	S	98.6	Very high	98.3	Very high	85 Å²	85	39.9 Å²	39.9	59%	0.594	23%	0.227	S	C	*	.	H	α-helix	trans	-58.4	-36	172.4	65.3	0	0	0	0	112.4	K277	S273-K277 WeakPolarHBondContact O-CG 3.48Å; S273-K277 PolarHBondContact O-N 3.4Å
274	R	98.7	Very high	98.3	Very high	65 Å²	65	44.1 Å²	44.1	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-74.9	-37.6	175.1	-62.1	-173.2	-66.9	-163.6	-2	111.6	E256 S272 K276 K277 F278 V436 E437	E256-R274 VanDerWaalsContact CD-NH2 3.31Å; E256-R274 IonicContact OE1-CZ 3.56Å; E256-R274 IonicContact OE1-NE 2.74Å; E256-R274 IonicContact OE1-NH2 3.27Å; E256-R274 PolarHBondContact OE1-NH2 2.98Å; E256-R274 IonicContact OE2-CZ 3.37Å; E256-R274 IonicContact OE2-NE 3.69Å; E256-R274 PolarHBondContact OE2-NE 2.89Å; E256-R274 IonicContact OE2-NH2 3.06Å; E256-R274 PolarHBondContact OE2-NH2 3.19Å; E256-R274 VanDerWaalsContact OE2-NH2 3.15Å; S272-R274 PolarHBondContact O-N 3.31Å; S272-R274 PolarHBondContact OG-N 3.02Å; R274-K276 VanDerWaalsContact C-N 3.3Å; R274-K276 PolarHBondContact O-N 3.27Å; R274-K277 WeakPolarHBondContact O-CB 3Å; R274-K277 PolarHBondContact O-N 2.92Å; R274-K277 VanDerWaalsContact O-N 3.11Å; R274-F278 PolarHBondContact O-N 3.45Å; R274-V436 HydrophobicContact CB-CG1 4.32Å; R274-V436 WeakPolarHBondContact O-CG1 3.31Å; R274-E437 WeakPolarHBondContact CD-O 3.42Å
275	G	98.8	Very high	98.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58	-40.9	173.4	0	0	0	0	0	113	E256 S272 F278 A279	E256-G275 VanDerWaalsContact O-CA 3.31Å; E256-G275 WeakPolarHBondContact O-CA 3.48Å; S272-G275 PolarHBondContact O-N 3.45Å; S272-G275 PolarHBondContact OG-N 3.38Å; S272-G275 VanDerWaalsContact OG-N 3.08Å; G275-F278 WeakPolarHBondContact O-CB 3.46Å; G275-F278 PolarHBondContact O-N 3.28Å; G275-A279 PolarHBondContact O-N 3.03Å
276	K	98.9	Very high	98.4	Very high	121 Å²	121	41.6 Å²	41.6	53%	0.526	23%	0.225	S	C	.	.	H	α-helix	trans	-65	-38.6	174.2	-66.7	174.3	-172.7	176.5	0	112.6	L271 S272 R274 A279 N280	L271-K276 HydrophobicContact CB-CG 3.99Å; L271-K276 HydrophobicContact CD1-CG 4.35Å; S272-K276 WeakPolarHBondContact O-CG 3.08Å; S272-K276 PolarHBondContact O-N 2.84Å; R274-K276 VanDerWaalsContact C-N 3.3Å; R274-K276 PolarHBondContact O-N 3.27Å; K276-A279 PolarHBondContact O-N 2.9Å; K276-N280 PolarHBondContact O-N 2.91Å; K276-N280 PolarHBondContact O-ND2 3.24Å
277	K	98.8	Very high	98.4	Very high	133 Å²	133	46.9 Å²	46.9	58%	0.578	24%	0.243	S	C	*	.	H	α-helix	trans	-62.9	-42.1	173.3	-70.1	176.4	-176.9	-180	0	111.4	S273 R274 N280 A281 V436	S273-K277 WeakPolarHBondContact O-CG 3.48Å; S273-K277 PolarHBondContact O-N 3.4Å; R274-K277 WeakPolarHBondContact O-CB 3Å; R274-K277 PolarHBondContact O-N 2.92Å; R274-K277 VanDerWaalsContact O-N 3.11Å; K277-N280 PolarHBondContact O-N 3.04Å; K277-A281 PolarHBondContact O-N 3.44Å; K277-V436 HydrophobicContact CB-CG1 3.87Å; K277-V436 HydrophobicContact CB-CG2 4.29Å
278	F	98.9	Very high	98.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-43.8	174.4	166.4	-103.8	0	0	0	112	C252 R274 G275 N280 A281 L282 T307 H415 L434 V436	C252-F278 HydrophobicContact CB-CZ 4.47Å; R274-F278 PolarHBondContact O-N 3.45Å; G275-F278 WeakPolarHBondContact O-CB 3.46Å; G275-F278 PolarHBondContact O-N 3.28Å; F278-N280 VanDerWaalsContact C-N 3.29Å; F278-N280 PolarHBondContact O-N 2.63Å; F278-A281 CarbonylContact O-C 3.6Å; F278-A281 PolarHBondContact O-N 2.62Å; F278-A281 VanDerWaalsContact O-N 3.08Å; F278-L282 HydrophobicContact CE1-CD2 4.24Å; F278-L282 HydrophobicContact CE2-CB 4.48Å; F278-L282 HydrophobicContact CZ-CB 4.36Å; F278-L282 HydrophobicContact CZ-CD1 4.44Å; F278-L282 HydrophobicContact CZ-CD2 4.18Å; F278-L282 WeakPolarHBondContact O-CB 3.36Å; F278-L282 PolarHBondContact O-N 2.78Å; F278-T307 HydrophobicContact CD1-CG2 4.21Å; F278-T307 HydrophobicContact CE1-CG2 3.88Å; F278-H415 HydrophobicContact CB-CB 4.42Å; F278-H415 WeakPolarHBondContact CB-CD2 3.27Å; F278-H415 AromaticContact CD1-CD2 3.78Å; F278-H415 VanDerWaalsContact CD2-CA 3.41Å; F278-H415 HydrophobicContact CD2-CB 3.56Å; F278-H415 AromaticContact CD2-CD2 3.75Å; F278-H415 AromaticContact CD2-CG 3.75Å; F278-H415 HydrophobicContact CE2-CB 4.05Å; F278-H415 HydrophobicContact CG-CB 4.09Å; F278-H415 AromaticContact CG-CD2 3.32Å; F278-H415 WeakPolarHBondContact CG-CD2 3.41Å; F278-H415 AromaticContact CG-CG 3.74Å; F278-H415 AromaticContact CG-NE2 3.95Å; F278-L434 HydrophobicContact CD2-CB 4.28Å; F278-L434 HydrophobicContact CD2-CD1 4.07Å; F278-L434 HydrophobicContact CE2-CB 4.36Å; F278-L434 HydrophobicContact CE2-CD1 3.6Å; F278-L434 HydrophobicContact CE2-CG 4.11Å; F278-V436 HydrophobicContact CB-CB 4.38Å; F278-V436 HydrophobicContact CB-CG1 4.36Å
279	A	98.9	Very high	98.3	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-42.2	178.3	0	0	0	0	0	112	L271 G275 K276 L282 S283 T307 A310	L271-A279 HydrophobicContact CD1-CB 4.38Å; G275-A279 PolarHBondContact O-N 3.03Å; K276-A279 PolarHBondContact O-N 2.9Å; A279-L282 PolarHBondContact O-N 2.53Å; A279-S283 PolarHBondContact O-N 3.37Å; A279-T307 HydrophobicContact CB-CG2 4.2Å; A279-A310 HydrophobicContact CB-CB 3.59Å
280	N	98.8	Very high	98.1	Very high	105 Å²	105	56.8 Å²	56.8	56%	0.561	29%	0.286	S	S	*	.	H	α-helix	trans	-66.5	-40.7	173.9	-67	-26.9	0	0	0	112.6	K276 K277 F278 L282 S283 K284	K276-N280 PolarHBondContact O-N 2.91Å; K276-N280 PolarHBondContact O-ND2 3.24Å; K277-N280 PolarHBondContact O-N 3.04Å; F278-N280 VanDerWaalsContact C-N 3.29Å; F278-N280 PolarHBondContact O-N 2.63Å; N280-L282 VanDerWaalsContact C-N 3.3Å; N280-L282 PolarHBondContact O-N 3.27Å; N280-S283 WeakPolarHBondContact O-CB 2.89Å; N280-S283 PolarHBondContact O-N 2.88Å; N280-K284 PolarHBondContact O-N 2.7Å; N280-K284 VanDerWaalsContact O-N 3.13Å
281	A	98.8	Very high	97.8	Very high	27 Å²	27	58.3 Å²	58.3	22%	0.223	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-35.7	175.8	0	0	0	0	0	111.9	K277 F278 K284 F285 L434 V436	K277-A281 PolarHBondContact O-N 3.44Å; F278-A281 CarbonylContact O-C 3.6Å; F278-A281 PolarHBondContact O-N 2.62Å; F278-A281 VanDerWaalsContact O-N 3.08Å; A281-K284 PolarHBondContact O-N 2.64Å; A281-F285 WeakPolarHBondContact O-CB 3.28Å; A281-F285 PolarHBondContact O-N 2.76Å; A281-L434 HydrophobicContact CB-CB 4.07Å; A281-L434 HydrophobicContact CB-CD1 4.4Å; A281-V436 HydrophobicContact CB-CG2 4.17Å
282	L	98.8	Very high	97.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-40.8	174.5	-174.8	65.5	0	0	0	111.4	F278 A279 N280 K284 F285 V286 T307 L311 L384 I386 V417 L434	F278-L282 HydrophobicContact CE1-CD2 4.24Å; F278-L282 HydrophobicContact CE2-CB 4.48Å; F278-L282 HydrophobicContact CZ-CB 4.36Å; F278-L282 HydrophobicContact CZ-CD1 4.44Å; F278-L282 HydrophobicContact CZ-CD2 4.18Å; F278-L282 WeakPolarHBondContact O-CB 3.36Å; F278-L282 PolarHBondContact O-N 2.78Å; A279-L282 PolarHBondContact O-N 2.53Å; N280-L282 VanDerWaalsContact C-N 3.3Å; N280-L282 PolarHBondContact O-N 3.27Å; L282-K284 PolarHBondContact O-N 2.8Å; L282-F285 HydrophobicContact CD1-CD1 4.28Å; L282-F285 PolarHBondContact O-N 2.83Å; L282-V286 WeakPolarHBondContact O-CB 3.39Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 3.35Å; L282-V286 PolarHBondContact O-N 3.18Å; L282-T307 HydrophobicContact CD2-CG2 3.86Å; L282-L311 HydrophobicContact CB-CD2 4.24Å; L282-L311 HydrophobicContact CD2-CD2 4.17Å; L282-L311 HydrophobicContact CG-CD2 3.9Å; L282-L384 HydrophobicContact CD2-CD2 4.45Å; L282-I386 HydrophobicContact CD2-CD1 4.06Å; L282-V417 HydrophobicContact CD1-CG2 3.57Å; L282-L434 HydrophobicContact CB-CD1 3.95Å; L282-L434 HydrophobicContact CD1-CD1 3.9Å
283	S	98.6	Very high	96.9	Very high	12 Å²	12	70.9 Å²	70.9	8%	0.084	35%	0.35	C	S	.	.	H	α-helix	trans	-56.5	-50.8	172.9	-167.5	0	0	0	0	111.1	A279 N280 F285 V286 E287 A310 L311	A279-S283 PolarHBondContact O-N 3.37Å; N280-S283 WeakPolarHBondContact O-CB 2.89Å; N280-S283 PolarHBondContact O-N 2.88Å; S283-F285 VanDerWaalsContact C-N 3.34Å; S283-F285 PolarHBondContact O-N 2.84Å; S283-V286 PolarHBondContact O-N 3.12Å; S283-E287 WeakPolarHBondContact O-CG 3.3Å; S283-E287 PolarHBondContact O-N 3.25Å; S283-E287 PolarHBondContact OG-OE1 2.97Å; S283-A310 PolarHBondContact OG-O 3.24Å; S283-L311 VanDerWaalsContact CA-CD2 3.46Å
284	K	98.3	Very high	96.8	Very high	127 Å²	127	68 Å²	68	55%	0.552	33%	0.328	S	S	*	.	H	α-helix	trans	-60.3	-44.4	178.3	-167.9	-172.2	-178	-151.3	0	111.9	N280 A281 L282 V286 E287 E288	N280-K284 PolarHBondContact O-N 2.7Å; N280-K284 VanDerWaalsContact O-N 3.13Å; A281-K284 PolarHBondContact O-N 2.64Å; L282-K284 PolarHBondContact O-N 2.8Å; K284-V286 VanDerWaalsContact C-N 3.35Å; K284-V286 PolarHBondContact O-N 3.46Å; K284-E287 PolarHBondContact O-N 3.12Å; K284-E288 WeakPolarHBondContact CE-OE1 3.06Å; K284-E288 IonicContact NZ-OE1 3.87Å; K284-E288 PolarHBondContact NZ-OE1 3.09Å; K284-E288 VanDerWaalsContact O-CG 3.28Å; K284-E288 WeakPolarHBondContact O-CG 3.44Å; K284-E288 PolarHBondContact O-N 2.95Å
285	F	98.4	Very high	96.7	Very high	15 Å²	15	71.4 Å²	71.4	7%	0.066	34%	0.341	C	S	.	.	H	α-helix	trans	-58.8	-45.7	176.2	169.7	-95.8	0	0	0	111.8	Y250 A281 L282 S283 E288 Q289 V417 I432 L434	Y250-F285 AromaticContact CD1-CE1 3.91Å; Y250-F285 HydrophobicContact CD1-CE1 3.91Å; Y250-F285 HydrophobicContact CD1-CZ 4.18Å; Y250-F285 AromaticContact CE1-CE1 3.87Å; Y250-F285 HydrophobicContact CE1-CE1 3.87Å; Y250-F285 AromaticContact CE1-CZ 3.86Å; Y250-F285 HydrophobicContact CE1-CZ 3.86Å; A281-F285 WeakPolarHBondContact O-CB 3.28Å; A281-F285 PolarHBondContact O-N 2.76Å; L282-F285 HydrophobicContact CD1-CD1 4.28Å; L282-F285 PolarHBondContact O-N 2.83Å; S283-F285 VanDerWaalsContact C-N 3.34Å; S283-F285 PolarHBondContact O-N 2.84Å; F285-E288 PolarHBondContact O-N 2.84Å; F285-Q289 HydrophobicContact CD1-CG 4.38Å; F285-Q289 HydrophobicContact CE1-CG 3.9Å; F285-Q289 HydrophobicContact CE2-CG 4.31Å; F285-Q289 HydrophobicContact CZ-CG 3.87Å; F285-Q289 WeakPolarHBondContact O-CG 3.05Å; F285-Q289 PolarHBondContact O-N 3.5Å; F285-Q289 VanDerWaalsContact O-N 3.09Å; F285-V417 HydrophobicContact CD1-CG2 4.26Å; F285-V417 HydrophobicContact CE1-CB 4.32Å; F285-V417 HydrophobicContact CE1-CG1 3.88Å; F285-V417 HydrophobicContact CE1-CG2 4.19Å; F285-V417 HydrophobicContact CZ-CB 4.49Å; F285-V417 HydrophobicContact CZ-CG1 4.17Å; F285-I432 HydrophobicContact CD2-CG2 4.35Å; F285-I432 HydrophobicContact CE2-CB 4.34Å; F285-I432 HydrophobicContact CE2-CG1 4.37Å; F285-I432 HydrophobicContact CE2-CG2 3.98Å; F285-I432 HydrophobicContact CZ-CD1 4.34Å; F285-L434 HydrophobicContact CB-CD1 4.18Å; F285-L434 HydrophobicContact CB-CD2 4.01Å; F285-L434 HydrophobicContact CD2-CD2 3.94Å; F285-L434 HydrophobicContact CG-CD2 4Å
286	V	97.8	Very high	96.7	Very high	18 Å²	18	71.6 Å²	71.6	11%	0.109	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-43.5	178.9	167.7	0	0	0	0	111.2	L282 S283 K284 E288 Q289 L294 L311 L313 L384	L282-V286 WeakPolarHBondContact O-CB 3.39Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 3.35Å; L282-V286 PolarHBondContact O-N 3.18Å; S283-V286 PolarHBondContact O-N 3.12Å; K284-V286 VanDerWaalsContact C-N 3.35Å; K284-V286 PolarHBondContact O-N 3.46Å; V286-E288 VanDerWaalsContact C-N 3.34Å; V286-E288 PolarHBondContact O-N 3.31Å; V286-Q289 PolarHBondContact O-N 3.44Å; V286-L294 HydrophobicContact CG1-CD2 3.49Å; V286-L294 VanDerWaalsContact CG1-CD2 3.49Å; V286-L294 HydrophobicContact CG2-CD2 4.4Å; V286-L311 HydrophobicContact CG2-CD2 4.42Å; V286-L313 HydrophobicContact CG1-CD1 4.05Å; V286-L384 HydrophobicContact CG2-CD2 3.96Å
287	E	96.8	Very high	96.7	Very high	133 Å²	133	66 Å²	66	62%	0.621	32%	0.318	S	S	*	.	H	α-helix	trans	-58.9	-44.4	174.4	-72.1	167.9	-155	0	0	111.5	S283 K284 Q289 N290	S283-E287 WeakPolarHBondContact O-CG 3.3Å; S283-E287 PolarHBondContact O-N 3.25Å; S283-E287 PolarHBondContact OG-OE1 2.97Å; K284-E287 PolarHBondContact O-N 3.12Å; E287-Q289 VanDerWaalsContact C-N 3.28Å; E287-Q289 PolarHBondContact O-N 3.21Å; E287-N290 PolarHBondContact O-N 3.02Å; E287-N290 VanDerWaalsContact O-N 3.09Å
288	E	97.1	Very high	96.8	Very high	120 Å²	120	59.7 Å²	59.7	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-65.5	-25.9	178.3	-72.3	169.8	-176	0	0	113.4	K284 F285 V286 N290	K284-E288 WeakPolarHBondContact CE-OE1 3.06Å; K284-E288 IonicContact NZ-OE1 3.87Å; K284-E288 PolarHBondContact NZ-OE1 3.09Å; K284-E288 VanDerWaalsContact O-CG 3.28Å; K284-E288 WeakPolarHBondContact O-CG 3.44Å; K284-E288 PolarHBondContact O-N 2.95Å; F285-E288 PolarHBondContact O-N 2.84Å; V286-E288 VanDerWaalsContact C-N 3.34Å; V286-E288 PolarHBondContact O-N 3.31Å; E288-N290 PolarHBondContact O-N 3.27Å
289	Q	95.9	Very high	96.7	Very high	54 Å²	54	59.7 Å²	59.7	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-71.9	-18.2	174.7	-62.4	-53.5	-79.8	0	0	112.9	Y250 F285 V286 E287 L291	Y250-Q289 HydrophobicContact CE1-CG 4.17Å; Y250-Q289 PolarHBondContact OH-OE1 2.85Å; F285-Q289 HydrophobicContact CD1-CG 4.38Å; F285-Q289 HydrophobicContact CE1-CG 3.9Å; F285-Q289 HydrophobicContact CE2-CG 4.31Å; F285-Q289 HydrophobicContact CZ-CG 3.87Å; F285-Q289 WeakPolarHBondContact O-CG 3.05Å; F285-Q289 PolarHBondContact O-N 3.5Å; F285-Q289 VanDerWaalsContact O-N 3.09Å; V286-Q289 PolarHBondContact O-N 3.44Å; E287-Q289 VanDerWaalsContact C-N 3.28Å; E287-Q289 PolarHBondContact O-N 3.21Å; Q289-L291 VanDerWaalsContact C-N 3.27Å; Q289-L291 HydrophobicContact CB-CD1 3.94Å; Q289-L291 HydrophobicContact CB-CD2 4.31Å; Q289-L291 HydrophobicContact CB-CG 3.71Å; Q289-L291 PolarHBondContact O-N 3.43Å
290	N	94	Very high	96.7	Very high	150 Å²	150	63.9 Å²	63.9	80%	0.802	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	46.3	179	-167.1	34.5	0	0	0	113.6	E287 E288	E287-N290 PolarHBondContact O-N 3.02Å; E287-N290 VanDerWaalsContact O-N 3.09Å; E288-N290 PolarHBondContact O-N 3.27Å
291	L	91.7	Very high	96.7	Very high	46 Å²	46	60.4 Å²	60.4	24%	0.241	29%	0.29	C	S	.	.			trans	-82.8	132.8	-176.2	-60.3	169.7	0	0	0	110.9	Y250 Q289 L294	Y250-L291 HydrophobicContact CD2-CD1 4.19Å; Y250-L291 HydrophobicContact CE2-CD1 3.3Å; Q289-L291 VanDerWaalsContact C-N 3.27Å; Q289-L291 HydrophobicContact CB-CD1 3.94Å; Q289-L291 HydrophobicContact CB-CD2 4.31Å; Q289-L291 HydrophobicContact CB-CG 3.71Å; Q289-L291 PolarHBondContact O-N 3.43Å; L291-L294 HydrophobicContact CB-CB 4.4Å; L291-L294 HydrophobicContact CD1-CD1 4.07Å; L291-L294 HydrophobicContact CD1-CD2 4.45Å
292	K	87.3	Confident	96.7	Very high	160 Å²	160	63.9 Å²	63.9	70%	0.696	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	137.9	167.9	-163.7	-171.1	172.4	-166.7	0	109.8	L294 N382	K292-L294 VanDerWaalsContact C-N 3.33Å; K292-L294 PolarHBondContact O-N 3.38Å; K292-N382 PolarHBondContact O-ND2 3.37Å
293	D	90.2	Very high	96.7	Very high	115 Å²	115	64 Å²	64	62%	0.615	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	40.1	169.9	-57.3	-39.8	0	0	0	115.1	R295	D293-R295 PolarHBondContact O-N 3.23Å
294	L	96.9	Very high	96.7	Very high	24 Å²	24	63.4 Å²	63.4	13%	0.126	30%	0.297	C	S	.	.			trans	-63.5	120.5	176.9	179.5	65.5	0	0	0	111.4	V286 L291 K292 V296 L313 N382 L384	V286-L294 HydrophobicContact CG1-CD2 3.49Å; V286-L294 VanDerWaalsContact CG1-CD2 3.49Å; V286-L294 HydrophobicContact CG2-CD2 4.4Å; L291-L294 HydrophobicContact CB-CB 4.4Å; L291-L294 HydrophobicContact CD1-CD1 4.07Å; L291-L294 HydrophobicContact CD1-CD2 4.45Å; K292-L294 VanDerWaalsContact C-N 3.33Å; K292-L294 PolarHBondContact O-N 3.38Å; L294-V296 HydrophobicContact CD2-CG2 4.44Å; L294-V296 HydrophobicContact CG-CG2 4.4Å; L294-L313 HydrophobicContact CD2-CD1 4.24Å; L294-N382 HydrophobicContact CD1-CB 4.17Å; L294-L384 HydrophobicContact CD1-CB 4.1Å; L294-L384 HydrophobicContact CD2-CB 4.36Å; L294-L384 HydrophobicContact CG-CB 4.49Å
295	R	98.1	Very high	96.8	Very high	137 Å²	137	58.6 Å²	58.6	52%	0.517	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137	168.4	-60.1	-59.3	-171.9	116.1	-1.5	110.3	D293 N382 V383 L384	D293-R295 PolarHBondContact O-N 3.23Å; R295-N382 PolarHBondContact N-O 3.19Å; R295-V383 HydrophobicContact CB-CG1 4.46Å; R295-V383 HydrophobicContact CB-CG2 4.34Å; R295-V383 CarbonylContact O-C 3.19Å; R295-V383 WeakPolarHBondContact O-CA 3.28Å; R295-L384 PolarHBondContact O-N 3.49Å
296	V	98.8	Very high	96.8	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.024	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.4	176.6	-176.3	0	0	0	0	109.6	L294 A308 L311 L313 Y315 E316 L384 I386	L294-V296 HydrophobicContact CD2-CG2 4.44Å; L294-V296 HydrophobicContact CG-CG2 4.4Å; V296-A308 HydrophobicContact CG1-CB 4.28Å; V296-L311 HydrophobicContact CG1-CD1 4.05Å; V296-L311 HydrophobicContact CG2-CD1 4.25Å; V296-L313 HydrophobicContact CG2-CB 4.32Å; V296-L313 HydrophobicContact CG2-CD1 4.29Å; V296-Y315 CarbonylContact O-C 3.52Å; V296-Y315 WeakPolarHBondContact O-CA 3.23Å; V296-Y315 WeakPolarHBondContact O-CB 3.46Å; V296-E316 PolarHBondContact O-N 3.38Å; V296-L384 CarbonylContact C-O 3.48Å; V296-L384 WeakPolarHBondContact CA-O 3.37Å; V296-L384 HydrophobicContact CG1-CD2 4.46Å; V296-L384 HydrophobicContact CG2-CB 4.48Å; V296-L384 HydrophobicContact CG2-CD2 4.49Å; V296-I386 HydrophobicContact CG1-CD1 4.22Å
297	W	98.9	Very high	96.8	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.015	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.1	176.2	-62.4	-16.9	0	0	0	111.3	E316 W318 L321 V373 E376 L377 Q380 V383 L384 V385 I386	W297-E316 WeakPolarHBondContact CA-O 3.31Å; W297-E316 PolarHBondContact NE1-OE2 3.41Å; W297-W318 AromaticContact CD1-NE1 3.74Å; W297-W318 AromaticContact CD2-NE1 3.9Å; W297-W318 AromaticContact CG-NE1 3.8Å; W297-W318 HydrophobicContact CZ2-CZ2 4.36Å; W297-W318 AromaticContact NE1-NE1 3.83Å; W297-L321 HydrophobicContact CB-CD1 3.99Å; W297-V373 HydrophobicContact CE3-CG1 4.24Å; W297-V373 HydrophobicContact CZ3-CG1 3.94Å; W297-E376 HydrophobicContact CH2-CB 3.65Å; W297-E376 HydrophobicContact CH2-CG 3.37Å; W297-E376 HydrophobicContact CZ2-CB 4.29Å; W297-E376 HydrophobicContact CZ2-CG 3.51Å; W297-E376 HydrophobicContact CZ3-CB 4.42Å; W297-E376 HydrophobicContact CZ3-CG 4.47Å; W297-L377 HydrophobicContact CE3-CD2 4.09Å; W297-L377 HydrophobicContact CH2-CD2 3.91Å; W297-L377 HydrophobicContact CH2-CG 4.13Å; W297-L377 HydrophobicContact CZ3-CD2 3.47Å; W297-L377 VanDerWaalsContact CZ3-CD2 3.47Å; W297-L377 HydrophobicContact CZ3-CG 3.61Å; W297-Q380 HydrophobicContact CH2-CG 4.24Å; W297-Q380 HydrophobicContact CZ2-CG 3.9Å; W297-V383 HydrophobicContact CD2-CG1 3.91Å; W297-V383 HydrophobicContact CE3-CG1 4.13Å; W297-V383 HydrophobicContact CG-CG1 4.33Å; W297-V383 HydrophobicContact CZ2-CG1 4.4Å; W297-V383 HydrophobicContact CZ3-CG1 4.47Å; W297-L384 PolarHBondContact N-O 3.2Å; W297-V385 HydrophobicContact CE3-CG2 4.05Å; W297-I386 PolarHBondContact O-N 3.22Å
298	T	98.9	Very high	96.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	166.1	175.6	69.8	0	0	0	0	110.8	A308 Y315 E316 W318 I386	T298-A308 HydrophobicContact CG2-CB 3.45Å; T298-A308 VanDerWaalsContact CG2-CB 3.45Å; T298-Y315 HydrophobicContact CG2-CD2 3.89Å; T298-Y315 HydrophobicContact CG2-CG 4.35Å; T298-E316 PolarHBondContact N-O 3.21Å; T298-W318 PolarHBondContact O-N 3.13Å; T298-I386 WeakPolarHBondContact CA-O 3.42Å; T298-I386 HydrophobicContact CG2-CB 4.46Å
299	S	98.8	Very high	97	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.			trans	-70.2	-176.9	158.1	83	0	0	0	0	111.1	L301 T304 L321 N322 H388	S299-L301 VanDerWaalsContact C-N 3.33Å; S299-L301 WeakPolarHBondContact OG-CB 3.33Å; S299-L301 PolarHBondContact OG-N 3.44Å; S299-T304 PolarHBondContact N-OG1 3.47Å; S299-T304 WeakPolarHBondContact OG-CG2 3.34Å; S299-T304 PolarHBondContact OG-OG1 3.34Å; S299-L321 VanDerWaalsContact CB-C 3.49Å; S299-L321 VanDerWaalsContact CB-O 3.3Å; S299-L321 WeakPolarHBondContact CB-O 3.5Å; S299-N322 WeakPolarHBondContact CB-OD1 3.38Å; S299-H388 WeakPolarHBondContact CB-NE2 3.46Å; S299-H388 PolarHBondContact OG-NE2 2.84Å
300	Q	98.8	Very high	97.1	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.421	25%	0.245	S	C	.	.	S	Bend	trans	-89.8	1.6	168	-68.5	-178.7	-20.8	0	0	113.1	Q317 K319 N322	Q300-Q317 HydrophobicContact CG-CB 4.1Å; Q300-K319 HydrophobicContact CG-CB 4.41Å; Q300-N322 PolarHBondContact N-OD1 3.32Å
301	L	98.8	Very high	97.3	Very high	33 Å²	33	44.4 Å²	44.4	17%	0.173	21%	0.209	C	C	.	.	S	Bend	trans	-86.4	140	179.2	-57.6	-178.5	0	0	0	111.4	D268 S299 S303 T304 I305 N322 E323	D268-L301 HydrophobicContact CB-CD2 4.34Å; D268-L301 WeakPolarHBondContact OD1-CA 3.49Å; D268-L301 WeakPolarHBondContact OD1-CB 3.47Å; S299-L301 VanDerWaalsContact C-N 3.33Å; S299-L301 WeakPolarHBondContact OG-CB 3.33Å; S299-L301 PolarHBondContact OG-N 3.44Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-S303 PolarHBondContact O-N 2.97Å; L301-T304 PolarHBondContact O-N 2.74Å; L301-T304 VanDerWaalsContact O-N 3.11Å; L301-T304 PolarHBondContact O-OG1 2.76Å; L301-I305 PolarHBondContact O-N 3.24Å; L301-N322 HydrophobicContact CD1-CB 4.39Å; L301-N322 HydrophobicContact CG-CB 4.43Å; L301-E323 HydrophobicContact CD1-CB 4.37Å
302	K	98.7	Very high	97.5	Very high	99 Å²	99	53.1 Å²	53.1	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-51.5	-43.3	-169.5	-173.5	177.4	-176.7	174.7	0	113.5	D268 T304 I305 Q306	D268-K302 VanDerWaalsContact OD1-CB 3.3Å; D268-K302 WeakPolarHBondContact OD1-CB 3.46Å; D268-K302 PolarHBondContact OD1-N 3.38Å; K302-T304 VanDerWaalsContact C-N 3.35Å; K302-T304 PolarHBondContact O-N 2.82Å; K302-I305 PolarHBondContact O-N 2.62Å; K302-Q306 HydrophobicContact CG-CG 4.16Å; K302-Q306 WeakPolarHBondContact O-CB 3.48Å; K302-Q306 VanDerWaalsContact O-CG 3.28Å; K302-Q306 WeakPolarHBondContact O-CG 3.36Å; K302-Q306 PolarHBondContact O-N 3.41Å
303	S	98.7	Very high	98	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-39.7	-177.2	62.5	0	0	0	0	112.8	H254 L301 T307	H254-S303 WeakPolarHBondContact CB-OG 3.37Å; H254-S303 VanDerWaalsContact CG-OG 3.25Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-S303 PolarHBondContact O-N 2.97Å; S303-T307 WeakPolarHBondContact O-CB 3.49Å; S303-T307 PolarHBondContact O-N 3.06Å; S303-T307 VanDerWaalsContact O-N 3.15Å; S303-T307 PolarHBondContact O-OG1 3.39Å
304	T	98.9	Very high	98.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-40.4	177.3	62.5	0	0	0	0	111.5	H254 S299 L301 K302 T307 A308 I386 H388	H254-T304 HydrophobicContact CB-CG2 3.85Å; S299-T304 PolarHBondContact N-OG1 3.47Å; S299-T304 WeakPolarHBondContact OG-CG2 3.34Å; S299-T304 PolarHBondContact OG-OG1 3.34Å; L301-T304 PolarHBondContact O-N 2.74Å; L301-T304 VanDerWaalsContact O-N 3.11Å; L301-T304 PolarHBondContact O-OG1 2.76Å; K302-T304 VanDerWaalsContact C-N 3.35Å; K302-T304 PolarHBondContact O-N 2.82Å; T304-T307 WeakPolarHBondContact O-CB 3.14Å; T304-T307 PolarHBondContact O-N 3.46Å; T304-A308 PolarHBondContact O-N 3.4Å; T304-I386 HydrophobicContact CG2-CG2 4.4Å; T304-I386 WeakPolarHBondContact CG2-O 3.39Å; T304-H388 WeakPolarHBondContact CG2-NE2 3.45Å
305	I	98.9	Very high	98.4	Very high	25 Å²	25	51 Å²	51	13%	0.128	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-51.5	178.4	-64.6	169.8	0	0	0	110.1	L301 K302 T307 A308 E309 Y315	L301-I305 PolarHBondContact O-N 3.24Å; K302-I305 PolarHBondContact O-N 2.62Å; I305-T307 PolarHBondContact O-N 3.33Å; I305-A308 PolarHBondContact O-N 2.94Å; I305-E309 HydrophobicContact CG2-CG 4.35Å; I305-E309 WeakPolarHBondContact O-CG 3.03Å; I305-E309 PolarHBondContact O-N 3.02Å; I305-Y315 HydrophobicContact CG2-CE2 4.16Å; I305-Y315 WeakPolarHBondContact CG2-OH 3.4Å
306	Q	98.8	Very high	98.5	Very high	52 Å²	52	49 Å²	49	24%	0.243	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-31.4	177	-71.1	-177.8	-41.2	0	0	112.8	L271 K302	L271-Q306 HydrophobicContact CD1-CB 3.62Å; L271-Q306 HydrophobicContact CG-CB 3.86Å; K302-Q306 HydrophobicContact CG-CG 4.16Å; K302-Q306 WeakPolarHBondContact O-CB 3.48Å; K302-Q306 VanDerWaalsContact O-CG 3.28Å; K302-Q306 WeakPolarHBondContact O-CG 3.36Å; K302-Q306 PolarHBondContact O-N 3.41Å
307	T	98.9	Very high	98.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-69.1	-42.3	174.6	-55.7	0	0	0	0	110.8	G255 F278 A279 L282 S303 T304 I305 I386	G255-T307 PolarHBondContact N-OG1 2.74Å; F278-T307 HydrophobicContact CD1-CG2 4.21Å; F278-T307 HydrophobicContact CE1-CG2 3.88Å; A279-T307 HydrophobicContact CB-CG2 4.2Å; L282-T307 HydrophobicContact CD2-CG2 3.86Å; S303-T307 WeakPolarHBondContact O-CB 3.49Å; S303-T307 PolarHBondContact O-N 3.06Å; S303-T307 VanDerWaalsContact O-N 3.15Å; S303-T307 PolarHBondContact O-OG1 3.39Å; T304-T307 WeakPolarHBondContact O-CB 3.14Å; T304-T307 PolarHBondContact O-N 3.46Å; I305-T307 PolarHBondContact O-N 3.33Å; T307-I386 HydrophobicContact CG2-CD1 4.09Å; T307-I386 HydrophobicContact CG2-CG2 3.94Å
308	A	98.8	Very high	98.5	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-35.8	177.6	0	0	0	0	0	113.3	V296 T298 T304 I305 A310 L311 Y315 I386	V296-A308 HydrophobicContact CG1-CB 4.28Å; T298-A308 HydrophobicContact CG2-CB 3.45Å; T298-A308 VanDerWaalsContact CG2-CB 3.45Å; T304-A308 PolarHBondContact O-N 3.4Å; I305-A308 PolarHBondContact O-N 2.94Å; A308-A310 PolarHBondContact O-N 3.24Å; A308-L311 VanDerWaalsContact O-CB 3.25Å; A308-L311 WeakPolarHBondContact O-CB 3.07Å; A308-L311 WeakPolarHBondContact O-CG 3.39Å; A308-L311 PolarHBondContact O-N 3.43Å; A308-Y315 HydrophobicContact CB-CD1 3.91Å; A308-Y315 HydrophobicContact CB-CD2 4.28Å; A308-Y315 HydrophobicContact CB-CE1 4.37Å; A308-Y315 HydrophobicContact CB-CG 3.88Å; A308-I386 HydrophobicContact CB-CD1 3.94Å
309	E	98.7	Very high	98.4	Very high	109 Å²	109	62.1 Å²	62.1	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-56.9	-33.7	177.9	-76.1	176.5	160.3	0	0	112.4	I305 L311 R312 Y315	I305-E309 HydrophobicContact CG2-CG 4.35Å; I305-E309 WeakPolarHBondContact O-CG 3.03Å; I305-E309 PolarHBondContact O-N 3.02Å; E309-L311 PolarHBondContact O-N 3.13Å; E309-R312 PolarHBondContact O-N 3.47Å; E309-Y315 HydrophobicContact CG-CE1 4.23Å
310	A	98.4	Very high	98.4	Very high	21 Å²	21	63.1 Å²	63.1	17%	0.174	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25	176.7	0	0	0	0	0	113.3	A279 S283 A308 R312	A279-A310 HydrophobicContact CB-CB 3.59Å; S283-A310 PolarHBondContact OG-O 3.24Å; A308-A310 PolarHBondContact O-N 3.24Å; A310-R312 VanDerWaalsContact C-N 3.29Å; A310-R312 PolarHBondContact O-N 3.36Å
311	L	97.9	Very high	98.4	Very high	9 Å²	9	58.8 Å²	58.8	5%	0.047	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-20	-178.7	-51.9	-179.9	0	0	0	113	L282 S283 V286 V296 A308 E309 L313 L384 I386	L282-L311 HydrophobicContact CB-CD2 4.24Å; L282-L311 HydrophobicContact CD2-CD2 4.17Å; L282-L311 HydrophobicContact CG-CD2 3.9Å; S283-L311 VanDerWaalsContact CA-CD2 3.46Å; V286-L311 HydrophobicContact CG2-CD2 4.42Å; V296-L311 HydrophobicContact CG1-CD1 4.05Å; V296-L311 HydrophobicContact CG2-CD1 4.25Å; A308-L311 VanDerWaalsContact O-CB 3.25Å; A308-L311 WeakPolarHBondContact O-CB 3.07Å; A308-L311 WeakPolarHBondContact O-CG 3.39Å; A308-L311 PolarHBondContact O-N 3.43Å; E309-L311 PolarHBondContact O-N 3.13Å; L311-L313 HydrophobicContact CB-CB 4.44Å; L311-L313 HydrophobicContact CB-CG 4.47Å; L311-L313 PolarHBondContact O-N 3.04Å; L311-L313 VanDerWaalsContact O-N 3.15Å; L311-L384 HydrophobicContact CD1-CD2 3.69Å; L311-I386 HydrophobicContact CD1-CD1 4.05Å
312	R	96.3	Very high	98.4	Very high	230 Å²	230	58.7 Å²	58.7	87%	0.868	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	29	-175.3	-51.6	177.2	-175.4	-176.2	0.8	113.7	E309 A310	E309-R312 PolarHBondContact O-N 3.47Å; A310-R312 VanDerWaalsContact C-N 3.29Å; A310-R312 PolarHBondContact O-N 3.36Å
313	L	96.7	Very high	98.4	Very high	66 Å²	66	55.8 Å²	55.8	35%	0.346	27%	0.265	S	S	.	.	S	Bend	trans	-111.1	152.7	174.3	-67.5	177	0	0	0	109.9	V286 L294 V296 L311 Y315	V286-L313 HydrophobicContact CG1-CD1 4.05Å; L294-L313 HydrophobicContact CD2-CD1 4.24Å; V296-L313 HydrophobicContact CG2-CB 4.32Å; V296-L313 HydrophobicContact CG2-CD1 4.29Å; L311-L313 HydrophobicContact CB-CB 4.44Å; L311-L313 HydrophobicContact CB-CG 4.47Å; L311-L313 PolarHBondContact O-N 3.04Å; L311-L313 VanDerWaalsContact O-N 3.15Å; L313-Y315 PolarHBondContact O-N 3.44Å
314	P	98.1	Very high	98.4	Very high	113 Å²	113	56.5 Å²	56.5	73%	0.734	27%	0.268	S	S	*	.			trans	-62.8	136.4	170.5	27.9	-33.9	0	0	0	110
315	Y	98.6	Very high	98.4	Very high	75 Å²	75	59.9 Å²	59.9	29%	0.294	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.2	177.2	63.8	-89.2	0	0	0	111.3	V296 T298 I305 A308 E309 L313 Q317	V296-Y315 CarbonylContact O-C 3.52Å; V296-Y315 WeakPolarHBondContact O-CA 3.23Å; V296-Y315 WeakPolarHBondContact O-CB 3.46Å; T298-Y315 HydrophobicContact CG2-CD2 3.89Å; T298-Y315 HydrophobicContact CG2-CG 4.35Å; I305-Y315 HydrophobicContact CG2-CE2 4.16Å; I305-Y315 WeakPolarHBondContact CG2-OH 3.4Å; A308-Y315 HydrophobicContact CB-CD1 3.91Å; A308-Y315 HydrophobicContact CB-CD2 4.28Å; A308-Y315 HydrophobicContact CB-CE1 4.37Å; A308-Y315 HydrophobicContact CB-CG 3.88Å; E309-Y315 HydrophobicContact CG-CE1 4.23Å; L313-Y315 PolarHBondContact O-N 3.44Å; Y315-Q317 HydrophobicContact CD2-CG 4.15Å; Y315-Q317 HydrophobicContact CE2-CG 3.91Å
316	E	98.7	Very high	98.4	Very high	94 Å²	94	58.8 Å²	58.8	44%	0.439	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135	178	-172.8	-179.1	-163.9	0	0	110.3	V296 W297 T298 W318	V296-E316 PolarHBondContact O-N 3.38Å; W297-E316 WeakPolarHBondContact CA-O 3.31Å; W297-E316 PolarHBondContact NE1-OE2 3.41Å; T298-E316 PolarHBondContact N-O 3.21Å; E316-W318 PolarHBondContact OE2-NE1 2.94Å
317	Q	98.8	Very high	98.4	Very high	88 Å²	88	57 Å²	57	41%	0.411	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.3	-178.9	-55.2	-176.7	23	0	0	110.7	Q300 Y315	Q300-Q317 HydrophobicContact CG-CB 4.1Å; Y315-Q317 HydrophobicContact CD2-CG 4.15Å; Y315-Q317 HydrophobicContact CE2-CG 3.91Å
318	W	98.8	Very high	98.3	Very high	52 Å²	52	60 Å²	60	20%	0.197	30%	0.295	C	S	.	.			trans	-112.7	115.6	179.4	-68	67.9	0	0	0	109.6	W297 T298 E316 A320 L321 V373 E376	W297-W318 AromaticContact CD1-NE1 3.74Å; W297-W318 AromaticContact CD2-NE1 3.9Å; W297-W318 AromaticContact CG-NE1 3.8Å; W297-W318 HydrophobicContact CZ2-CZ2 4.36Å; W297-W318 AromaticContact NE1-NE1 3.83Å; T298-W318 PolarHBondContact O-N 3.13Å; E316-W318 PolarHBondContact OE2-NE1 2.94Å; W318-A320 PolarHBondContact O-N 2.92Å; W318-L321 HydrophobicContact CB-CB 4.22Å; W318-L321 HydrophobicContact CB-CD1 3.93Å; W318-L321 HydrophobicContact CB-CG 3.92Å; W318-L321 HydrophobicContact CG-CD1 4.33Å; W318-L321 WeakPolarHBondContact O-CB 3.44Å; W318-L321 PolarHBondContact O-N 3.2Å; W318-V373 HydrophobicContact CE3-CG2 4.05Å; W318-E376 HydrophobicContact CH2-CB 4.1Å; W318-E376 HydrophobicContact CH2-CG 4.01Å; W318-E376 HydrophobicContact CZ2-CG 4.16Å
319	K	98.5	Very high	98.3	Very high	144 Å²	144	60 Å²	60	63%	0.626	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-56.6	-33.3	172.9	-169.4	179.1	178.6	-170.4	0	111.9	Q300 L321 N322 R369	Q300-K319 HydrophobicContact CG-CB 4.41Å; K319-L321 PolarHBondContact O-N 3.5Å; K319-L321 VanDerWaalsContact O-N 3.15Å; K319-N322 WeakPolarHBondContact O-CB 3.41Å; K319-N322 PolarHBondContact O-N 3.24Å; K319-R369 PolarHBondContact O-NH1 3.38Å
320	A	98.6	Very high	98.2	Very high	21 Å²	21	57.4 Å²	57.4	17%	0.174	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-59.2	-23	175.7	0	0	0	0	0	113.3	W318 R369 L370 V373	W318-A320 PolarHBondContact O-N 2.92Å; A320-R369 VanDerWaalsContact C-NH1 3.35Å; A320-R369 HydrophobicContact CB-CG 4.12Å; A320-R369 PolarHBondContact O-NH1 3.17Å; A320-L370 WeakPolarHBondContact O-CD2 3.42Å; A320-V373 HydrophobicContact CB-CG2 3.8Å
321	L	98.9	Very high	98.2	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-88	-0.8	177	-72	177.6	0	0	0	114.2	W297 S299 W318 K319 L370 V373 V385 C387 H388 V391 L395	W297-L321 HydrophobicContact CB-CD1 3.99Å; S299-L321 VanDerWaalsContact CB-C 3.49Å; S299-L321 VanDerWaalsContact CB-O 3.3Å; S299-L321 WeakPolarHBondContact CB-O 3.5Å; W318-L321 HydrophobicContact CB-CB 4.22Å; W318-L321 HydrophobicContact CB-CD1 3.93Å; W318-L321 HydrophobicContact CB-CG 3.92Å; W318-L321 HydrophobicContact CG-CD1 4.33Å; W318-L321 WeakPolarHBondContact O-CB 3.44Å; W318-L321 PolarHBondContact O-N 3.2Å; K319-L321 PolarHBondContact O-N 3.5Å; K319-L321 VanDerWaalsContact O-N 3.15Å; L321-L370 HydrophobicContact CD2-CD2 3.99Å; L321-V373 HydrophobicContact CD2-CG1 3.99Å; L321-V373 HydrophobicContact CD2-CG2 4.34Å; L321-V373 HydrophobicContact CG-CG2 4.37Å; L321-V385 HydrophobicContact CD1-CG1 3.77Å; L321-V385 HydrophobicContact CD2-CG1 3.94Å; L321-C387 HydrophobicContact CD2-CB 4.4Å; L321-H388 PolarHBondContact O-CD2 2.88Å; L321-H388 VanDerWaalsContact O-CD2 3.3Å; L321-V391 HydrophobicContact CD2-CG1 3.77Å; L321-L395 HydrophobicContact CD2-CD1 4.22Å
322	N	98.9	Very high	98.2	Very high	30 Å²	30	62.6 Å²	62.6	16%	0.16	30%	0.304	C	S	.	.	S	Bend	trans	-58.8	149.5	173.4	-71.7	8.1	0	0	0	110.7	S299 Q300 L301 K319 R369 V391	S299-N322 WeakPolarHBondContact CB-OD1 3.38Å; Q300-N322 PolarHBondContact N-OD1 3.32Å; L301-N322 HydrophobicContact CD1-CB 4.39Å; L301-N322 HydrophobicContact CG-CB 4.43Å; K319-N322 WeakPolarHBondContact O-CB 3.41Å; K319-N322 PolarHBondContact O-N 3.24Å; N322-R369 PolarHBondContact O-NH1 2.82Å; N322-R369 PolarHBondContact O-NH2 2.74Å; N322-R369 VanDerWaalsContact O-NH2 3.09Å; N322-V391 WeakPolarHBondContact O-CG2 3.37Å
323	E	98.7	Very high	98.3	Very high	38 Å²	38	52.6 Å²	52.6	18%	0.178	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-55.6	161.3	176.7	-169.9	55	-57.9	0	0	111.9	L301 D325 R369 H388 Q389 A390 V391	L301-E323 HydrophobicContact CD1-CB 4.37Å; E323-D325 PolarHBondContact O-N 3.32Å; E323-R369 PolarHBondContact O-NH2 3.27Å; E323-H388 HydrophobicContact CB-CB 3.68Å; E323-H388 HydrophobicContact CG-CB 3.85Å; E323-H388 PolarHBondContact N-CD2 3.01Å; E323-H388 WeakPolarHBondContact OE1-CB 3.46Å; E323-H388 WeakPolarHBondContact OE2-CB 3.45Å; E323-Q389 PolarHBondContact OE2-N 3.47Å; E323-A390 WeakPolarHBondContact OE1-CA 3.43Å; E323-A390 WeakPolarHBondContact OE1-CB 3.44Å; E323-A390 PolarHBondContact OE1-N 3.05Å; E323-A390 PolarHBondContact OE2-N 2.9Å; E323-V391 PolarHBondContact OE1-N 3.05Å
324	I	98.6	Very high	98.3	Very high	18 Å²	18	51.3 Å²	51.3	9%	0.092	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-53.6	128.9	170.2	-166.3	169	0	0	0	110.6	A326 E361 Y363 L366 A390	I324-A326 PolarHBondContact O-N 3.16Å; I324-E361 HydrophobicContact CD1-CB 4.47Å; I324-E361 HydrophobicContact CG1-CB 3.75Å; I324-Y363 HydrophobicContact CD1-CD2 4.37Å; I324-L366 HydrophobicContact CB-CD1 3.86Å; I324-L366 HydrophobicContact CB-CD2 4.33Å; I324-L366 HydrophobicContact CB-CG 4.18Å; I324-L366 HydrophobicContact CD1-CD1 4.25Å; I324-L366 HydrophobicContact CD1-CG 4.39Å; I324-L366 HydrophobicContact CG1-CD1 4.21Å; I324-L366 HydrophobicContact CG1-CG 4.15Å; I324-A390 HydrophobicContact CB-CB 3.93Å; I324-A390 HydrophobicContact CG2-CB 3.7Å
325	D	98.7	Very high	98.2	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	25%	0.246	S	C	.	.			trans	-73.9	114.6	175.5	-170.1	-27.5	0	0	0	109.9	E323 G327 G360 E361	E323-D325 PolarHBondContact O-N 3.32Å; D325-G327 PolarHBondContact O-N 2.87Å; D325-G327 WeakPolarHBondContact OD1-CA 3.37Å; D325-G327 PolarHBondContact OD1-N 3.32Å; D325-G360 WeakPolarHBondContact O-CA 3.29Å; D325-E361 HydrophobicContact CB-CB 4.32Å; D325-E361 HydrophobicContact CB-CG 3.96Å; D325-E361 PolarHBondContact N-OE2 3.46Å; D325-E361 PolarHBondContact O-N 3.02Å
326	A	98.3	Very high	98.2	Very high	2 Å²	2	50.9 Å²	50.9	2%	0.017	25%	0.25	C	C	.	.			trans	-83.4	3.6	178	0	0	0	0	0	113.5	I265 I324 V328 C329 E330 Y357	I265-A326 HydrophobicContact CD1-CB 3.64Å; I265-A326 HydrophobicContact CG1-CB 4.23Å; I324-A326 PolarHBondContact O-N 3.16Å; A326-V328 PolarHBondContact O-N 2.87Å; A326-C329 HydrophobicContact CB-CB 4.16Å; A326-C329 WeakPolarHBondContact O-CB 3.42Å; A326-C329 PolarHBondContact O-N 2.79Å; A326-E330 HydrophobicContact CB-CG 4.23Å; A326-E330 VanDerWaalsContact CB-OE1 3.27Å; A326-E330 WeakPolarHBondContact CB-OE1 3.37Å; A326-E330 PolarHBondContact N-OE1 2.76Å; A326-Y357 HydrophobicContact CB-CD1 4.36Å; A326-Y357 HydrophobicContact CB-CD2 4.22Å; A326-Y357 HydrophobicContact CB-CE1 4.36Å; A326-Y357 HydrophobicContact CB-CE2 4.16Å; A326-Y357 HydrophobicContact CB-CG 4.29Å; A326-Y357 WeakPolarHBondContact O-CB 3.4Å
327	G	98.1	Very high	98.2	Very high	14 Å²	14	46.6 Å²	46.6	14%	0.144	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	55.2	-123.8	177.8	0	0	0	0	0	112	D325 C329 E330 P358	D325-G327 PolarHBondContact O-N 2.87Å; D325-G327 WeakPolarHBondContact OD1-CA 3.37Å; D325-G327 PolarHBondContact OD1-N 3.32Å; G327-C329 PolarHBondContact O-N 3.13Å; G327-E330 WeakPolarHBondContact O-CB 3.49Å; G327-E330 WeakPolarHBondContact O-CG 3.4Å; G327-E330 PolarHBondContact O-N 2.88Å; G327-E330 VanDerWaalsContact O-N 3.1Å; G327-P358 WeakPolarHBondContact CA-O 3.29Å
328	V	97.9	Very high	98.1	Very high	63 Å²	63	47.8 Å²	47.8	38%	0.382	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-63	-10.1	177.5	-55.8	0	0	0	0	114.3	A326 Y341 P358 T359	A326-V328 PolarHBondContact O-N 2.87Å; V328-Y341 HydrophobicContact CG2-CE1 4.46Å; V328-P358 HydrophobicContact CG2-CB 3.83Å; V328-P358 HydrophobicContact CG2-CG 4.06Å; V328-P358 PolarHBondContact N-O 3.17Å; V328-T359 HydrophobicContact CG1-CG2 4.43Å
329	C	98.1	Very high	98	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-100.7	6.4	177.9	-59	0	0	0	0	113.9	I265 A326 G327 L332 I337 Y357	I265-C329 HydrophobicContact CD1-CB 4.46Å; I265-C329 WeakPolarHBondContact CG1-O 3.41Å; A326-C329 HydrophobicContact CB-CB 4.16Å; A326-C329 WeakPolarHBondContact O-CB 3.42Å; A326-C329 PolarHBondContact O-N 2.79Å; G327-C329 PolarHBondContact O-N 3.13Å; C329-L332 PolarHBondContact O-N 2.85Å; C329-I337 HydrophobicContact CB-CD1 3.85Å; C329-I337 HydrophobicContact CB-CG1 4.01Å; C329-Y357 HydrophobicContact CB-CD1 3.99Å; C329-Y357 HydrophobicContact CB-CE1 4Å
330	E	97.8	Very high	98	Very high	56 Å²	56	47.7 Å²	47.7	26%	0.262	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	144.1	171.5	-76.1	-72	121.6	0	0	111.3	G266 G267 A326 G327 L332	G266-E330 WeakPolarHBondContact CA-OE1 3.35Å; G266-E330 WeakPolarHBondContact CA-OE2 3.1Å; G267-E330 PolarHBondContact N-OE2 2.73Å; A326-E330 HydrophobicContact CB-CG 4.23Å; A326-E330 VanDerWaalsContact CB-OE1 3.27Å; A326-E330 WeakPolarHBondContact CB-OE1 3.37Å; A326-E330 PolarHBondContact N-OE1 2.76Å; G327-E330 WeakPolarHBondContact O-CB 3.49Å; G327-E330 WeakPolarHBondContact O-CG 3.4Å; G327-E330 PolarHBondContact O-N 2.88Å; G327-E330 VanDerWaalsContact O-N 3.1Å; E330-L332 PolarHBondContact O-N 2.71Å; E330-L332 VanDerWaalsContact O-N 3.07Å
331	E	97.9	Very high	98	Very high	97 Å²	97	50.6 Å²	50.6	45%	0.453	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	7.7	178.1	-42.2	-169.8	166.6	0	0	116.1	Y259 K264 I265	Y259-E331 HydrophobicContact CE2-CB 4.15Å; Y259-E331 HydrophobicContact CE2-CG 3.94Å; K264-E331 WeakPolarHBondContact CD-O 2.96Å; K264-E331 WeakPolarHBondContact CE-O 3.38Å; K264-E331 WeakPolarHBondContact CG-O 3.49Å; I265-E331 WeakPolarHBondContact O-CA 3.24Å; I265-E331 PolarHBondContact O-N 2.76Å
332	L	98.3	Very high	97.9	Very high	41 Å²	41	54.5 Å²	54.5	22%	0.215	28%	0.277	C	S	.	.			trans	-93.3	153.5	174.9	-59.5	-175.7	0	0	0	112.2	K264 I265 C329 E330 E336 I337 Y341	K264-L332 CarbonylContact C-O 3.6Å; K264-L332 WeakPolarHBondContact CA-O 3.39Å; I265-L332 PolarHBondContact N-O 3.36Å; C329-L332 PolarHBondContact O-N 2.85Å; E330-L332 PolarHBondContact O-N 2.71Å; E330-L332 VanDerWaalsContact O-N 3.07Å; L332-E336 HydrophobicContact CB-CB 4.34Å; L332-E336 HydrophobicContact CD2-CB 4.5Å; L332-I337 HydrophobicContact CB-CD1 4.25Å; L332-I337 HydrophobicContact CB-CG1 3.81Å; L332-I337 HydrophobicContact CD1-CG1 4.02Å; L332-Y341 HydrophobicContact CD1-CE2 4.14Å
333	T	98.3	Very high	97.8	Very high	21 Å²	21	57.7 Å²	57.7	13%	0.129	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-77.7	160.8	163.8	62.3	0	0	0	0	110.9	Q262 G263 K264 E335 E336 I337	Q262-T333 WeakPolarHBondContact O-CG2 3.41Å; G263-T333 WeakPolarHBondContact O-CA 3.39Å; K264-T333 HydrophobicContact CG-CG2 3.88Å; T333-E335 PolarHBondContact O-N 2.72Å; T333-E336 WeakPolarHBondContact CB-OE2 3.29Å; T333-E336 WeakPolarHBondContact CG2-OE2 3.31Å; T333-E336 PolarHBondContact N-OE2 2.83Å; T333-E336 PolarHBondContact O-N 3.42Å; T333-E336 WeakPolarHBondContact OG1-CB 3.36Å; T333-E336 VanDerWaalsContact OG1-CD 3.25Å; T333-E336 WeakPolarHBondContact OG1-CG 3.48Å; T333-E336 PolarHBondContact OG1-N 2.77Å; T333-E336 VanDerWaalsContact OG1-N 3.15Å; T333-E336 PolarHBondContact OG1-OE2 2.85Å; T333-I337 VanDerWaalsContact O-CG1 3.3Å; T333-I337 WeakPolarHBondContact O-CG1 3.17Å; T333-I337 PolarHBondContact O-N 2.73Å
334	Y	95.6	Very high	97.7	Very high	39 Å²	39	57 Å²	57	15%	0.153	29%	0.288	C	S	.	.	H	α-helix	trans	-66.6	-28.7	176.6	-80.6	-70.9	0	0	0	112.8	I265 I337 R338 Y345 R443	I265-Y334 HydrophobicContact CG2-CD2 4.14Å; I265-Y334 HydrophobicContact CG2-CE1 4.42Å; I265-Y334 HydrophobicContact CG2-CE2 3.57Å; Y334-I337 HydrophobicContact CD1-CD1 4.4Å; Y334-R338 WeakPolarHBondContact O-CB 3.48Å; Y334-R338 PolarHBondContact O-N 3.37Å; Y334-Y345 HydrophobicContact CD1-CE2 4.46Å; Y334-R443 VanDerWaalsContact CB-NH1 3.3Å
335	E	97.1	Very high	97.6	Very high	99 Å²	99	58.4 Å²	58.4	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-49.3	173.3	-66	69.9	-154.5	0	0	110.5	T333 I337 R338 D339	T333-E335 PolarHBondContact O-N 2.72Å; E335-I337 VanDerWaalsContact C-N 3.31Å; E335-I337 PolarHBondContact O-N 2.83Å; E335-R338 WeakPolarHBondContact O-CB 3.29Å; E335-R338 PolarHBondContact O-N 3.42Å; E335-R338 VanDerWaalsContact O-N 3.14Å; E335-D339 PolarHBondContact O-N 3.44Å
336	E	98.1	Very high	97.4	Very high	79 Å²	79	57.5 Å²	57.5	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-60.7	-39	175.5	-73.1	162.2	147.2	0	0	112	L332 T333 D339 T340	L332-E336 HydrophobicContact CB-CB 4.34Å; L332-E336 HydrophobicContact CD2-CB 4.5Å; T333-E336 WeakPolarHBondContact CB-OE2 3.29Å; T333-E336 WeakPolarHBondContact CG2-OE2 3.31Å; T333-E336 PolarHBondContact N-OE2 2.83Å; T333-E336 PolarHBondContact O-N 3.42Å; T333-E336 WeakPolarHBondContact OG1-CB 3.36Å; T333-E336 VanDerWaalsContact OG1-CD 3.25Å; T333-E336 WeakPolarHBondContact OG1-CG 3.48Å; T333-E336 PolarHBondContact OG1-N 2.77Å; T333-E336 VanDerWaalsContact OG1-N 3.15Å; T333-E336 PolarHBondContact OG1-OE2 2.85Å; E336-D339 PolarHBondContact O-N 2.95Å; E336-T340 WeakPolarHBondContact O-CB 3.32Å; E336-T340 PolarHBondContact O-N 3.03Å; E336-T340 PolarHBondContact O-OG1 3.37Å
337	I	97.9	Very high	97.3	Very high	4 Å²	4	58 Å²	58	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-43.8	175.3	-65.9	165.3	0	0	0	110.8	I265 C329 L332 T333 Y334 E335 D339 Y341 Y345	I265-I337 HydrophobicContact CD1-CD1 3.53Å; I265-I337 HydrophobicContact CG1-CD1 4.21Å; C329-I337 HydrophobicContact CB-CD1 3.85Å; C329-I337 HydrophobicContact CB-CG1 4.01Å; L332-I337 HydrophobicContact CB-CD1 4.25Å; L332-I337 HydrophobicContact CB-CG1 3.81Å; L332-I337 HydrophobicContact CD1-CG1 4.02Å; T333-I337 VanDerWaalsContact O-CG1 3.3Å; T333-I337 WeakPolarHBondContact O-CG1 3.17Å; T333-I337 PolarHBondContact O-N 2.73Å; Y334-I337 HydrophobicContact CD1-CD1 4.4Å; E335-I337 VanDerWaalsContact C-N 3.31Å; E335-I337 PolarHBondContact O-N 2.83Å; I337-D339 VanDerWaalsContact C-N 3.28Å; I337-D339 PolarHBondContact O-N 3.49Å; I337-Y341 CarbonylContact O-C 3.28Å; I337-Y341 VanDerWaalsContact O-CA 3.27Å; I337-Y341 WeakPolarHBondContact O-CA 3.48Å; I337-Y341 PolarHBondContact O-N 3.3Å; I337-Y345 HydrophobicContact CG2-CD2 4.31Å
338	R	96.8	Very high	97.3	Very high	113 Å²	113	58.7 Å²	58.7	43%	0.426	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-40.1	177.9	-176.4	-166.7	64.2	-152	-10.1	111.4	Y334 E335 P342 Y345	Y334-R338 WeakPolarHBondContact O-CB 3.48Å; Y334-R338 PolarHBondContact O-N 3.37Å; E335-R338 WeakPolarHBondContact O-CB 3.29Å; E335-R338 PolarHBondContact O-N 3.42Å; E335-R338 VanDerWaalsContact O-N 3.14Å; R338-P342 WeakPolarHBondContact O-CA 3.19Å; R338-P342 WeakPolarHBondContact O-CB 3.38Å; R338-Y345 HydrophobicContact CB-CD1 4.48Å; R338-Y345 HydrophobicContact CB-CD2 3.67Å; R338-Y345 HydrophobicContact CB-CE2 3.96Å; R338-Y345 HydrophobicContact CB-CG 3.97Å; R338-Y345 HydrophobicContact CG-CD1 4.24Å; R338-Y345 HydrophobicContact CG-CD2 4.31Å; R338-Y345 HydrophobicContact CG-CE1 4.47Å; R338-Y345 HydrophobicContact CG-CG 4.18Å
339	D	97.8	Very high	97	Very high	108 Å²	108	58.8 Å²	58.8	58%	0.578	29%	0.291	S	S	*	.	H	α-helix	trans	-81.9	-34.8	-174.1	-59.6	-11.5	0	0	0	111.4	E335 E336 I337	E335-D339 PolarHBondContact O-N 3.44Å; E336-D339 PolarHBondContact O-N 2.95Å; I337-D339 VanDerWaalsContact C-N 3.28Å; I337-D339 PolarHBondContact O-N 3.49Å
340	T	97.8	Very high	96.7	Very high	87 Å²	87	64.2 Å²	64.2	53%	0.534	32%	0.317	S	S	.	.	H	α-helix	trans	-87	-38.8	-179.6	-48.5	0	0	0	0	113	E336 P342	E336-T340 WeakPolarHBondContact O-CB 3.32Å; E336-T340 PolarHBondContact O-N 3.03Å; E336-T340 PolarHBondContact O-OG1 3.37Å; T340-P342 VanDerWaalsContact C-CD 3.45Å
341	Y	97.5	Very high	96.5	Very high	81 Å²	81	64.1 Å²	64.1	32%	0.318	32%	0.318	S	S	.	.			trans	-128.6	61.4	-177	-54.1	-77.3	0	0	0	111.2	V328 L332 I337 E343 E344 Y345	V328-Y341 HydrophobicContact CG2-CE1 4.46Å; L332-Y341 HydrophobicContact CD1-CE2 4.14Å; I337-Y341 CarbonylContact O-C 3.28Å; I337-Y341 VanDerWaalsContact O-CA 3.27Å; I337-Y341 WeakPolarHBondContact O-CA 3.48Å; I337-Y341 PolarHBondContact O-N 3.3Å; Y341-E343 PolarHBondContact O-N 3.02Å; Y341-E344 PolarHBondContact O-N 2.97Å; Y341-E344 VanDerWaalsContact O-N 3.13Å; Y341-Y345 PolarHBondContact O-N 3.35Å
342	P	97.5	Very high	96.5	Very high	83 Å²	83	60.3 Å²	60.3	54%	0.539	30%	0.3	S	S	.	.	H	α-helix	trans	-59.4	-35	-172.9	22.5	-34	0	0	0	113.3	R338 T340 A346	R338-P342 WeakPolarHBondContact O-CA 3.19Å; R338-P342 WeakPolarHBondContact O-CB 3.38Å; T340-P342 VanDerWaalsContact C-CD 3.45Å; P342-A346 PolarHBondContact O-N 2.61Å
343	E	96.4	Very high	96.5	Very high	97 Å²	97	59.1 Å²	59.1	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-48	177.2	-172	-177.7	156.9	0	0	112	R9 Y341 Y345 A346 L347	R9-E343 IonicContact CZ-OE1 3Å; R9-E343 IonicContact NE-OE1 2.7Å; R9-E343 PolarHBondContact NE-OE1 2.86Å; R9-E343 IonicContact NH2-OE1 3.25Å; R9-E343 PolarHBondContact NH2-OE1 2.99Å; R9-E343 IonicContact NH2-OE2 2.92Å; Y341-E343 PolarHBondContact O-N 3.02Å; E343-Y345 VanDerWaalsContact C-N 3.34Å; E343-Y345 PolarHBondContact O-N 3.11Å; E343-A346 PolarHBondContact O-N 3.37Å; E343-L347 HydrophobicContact CG-CD1 4Å; E343-L347 HydrophobicContact CG-CG 4.47Å; E343-L347 WeakPolarHBondContact O-CB 3.36Å; E343-L347 VanDerWaalsContact O-CG 3.27Å; E343-L347 WeakPolarHBondContact O-CG 3.36Å; E343-L347 PolarHBondContact O-N 2.69Å
344	E	97.6	Very high	96.5	Very high	24 Å²	24	62.4 Å²	62.4	11%	0.112	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-40	179.7	-66.3	-60.9	133.7	0	0	111.4	K12 Y341 A346 L347 R348 Y355 P358	K12-E344 WeakPolarHBondContact CE-OE2 3.24Å; K12-E344 IonicContact NZ-OE1 3.36Å; K12-E344 PolarHBondContact NZ-OE1 3.33Å; K12-E344 IonicContact NZ-OE2 3.57Å; K12-E344 PolarHBondContact NZ-OE2 2.92Å; Y341-E344 PolarHBondContact O-N 2.97Å; Y341-E344 VanDerWaalsContact O-N 3.13Å; E344-A346 VanDerWaalsContact C-N 3.35Å; E344-A346 PolarHBondContact O-N 2.86Å; E344-L347 PolarHBondContact O-N 3.48Å; E344-R348 WeakPolarHBondContact O-CB 3.34Å; E344-R348 PolarHBondContact O-N 2.93Å; E344-Y355 HydrophobicContact CB-CE2 4.42Å; E344-Y355 WeakPolarHBondContact O-CE2 3.41Å; E344-Y355 WeakPolarHBondContact OE2-CE2 3.46Å; E344-Y355 PolarHBondContact OE2-OH 3.45Å; E344-Y355 VanDerWaalsContact OE2-OH 3.09Å; E344-P358 HydrophobicContact CG-CG 4.13Å
345	Y	95.9	Very high	96.6	Very high	46 Å²	46	60.7 Å²	60.7	18%	0.18	30%	0.297	C	S	.	.	H	α-helix	trans	-56.6	-48.1	174	-174.7	-81.2	0	0	0	111.5	Y334 I337 R338 Y341 E343 E349 R443	Y334-Y345 HydrophobicContact CD1-CE2 4.46Å; I337-Y345 HydrophobicContact CG2-CD2 4.31Å; R338-Y345 HydrophobicContact CB-CD1 4.48Å; R338-Y345 HydrophobicContact CB-CD2 3.67Å; R338-Y345 HydrophobicContact CB-CE2 3.96Å; R338-Y345 HydrophobicContact CB-CG 3.97Å; R338-Y345 HydrophobicContact CG-CD1 4.24Å; R338-Y345 HydrophobicContact CG-CD2 4.31Å; R338-Y345 HydrophobicContact CG-CE1 4.47Å; R338-Y345 HydrophobicContact CG-CG 4.18Å; Y341-Y345 PolarHBondContact O-N 3.35Å; E343-Y345 VanDerWaalsContact C-N 3.34Å; E343-Y345 PolarHBondContact O-N 3.11Å; Y345-E349 PolarHBondContact O-N 3.11Å; Y345-E349 VanDerWaalsContact O-N 3.15Å; Y345-R443 PolarHBondContact OH-NH1 2.85Å; Y345-R443 PolarHBondContact OH-NH2 2.87Å
346	A	95.2	Very high	96.7	Very high	53 Å²	53	59 Å²	59	44%	0.438	29%	0.286	S	S	.	.	H	α-helix	trans	-67.6	-43.4	179.5	0	0	0	0	0	112.6	P342 E343 E344 R348 E349 Q350	P342-A346 PolarHBondContact O-N 2.61Å; E343-A346 PolarHBondContact O-N 3.37Å; E344-A346 VanDerWaalsContact C-N 3.35Å; E344-A346 PolarHBondContact O-N 2.86Å; A346-R348 VanDerWaalsContact C-N 3.31Å; A346-R348 PolarHBondContact O-N 2.98Å; A346-E349 PolarHBondContact O-N 2.89Å; A346-Q350 PolarHBondContact O-N 3.06Å
347	L	96.1	Very high	96.7	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-42	177.5	-72.1	169.8	0	0	0	111.5	R9 V10 E343 E344 Q350 D351 Y355	R9-L347 HydrophobicContact CB-CD1 3.95Å; R9-L347 HydrophobicContact CB-CD2 4.32Å; V10-L347 HydrophobicContact CG2-CD2 4.07Å; E343-L347 HydrophobicContact CG-CD1 4Å; E343-L347 HydrophobicContact CG-CG 4.47Å; E343-L347 WeakPolarHBondContact O-CB 3.36Å; E343-L347 VanDerWaalsContact O-CG 3.27Å; E343-L347 WeakPolarHBondContact O-CG 3.36Å; E343-L347 PolarHBondContact O-N 2.69Å; E344-L347 PolarHBondContact O-N 3.48Å; L347-Q350 PolarHBondContact O-N 3.2Å; L347-D351 PolarHBondContact O-N 3.47Å; L347-D351 VanDerWaalsContact O-N 3.1Å; L347-Y355 HydrophobicContact CB-CD2 3.98Å; L347-Y355 HydrophobicContact CB-CE2 4.13Å
348	R	96.8	Very high	96.7	Very high	29 Å²	29	56.8 Å²	56.8	11%	0.109	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-37.1	177.3	-174.3	171.9	-176	-95.7	11.1	112.9	E344 A346 K352 Y355 Y357	E344-R348 WeakPolarHBondContact O-CB 3.34Å; E344-R348 PolarHBondContact O-N 2.93Å; A346-R348 VanDerWaalsContact C-N 3.31Å; A346-R348 PolarHBondContact O-N 2.98Å; R348-K352 HydrophobicContact CG-CG 4.37Å; R348-K352 WeakPolarHBondContact O-CA 3.47Å; R348-K352 VanDerWaalsContact O-CB 3.25Å; R348-K352 WeakPolarHBondContact O-CB 3.49Å; R348-K352 PolarHBondContact O-N 2.88Å; R348-K352 VanDerWaalsContact O-N 3.14Å; R348-Y355 HydrophobicContact CB-CD1 3.62Å; R348-Y355 HydrophobicContact CB-CD2 3.75Å; R348-Y355 HydrophobicContact CB-CE1 3.74Å; R348-Y355 HydrophobicContact CB-CE2 3.85Å; R348-Y355 HydrophobicContact CB-CG 3.62Å; R348-Y355 HydrophobicContact CG-CD1 3.45Å; R348-Y355 VanDerWaalsContact CG-CD1 3.45Å; R348-Y355 HydrophobicContact CG-CD2 4.46Å; R348-Y355 HydrophobicContact CG-CE1 3.78Å; R348-Y355 HydrophobicContact CG-CG 3.84Å; R348-Y357 WeakPolarHBondContact CD-OH 3.41Å; R348-Y357 VanDerWaalsContact CZ-OH 3.22Å; R348-Y357 PolarHBondContact NE-OH 2.89Å; R348-Y357 PolarHBondContact NH2-OH 3.43Å
349	E	91.7	Very high	96.8	Very high	65 Å²	65	57 Å²	57	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-68.9	-37.5	178.4	-170.4	172.4	-149.2	0	0	111.7	Y345 A346 S446 V449	Y345-E349 PolarHBondContact O-N 3.11Å; Y345-E349 VanDerWaalsContact O-N 3.15Å; A346-E349 PolarHBondContact O-N 2.89Å; E349-S446 WeakPolarHBondContact OE1-CB 3.08Å; E349-S446 PolarHBondContact OE1-OG 3.2Å; E349-V449 HydrophobicContact CG-CG2 4.13Å
350	Q	92.7	Very high	96.8	Very high	115 Å²	115	52.6 Å²	52.6	54%	0.537	27%	0.272	S	S	.	.	H	α-helix	trans	-67.8	-46.5	178	-176	-179.6	2	0	0	112.5	A346 L347	A346-Q350 PolarHBondContact O-N 3.06Å; L347-Q350 PolarHBondContact O-N 3.2Å
351	D	94.2	Very high	96.9	Very high	54 Å²	54	50 Å²	50	29%	0.289	25%	0.254	S	S	.	.			trans	-136.5	69.1	-175.1	-168.5	-8.4	0	0	0	112.1	V10 L347 Y353 Y354 Y355	V10-D351 HydrophobicContact CG1-CB 4.11Å; L347-D351 PolarHBondContact O-N 3.47Å; L347-D351 VanDerWaalsContact O-N 3.1Å; D351-Y353 PolarHBondContact O-N 3.17Å; D351-Y354 PolarHBondContact O-N 3Å; D351-Y354 WeakPolarHBondContact OD1-CD2 3.44Å; D351-Y354 PolarHBondContact OD1-N 3.48Å; D351-Y355 WeakPolarHBondContact O-CA 3.36Å; D351-Y355 WeakPolarHBondContact O-CB 3.34Å; D351-Y355 PolarHBondContact O-N 3.22Å
352	K	97.6	Very high	96.9	Very high	16 Å²	16	46.3 Å²	46.3	7%	0.07	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.6	-171.7	-162.3	175.3	176.2	-166.3	0	114.7	R348 Y363 P408 Y409	R348-K352 HydrophobicContact CG-CG 4.37Å; R348-K352 WeakPolarHBondContact O-CA 3.47Å; R348-K352 VanDerWaalsContact O-CB 3.25Å; R348-K352 WeakPolarHBondContact O-CB 3.49Å; R348-K352 PolarHBondContact O-N 2.88Å; R348-K352 VanDerWaalsContact O-N 3.14Å; K352-Y363 HydrophobicContact CG-CE2 4.48Å; K352-Y363 WeakPolarHBondContact O-CD2 3.49Å; K352-P408 HydrophobicContact CB-CB 4.13Å; K352-P408 HydrophobicContact CB-CG 4.41Å; K352-P408 HydrophobicContact CD-CB 3.67Å; K352-P408 HydrophobicContact CG-CB 3.77Å; K352-P408 HydrophobicContact CG-CG 4.45Å; K352-P408 PolarHBondContact NZ-O 3.25Å; K352-Y409 HydrophobicContact CB-CE2 4.34Å; K352-Y409 WeakPolarHBondContact CB-OH 3.37Å; K352-Y409 HydrophobicContact CD-CD1 4.43Å; K352-Y409 HydrophobicContact CD-CE1 3.68Å; K352-Y409 HydrophobicContact CD-CE2 4.22Å
353	Y	98	Very high	97	Very high	16 Å²	16	42.5 Å²	42.5	6%	0.063	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-49.4	-179.8	178.7	-96.3	0	0	0	111.5	D351 Y363 Q364 A404 M407 P408	D351-Y353 PolarHBondContact O-N 3.17Å; Y353-Y363 PolarHBondContact O-N 3.34Å; Y353-Q364 HydrophobicContact CE1-CB 3.96Å; Y353-Q364 HydrophobicContact CE1-CG 4.32Å; Y353-Q364 PolarHBondContact O-N 3.43Å; Y353-A404 WeakPolarHBondContact CB-O 3.45Å; Y353-A404 HydrophobicContact CD1-CB 3.82Å; Y353-A404 HydrophobicContact CD2-CB 3.84Å; Y353-A404 WeakPolarHBondContact CD2-O 3.41Å; Y353-A404 HydrophobicContact CE1-CB 3.68Å; Y353-A404 HydrophobicContact CE2-CB 3.71Å; Y353-A404 HydrophobicContact CG-CB 3.9Å; Y353-M407 HydrophobicContact CD2-SD 4.3Å; Y353-M407 HydrophobicContact CE2-CE 4.11Å; Y353-M407 HydrophobicContact CE2-SD 3.87Å; Y353-P408 HydrophobicContact CD2-CG 4.33Å
354	Y	98.1	Very high	97.1	Very high	91 Å²	91	40.9 Å²	40.9	36%	0.357	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-17.6	-177.4	-65.4	-70.1	0	0	0	113.7	D351 R356	D351-Y354 PolarHBondContact O-N 3Å; D351-Y354 WeakPolarHBondContact OD1-CD2 3.44Å; D351-Y354 PolarHBondContact OD1-N 3.48Å; Y354-R356 PolarHBondContact O-N 3.35Å
355	Y	98.5	Very high	97.1	Very high	3 Å²	3	41.4 Å²	41.4	1%	0.012	21%	0.211	C	C	.	.			trans	-57.8	125.2	174.9	170.3	-87.4	0	0	0	110.7	E344 L347 R348 D351 Y357 S362	E344-Y355 HydrophobicContact CB-CE2 4.42Å; E344-Y355 WeakPolarHBondContact O-CE2 3.41Å; E344-Y355 WeakPolarHBondContact OE2-CE2 3.46Å; E344-Y355 PolarHBondContact OE2-OH 3.45Å; E344-Y355 VanDerWaalsContact OE2-OH 3.09Å; L347-Y355 HydrophobicContact CB-CD2 3.98Å; L347-Y355 HydrophobicContact CB-CE2 4.13Å; R348-Y355 HydrophobicContact CB-CD1 3.62Å; R348-Y355 HydrophobicContact CB-CD2 3.75Å; R348-Y355 HydrophobicContact CB-CE1 3.74Å; R348-Y355 HydrophobicContact CB-CE2 3.85Å; R348-Y355 HydrophobicContact CB-CG 3.62Å; R348-Y355 HydrophobicContact CG-CD1 3.45Å; R348-Y355 VanDerWaalsContact CG-CD1 3.45Å; R348-Y355 HydrophobicContact CG-CD2 4.46Å; R348-Y355 HydrophobicContact CG-CE1 3.78Å; R348-Y355 HydrophobicContact CG-CG 3.84Å; D351-Y355 WeakPolarHBondContact O-CA 3.36Å; D351-Y355 WeakPolarHBondContact O-CB 3.34Å; D351-Y355 PolarHBondContact O-N 3.22Å; Y355-Y357 AromaticContact CE1-CD1 3.67Å; Y355-Y357 HydrophobicContact CE1-CD1 3.67Å; Y355-Y357 AromaticContact CE1-CD2 3.9Å; Y355-Y357 HydrophobicContact CE1-CD2 3.9Å; Y355-Y357 AromaticContact CE1-CE1 3.9Å; Y355-Y357 HydrophobicContact CE1-CE1 3.9Å; Y355-Y357 HydrophobicContact CE1-CE2 4.17Å; Y355-Y357 AromaticContact CE1-CG 3.67Å; Y355-Y357 HydrophobicContact CE1-CG 3.67Å; Y355-Y357 WeakPolarHBondContact OH-CD1 3.46Å; Y355-S362 VanDerWaalsContact O-CA 3.27Å; Y355-S362 WeakPolarHBondContact O-CA 3.39Å; Y355-S362 WeakPolarHBondContact O-CB 3.45Å
356	R	98.8	Very high	97.2	Very high	64 Å²	64	39.2 Å²	39.2	24%	0.242	20%	0.202	C	C	.	.			trans	-107.3	128.3	171	-175.5	179.9	-73.1	161.4	-3.7	109.3	V10 K12 Y354 G360 D365	V10-R356 PolarHBondContact O-N 3.04Å; K12-R356 HydrophobicContact CB-CB 4.48Å; K12-R356 HydrophobicContact CG-CB 4.19Å; K12-R356 WeakPolarHBondContact CG-O 3.45Å; K12-R356 PolarHBondContact NZ-O 3.19Å; K12-R356 VanDerWaalsContact NZ-O 3.07Å; Y354-R356 PolarHBondContact O-N 3.35Å; R356-G360 WeakPolarHBondContact CD-O 3.16Å; R356-G360 VanDerWaalsContact CG-O 3.28Å; R356-G360 WeakPolarHBondContact CG-O 3.39Å; R356-D365 IonicContact CZ-OD1 4Å; R356-D365 IonicContact CZ-OD2 2.63Å; R356-D365 IonicContact NE-OD1 3.39Å; R356-D365 IonicContact NE-OD2 3.61Å; R356-D365 PolarHBondContact NE-OD2 2.97Å; R356-D365 VanDerWaalsContact NH2-CG 3.28Å; R356-D365 IonicContact NH2-OD1 2.69Å; R356-D365 PolarHBondContact NH2-OD1 3.45Å; R356-D365 IonicContact NH2-OD2 3.46Å; R356-D365 PolarHBondContact NH2-OD2 3.3Å; R356-D365 VanDerWaalsContact NH2-OD2 3.16Å
357	Y	98.6	Very high	97.4	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.02	18%	0.181	C	C	.	.			trans	-59.4	142.9	170.5	-77.9	-79.2	0	0	0	110.6	A326 C329 R348 Y355 T359 G360 E361	A326-Y357 HydrophobicContact CB-CD1 4.36Å; A326-Y357 HydrophobicContact CB-CD2 4.22Å; A326-Y357 HydrophobicContact CB-CE1 4.36Å; A326-Y357 HydrophobicContact CB-CE2 4.16Å; A326-Y357 HydrophobicContact CB-CG 4.29Å; A326-Y357 WeakPolarHBondContact O-CB 3.4Å; C329-Y357 HydrophobicContact CB-CD1 3.99Å; C329-Y357 HydrophobicContact CB-CE1 4Å; R348-Y357 WeakPolarHBondContact CD-OH 3.41Å; R348-Y357 VanDerWaalsContact CZ-OH 3.22Å; R348-Y357 PolarHBondContact NE-OH 2.89Å; R348-Y357 PolarHBondContact NH2-OH 3.43Å; Y355-Y357 AromaticContact CE1-CD1 3.67Å; Y355-Y357 HydrophobicContact CE1-CD1 3.67Å; Y355-Y357 AromaticContact CE1-CD2 3.9Å; Y355-Y357 HydrophobicContact CE1-CD2 3.9Å; Y355-Y357 AromaticContact CE1-CE1 3.9Å; Y355-Y357 HydrophobicContact CE1-CE1 3.9Å; Y355-Y357 HydrophobicContact CE1-CE2 4.17Å; Y355-Y357 AromaticContact CE1-CG 3.67Å; Y355-Y357 HydrophobicContact CE1-CG 3.67Å; Y355-Y357 WeakPolarHBondContact OH-CD1 3.46Å; Y357-T359 PolarHBondContact O-N 3.39Å; Y357-G360 PolarHBondContact O-N 2.88Å; Y357-E361 PolarHBondContact N-O 3.39Å
358	P	98.2	Very high	97.3	Very high	30 Å²	30	40.7 Å²	40.7	20%	0.195	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	126.1	172.4	-20	30.3	0	0	0	110.1	G327 V328 E344 G360	G327-P358 WeakPolarHBondContact CA-O 3.29Å; V328-P358 HydrophobicContact CG2-CB 3.83Å; V328-P358 HydrophobicContact CG2-CG 4.06Å; V328-P358 PolarHBondContact N-O 3.17Å; E344-P358 HydrophobicContact CG-CG 4.13Å; P358-G360 PolarHBondContact O-N 3.21Å; P358-G360 VanDerWaalsContact O-N 3.14Å
359	T	97.9	Very high	97.4	Very high	119 Å²	119	42 Å²	42	73%	0.73	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	16.3	-173.2	75.2	0	0	0	0	115.8	V328 Y357	V328-T359 HydrophobicContact CG1-CG2 4.43Å; Y357-T359 PolarHBondContact O-N 3.39Å
360	G	98.3	Very high	97.7	Very high	14 Å²	14	39 Å²	39	14%	0.144	19%	0.19	C	C	.	.	S	Bend	trans	-125.8	-150.6	179.8	0	0	0	0	0	112.8	D325 R356 Y357 P358	D325-G360 WeakPolarHBondContact O-CA 3.29Å; R356-G360 WeakPolarHBondContact CD-O 3.16Å; R356-G360 VanDerWaalsContact CG-O 3.28Å; R356-G360 WeakPolarHBondContact CG-O 3.39Å; Y357-G360 PolarHBondContact O-N 2.88Å; P358-G360 PolarHBondContact O-N 3.21Å; P358-G360 VanDerWaalsContact O-N 3.14Å
361	E	98.6	Very high	97.9	Very high	34 Å²	34	34.7 Å²	34.7	16%	0.159	17%	0.17	C	C	.	.			trans	-115	161.6	-172	-72.8	178.4	130.7	0	0	113.1	I324 D325 Y357 D365 R369	I324-E361 HydrophobicContact CD1-CB 4.47Å; I324-E361 HydrophobicContact CG1-CB 3.75Å; D325-E361 HydrophobicContact CB-CB 4.32Å; D325-E361 HydrophobicContact CB-CG 3.96Å; D325-E361 PolarHBondContact N-OE2 3.46Å; D325-E361 PolarHBondContact O-N 3.02Å; Y357-E361 PolarHBondContact N-O 3.39Å; E361-D365 HydrophobicContact CB-CB 4.13Å; E361-D365 HydrophobicContact CG-CB 4.19Å; E361-R369 IonicContact OE1-CZ 2.72Å; E361-R369 IonicContact OE1-NE 3.86Å; E361-R369 PolarHBondContact OE1-NE 3.5Å; E361-R369 IonicContact OE1-NH2 2.98Å; E361-R369 PolarHBondContact OE1-NH2 2.76Å; E361-R369 IonicContact OE2-CZ 3.33Å; E361-R369 IonicContact OE2-NE 2.66Å; E361-R369 IonicContact OE2-NH2 2.67Å; E361-R369 PolarHBondContact OE2-NH2 2.86Å
362	S	98.7	Very high	98.1	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.014	18%	0.179	C	C	.	.			trans	-109.3	171.8	164.7	65.2	0	0	0	0	111	Y355 Q364 D365 L366	Y355-S362 VanDerWaalsContact O-CA 3.27Å; Y355-S362 WeakPolarHBondContact O-CA 3.39Å; Y355-S362 WeakPolarHBondContact O-CB 3.45Å; S362-Q364 PolarHBondContact O-N 3.25Å; S362-Q364 WeakPolarHBondContact OG-CB 3.44Å; S362-Q364 PolarHBondContact OG-N 3.29Å; S362-D365 WeakPolarHBondContact CB-OD2 3.45Å; S362-D365 PolarHBondContact N-OD2 2.79Å; S362-D365 PolarHBondContact O-N 3.39Å; S362-D365 PolarHBondContact OG-N 3.15Å; S362-D365 VanDerWaalsContact OG-N 3.09Å; S362-D365 PolarHBondContact OG-OD2 3.47Å; S362-L366 PolarHBondContact O-N 3.1Å; S362-L366 VanDerWaalsContact O-N 3.09Å
363	Y	98.6	Very high	98.1	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-30.2	168.8	-85	-93.2	0	0	0	112	I324 K352 Y353 D365 L366 V367 A390 R393 M407 P408	I324-Y363 HydrophobicContact CD1-CD2 4.37Å; K352-Y363 HydrophobicContact CG-CE2 4.48Å; K352-Y363 WeakPolarHBondContact O-CD2 3.49Å; Y353-Y363 PolarHBondContact O-N 3.34Å; Y363-D365 VanDerWaalsContact C-N 3.33Å; Y363-L366 HydrophobicContact CD1-CD1 4.44Å; Y363-L366 WeakPolarHBondContact O-CB 3.22Å; Y363-L366 PolarHBondContact O-N 3.21Å; Y363-V367 WeakPolarHBondContact O-CG2 3.39Å; Y363-V367 PolarHBondContact O-N 3.08Å; Y363-A390 HydrophobicContact CE1-CB 3.78Å; Y363-A390 WeakPolarHBondContact OH-CB 3.13Å; Y363-R393 HydrophobicContact CE1-CB 4.26Å; Y363-R393 PolarHBondContact OH-NH1 3.32Å; Y363-M407 HydrophobicContact CD1-CG 4.33Å; Y363-M407 HydrophobicContact CD1-SD 4.22Å; Y363-P408 HydrophobicContact CD1-CG 4.26Å; Y363-P408 HydrophobicContact CD2-CB 3.97Å; Y363-P408 HydrophobicContact CD2-CG 3.9Å; Y363-P408 HydrophobicContact CE1-CB 4.28Å; Y363-P408 HydrophobicContact CE2-CB 3.68Å; Y363-P408 HydrophobicContact CE2-CG 4.14Å; Y363-P408 HydrophobicContact CG-CB 4.38Å; Y363-P408 HydrophobicContact CG-CG 3.96Å
364	Q	98.4	Very high	98.1	Very high	63 Å²	63	34 Å²	34	29%	0.294	17%	0.173	S	C	.	.	H	α-helix	trans	-62.6	-40.3	172.7	-171.7	178.5	23.4	0	0	111.6	Y353 S362 V367 Q368	Y353-Q364 HydrophobicContact CE1-CB 3.96Å; Y353-Q364 HydrophobicContact CE1-CG 4.32Å; Y353-Q364 PolarHBondContact O-N 3.43Å; S362-Q364 PolarHBondContact O-N 3.25Å; S362-Q364 WeakPolarHBondContact OG-CB 3.44Å; S362-Q364 PolarHBondContact OG-N 3.29Å; Q364-V367 PolarHBondContact O-N 3.34Å; Q364-Q368 PolarHBondContact O-N 2.8Å
365	D	98.6	Very high	98.1	Very high	35 Å²	35	29.9 Å²	29.9	19%	0.187	16%	0.156	C	C	.	.	H	α-helix	trans	-66.4	-41.7	176	-60.5	-49.1	0	0	0	111.6	R356 E361 S362 Y363 V367 Q368 R369	R356-D365 IonicContact CZ-OD1 4Å; R356-D365 IonicContact CZ-OD2 2.63Å; R356-D365 IonicContact NE-OD1 3.39Å; R356-D365 IonicContact NE-OD2 3.61Å; R356-D365 PolarHBondContact NE-OD2 2.97Å; R356-D365 VanDerWaalsContact NH2-CG 3.28Å; R356-D365 IonicContact NH2-OD1 2.69Å; R356-D365 PolarHBondContact NH2-OD1 3.45Å; R356-D365 IonicContact NH2-OD2 3.46Å; R356-D365 PolarHBondContact NH2-OD2 3.3Å; R356-D365 VanDerWaalsContact NH2-OD2 3.16Å; E361-D365 HydrophobicContact CB-CB 4.13Å; E361-D365 HydrophobicContact CG-CB 4.19Å; S362-D365 WeakPolarHBondContact CB-OD2 3.45Å; S362-D365 PolarHBondContact N-OD2 2.79Å; S362-D365 PolarHBondContact O-N 3.39Å; S362-D365 PolarHBondContact OG-N 3.15Å; S362-D365 VanDerWaalsContact OG-N 3.09Å; S362-D365 PolarHBondContact OG-OD2 3.47Å; Y363-D365 VanDerWaalsContact C-N 3.33Å; D365-V367 VanDerWaalsContact C-N 3.32Å; D365-V367 PolarHBondContact O-N 3.28Å; D365-Q368 PolarHBondContact O-N 2.99Å; D365-R369 WeakPolarHBondContact O-CB 3.48Å; D365-R369 PolarHBondContact O-N 3.3Å
366	L	98.3	Very high	98	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.1	-44.3	173.9	-80.8	-170	0	0	0	112.5	I324 S362 Y363 Q368 R369 L370 A390 V391	I324-L366 HydrophobicContact CB-CD1 3.86Å; I324-L366 HydrophobicContact CB-CD2 4.33Å; I324-L366 HydrophobicContact CB-CG 4.18Å; I324-L366 HydrophobicContact CD1-CD1 4.25Å; I324-L366 HydrophobicContact CD1-CG 4.39Å; I324-L366 HydrophobicContact CG1-CD1 4.21Å; I324-L366 HydrophobicContact CG1-CG 4.15Å; S362-L366 PolarHBondContact O-N 3.1Å; S362-L366 VanDerWaalsContact O-N 3.09Å; Y363-L366 HydrophobicContact CD1-CD1 4.44Å; Y363-L366 WeakPolarHBondContact O-CB 3.22Å; Y363-L366 PolarHBondContact O-N 3.21Å; L366-Q368 VanDerWaalsContact C-N 3.32Å; L366-Q368 PolarHBondContact O-N 2.96Å; L366-R369 PolarHBondContact O-N 2.78Å; L366-L370 HydrophobicContact CB-CD1 4.47Å; L366-L370 VanDerWaalsContact O-CB 3.27Å; L366-L370 WeakPolarHBondContact O-CB 3.4Å; L366-L370 VanDerWaalsContact O-CG 3.23Å; L366-L370 WeakPolarHBondContact O-CG 3.31Å; L366-L370 PolarHBondContact O-N 2.96Å; L366-A390 HydrophobicContact CD1-CB 3.65Å; L366-V391 HydrophobicContact CD2-CG2 4.42Å
367	V	98.2	Very high	97.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.5	-46.5	177.9	161.8	0	0	0	0	110.9	W61 Y363 Q364 D365 R369 L370 E371 M407	W61-V367 HydrophobicContact CD2-CG1 4.14Å; W61-V367 HydrophobicContact CE3-CG1 4.12Å; W61-V367 HydrophobicContact CH2-CG1 4.18Å; W61-V367 VanDerWaalsContact CH2-O 3.22Å; W61-V367 WeakPolarHBondContact CH2-O 3.46Å; W61-V367 HydrophobicContact CZ2-CB 4.38Å; W61-V367 HydrophobicContact CZ2-CG1 4.23Å; W61-V367 HydrophobicContact CZ2-CG2 4.19Å; W61-V367 HydrophobicContact CZ3-CG1 4.12Å; W61-V367 WeakPolarHBondContact O-CG1 3.35Å; Y363-V367 WeakPolarHBondContact O-CG2 3.39Å; Y363-V367 PolarHBondContact O-N 3.08Å; Q364-V367 PolarHBondContact O-N 3.34Å; D365-V367 VanDerWaalsContact C-N 3.32Å; D365-V367 PolarHBondContact O-N 3.28Å; V367-R369 PolarHBondContact O-N 2.7Å; V367-L370 PolarHBondContact O-N 3.42Å; V367-E371 PolarHBondContact O-N 2.87Å; V367-E371 VanDerWaalsContact O-N 3.17Å; V367-M407 HydrophobicContact CG2-CE 3.9Å; V367-M407 HydrophobicContact CG2-SD 3.95Å
368	Q	95.4	Very high	97.7	Very high	96 Å²	96	28.3 Å²	28.3	45%	0.449	15%	0.152	S	C	.	.	H	α-helix	trans	-64	-41.6	177.8	-60.4	-60.1	-47.6	0	0	111.3	I62 Q364 D365 L366 L370 E371	I62-Q368 PolarHBondContact O-NE2 2.72Å; Q364-Q368 PolarHBondContact O-N 2.8Å; D365-Q368 PolarHBondContact O-N 2.99Å; L366-Q368 VanDerWaalsContact C-N 3.32Å; L366-Q368 PolarHBondContact O-N 2.96Å; Q368-L370 VanDerWaalsContact C-N 3.33Å; Q368-L370 PolarHBondContact O-N 2.92Å; Q368-E371 PolarHBondContact O-N 2.78Å
369	R	98.2	Very high	97.5	Very high	57 Å²	57	33 Å²	33	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-33.6	177.4	175.9	158.9	64.8	101.7	-21.9	113	K319 A320 N322 E323 E361 D365 L366 V367 P372	K319-R369 PolarHBondContact O-NH1 3.38Å; A320-R369 VanDerWaalsContact C-NH1 3.35Å; A320-R369 HydrophobicContact CB-CG 4.12Å; A320-R369 PolarHBondContact O-NH1 3.17Å; N322-R369 PolarHBondContact O-NH1 2.82Å; N322-R369 PolarHBondContact O-NH2 2.74Å; N322-R369 VanDerWaalsContact O-NH2 3.09Å; E323-R369 PolarHBondContact O-NH2 3.27Å; E361-R369 IonicContact OE1-CZ 2.72Å; E361-R369 IonicContact OE1-NE 3.86Å; E361-R369 PolarHBondContact OE1-NE 3.5Å; E361-R369 IonicContact OE1-NH2 2.98Å; E361-R369 PolarHBondContact OE1-NH2 2.76Å; E361-R369 IonicContact OE2-CZ 3.33Å; E361-R369 IonicContact OE2-NE 2.66Å; E361-R369 IonicContact OE2-NH2 2.67Å; E361-R369 PolarHBondContact OE2-NH2 2.86Å; D365-R369 WeakPolarHBondContact O-CB 3.48Å; D365-R369 PolarHBondContact O-N 3.3Å; L366-R369 PolarHBondContact O-N 2.78Å; V367-R369 PolarHBondContact O-N 2.7Å; R369-P372 WeakPolarHBondContact O-CD 3.17Å
370	L	98.6	Very high	97.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-88.4	-6.8	-177.1	-70.6	170.7	0	0	0	113.7	W61 A320 L321 L366 V367 Q368 V373 I374 V391 C394 L395	W61-L370 HydrophobicContact CH2-CB 3.89Å; W61-L370 HydrophobicContact CZ2-CB 4.2Å; A320-L370 WeakPolarHBondContact O-CD2 3.42Å; L321-L370 HydrophobicContact CD2-CD2 3.99Å; L366-L370 HydrophobicContact CB-CD1 4.47Å; L366-L370 VanDerWaalsContact O-CB 3.27Å; L366-L370 WeakPolarHBondContact O-CB 3.4Å; L366-L370 VanDerWaalsContact O-CG 3.23Å; L366-L370 WeakPolarHBondContact O-CG 3.31Å; L366-L370 PolarHBondContact O-N 2.96Å; V367-L370 PolarHBondContact O-N 3.42Å; Q368-L370 VanDerWaalsContact C-N 3.33Å; Q368-L370 PolarHBondContact O-N 2.92Å; L370-V373 HydrophobicContact CD2-CB 4.42Å; L370-V373 HydrophobicContact CD2-CG2 4.12Å; L370-V373 WeakPolarHBondContact O-CB 3.35Å; L370-V373 PolarHBondContact O-N 2.69Å; L370-I374 PolarHBondContact O-N 3.2Å; L370-V391 HydrophobicContact CD1-CG1 4.07Å; L370-V391 HydrophobicContact CD2-CG1 3.89Å; L370-C394 HydrophobicContact CD1-CB 3.49Å; L370-C394 VanDerWaalsContact CD1-CB 3.49Å; L370-L395 HydrophobicContact CD1-CD2 4.46Å; L370-L395 HydrophobicContact CD2-CD2 4.44Å
371	E	97.1	Very high	97	Very high	25 Å²	25	32.5 Å²	32.5	12%	0.117	15%	0.151	C	C	.	.	H	α-helix	trans	-54	-47.5	179.5	-179.4	176	166.7	0	0	112.8	Y58 W61 I62 R234 V367 Q368 V373 I374 M375	Y58-E371 HydrophobicContact CE2-CG 4.29Å; Y58-E371 PolarHBondContact OH-OE1 2.93Å; W61-E371 HydrophobicContact CZ3-CB 4.18Å; I62-E371 HydrophobicContact CG2-CG 4.49Å; R234-E371 IonicContact CZ-OE1 3.16Å; R234-E371 IonicContact CZ-OE2 2.79Å; R234-E371 IonicContact NE-OE1 3.77Å; R234-E371 PolarHBondContact NE-OE1 2.97Å; R234-E371 VanDerWaalsContact NE-OE1 3.16Å; R234-E371 IonicContact NH1-OE2 2.74Å; R234-E371 IonicContact NH2-OE1 3.81Å; R234-E371 PolarHBondContact NH2-OE1 3Å; R234-E371 IonicContact NH2-OE2 3.65Å; R234-E371 PolarHBondContact NH2-OE2 3.23Å; V367-E371 PolarHBondContact O-N 2.87Å; V367-E371 VanDerWaalsContact O-N 3.17Å; Q368-E371 PolarHBondContact O-N 2.78Å; E371-V373 VanDerWaalsContact C-N 3.25Å; E371-V373 PolarHBondContact O-N 3.01Å; E371-I374 PolarHBondContact O-N 3.27Å; E371-I374 VanDerWaalsContact O-N 3.13Å; E371-M375 WeakPolarHBondContact O-CG 3.27Å; E371-M375 PolarHBondContact O-N 2.98Å
372	P	97.6	Very high	96.9	Very high	73 Å²	73	32.1 Å²	32.1	47%	0.474	15%	0.151	S	C	.	.	H	α-helix	trans	-60.3	-33.4	176.2	-24	35.4	0	0	0	113.7	R369 M375 E376	R369-P372 WeakPolarHBondContact O-CD 3.17Å; P372-M375 PolarHBondContact O-N 2.91Å; P372-E376 PolarHBondContact O-N 3.44Å
373	V	98.4	Very high	96.9	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-42.6	176.4	-179.2	0	0	0	0	110.3	W297 W318 A320 L321 L370 E371 M375 E376 L377 L395	W297-V373 HydrophobicContact CE3-CG1 4.24Å; W297-V373 HydrophobicContact CZ3-CG1 3.94Å; W318-V373 HydrophobicContact CE3-CG2 4.05Å; A320-V373 HydrophobicContact CB-CG2 3.8Å; L321-V373 HydrophobicContact CD2-CG1 3.99Å; L321-V373 HydrophobicContact CD2-CG2 4.34Å; L321-V373 HydrophobicContact CG-CG2 4.37Å; L370-V373 HydrophobicContact CD2-CB 4.42Å; L370-V373 HydrophobicContact CD2-CG2 4.12Å; L370-V373 WeakPolarHBondContact O-CB 3.35Å; L370-V373 PolarHBondContact O-N 2.69Å; E371-V373 VanDerWaalsContact C-N 3.25Å; E371-V373 PolarHBondContact O-N 3.01Å; V373-M375 VanDerWaalsContact C-N 3.34Å; V373-E376 PolarHBondContact O-N 2.83Å; V373-L377 HydrophobicContact CG1-CD1 4.3Å; V373-L377 HydrophobicContact CG1-CG 4.45Å; V373-L377 WeakPolarHBondContact O-CB 3.47Å; V373-L377 WeakPolarHBondContact O-CG 3.23Å; V373-L377 PolarHBondContact O-N 3.05Å; V373-L395 HydrophobicContact CG1-CD2 4.26Å
374	I	97.8	Very high	96.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-42.1	175.3	-66.2	-59	0	0	0	111.1	W61 L370 E371 E376 L377 E378 L395 Y398 F399	W61-I374 HydrophobicContact CE3-CG1 4.43Å; W61-I374 HydrophobicContact CH2-CG1 3.53Å; W61-I374 HydrophobicContact CZ2-CG1 3.93Å; W61-I374 HydrophobicContact CZ3-CB 4.4Å; W61-I374 HydrophobicContact CZ3-CG1 3.81Å; L370-I374 PolarHBondContact O-N 3.2Å; E371-I374 PolarHBondContact O-N 3.27Å; E371-I374 VanDerWaalsContact O-N 3.13Å; I374-E376 VanDerWaalsContact C-N 3.32Å; I374-E376 PolarHBondContact O-N 3.23Å; I374-L377 HydrophobicContact CD1-CD1 4.35Å; I374-L377 PolarHBondContact O-N 3.38Å; I374-E378 HydrophobicContact CG2-CG 4.43Å; I374-E378 WeakPolarHBondContact O-CB 3.19Å; I374-E378 WeakPolarHBondContact O-CG 3.4Å; I374-E378 PolarHBondContact O-N 3.19Å; I374-L395 HydrophobicContact CD1-CD2 3.59Å; I374-L395 HydrophobicContact CG1-CD2 4.36Å; I374-Y398 HydrophobicContact CD1-CD1 3.66Å; I374-Y398 HydrophobicContact CD1-CE1 4.29Å; I374-Y398 HydrophobicContact CD1-CG 3.81Å; I374-Y398 HydrophobicContact CG1-CD1 4.47Å; I374-Y398 HydrophobicContact CG1-CG 4.33Å; I374-Y398 HydrophobicContact CG2-CD1 3.95Å; I374-Y398 HydrophobicContact CG2-CD2 3.98Å; I374-Y398 HydrophobicContact CG2-CE1 3.6Å; I374-Y398 HydrophobicContact CG2-CE2 3.62Å; I374-Y398 HydrophobicContact CG2-CG 4.12Å; I374-Y398 VanDerWaalsContact CG2-CZ 3.41Å; I374-F399 HydrophobicContact CD1-CE2 4.48Å
375	M	96.8	Very high	96.9	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.02	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-43.4	177.7	-61.6	-60.2	91.3	0	0	111.6	Y58 Y237 Y238 E371 P372 V373 E378 R379	Y58-M375 HydrophobicContact CD2-CE 3.73Å; Y58-M375 HydrophobicContact CE2-CE 3.28Å; Y58-M375 HydrophobicContact CE2-SD 4.18Å; Y237-M375 HydrophobicContact CD1-SD 4.19Å; Y237-M375 HydrophobicContact CE1-CB 4.4Å; Y237-M375 HydrophobicContact CE1-CG 3.71Å; Y237-M375 HydrophobicContact CE1-SD 3.87Å; Y238-M375 HydrophobicContact CD2-CE 3.53Å; Y238-M375 HydrophobicContact CD2-SD 3.85Å; Y238-M375 HydrophobicContact CE2-CE 3.77Å; E371-M375 WeakPolarHBondContact O-CG 3.27Å; E371-M375 PolarHBondContact O-N 2.98Å; P372-M375 PolarHBondContact O-N 2.91Å; V373-M375 VanDerWaalsContact C-N 3.34Å; M375-E378 PolarHBondContact O-N 3.46Å; M375-R379 PolarHBondContact O-N 3.29Å
376	E	97.1	Very high	96.9	Very high	37 Å²	37	27.2 Å²	27.2	17%	0.173	13%	0.127	C	C	.	.	H	α-helix	trans	-71.3	-39.5	178.7	-168.5	61.7	-160.7	0	0	111.6	W297 W318 P372 V373 I374 E378 R379 Q380	W297-E376 HydrophobicContact CH2-CB 3.65Å; W297-E376 HydrophobicContact CH2-CG 3.37Å; W297-E376 HydrophobicContact CZ2-CB 4.29Å; W297-E376 HydrophobicContact CZ2-CG 3.51Å; W297-E376 HydrophobicContact CZ3-CB 4.42Å; W297-E376 HydrophobicContact CZ3-CG 4.47Å; W318-E376 HydrophobicContact CH2-CB 4.1Å; W318-E376 HydrophobicContact CH2-CG 4.01Å; W318-E376 HydrophobicContact CZ2-CG 4.16Å; P372-E376 PolarHBondContact O-N 3.44Å; V373-E376 PolarHBondContact O-N 2.83Å; I374-E376 VanDerWaalsContact C-N 3.32Å; I374-E376 PolarHBondContact O-N 3.23Å; E376-E378 PolarHBondContact O-N 3.1Å; E376-R379 WeakPolarHBondContact O-CB 3.42Å; E376-R379 PolarHBondContact O-N 3.25Å; E376-R379 IonicContact OE1-CZ 3.63Å; E376-R379 IonicContact OE1-NE 3.35Å; E376-R379 PolarHBondContact OE1-NE 3.45Å; E376-R379 IonicContact OE1-NH2 2.64Å; E376-R379 PolarHBondContact OE1-NH2 3.2Å; E376-R379 IonicContact OE2-CZ 3.83Å; E376-R379 IonicContact OE2-NE 3.5Å; E376-R379 PolarHBondContact OE2-NE 3.37Å; E376-R379 IonicContact OE2-NH2 2.62Å; E376-R379 PolarHBondContact OE2-NH2 2.92Å; E376-Q380 HydrophobicContact CG-CG 4.25Å; E376-Q380 VanDerWaalsContact O-CG 3.27Å; E376-Q380 WeakPolarHBondContact O-CG 3.33Å; E376-Q380 PolarHBondContact O-N 3.05Å; E376-Q380 PolarHBondContact OE1-NE2 3.33Å
377	L	96.3	Very high	97	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-35.5	172.4	-76.9	176.5	0	0	0	112	R247 I249 W297 V373 I374 R379 V383 V385 L395 F399	R247-L377 PolarHBondContact NH1-O 3.4Å; I249-L377 HydrophobicContact CG2-CD2 4.31Å; W297-L377 HydrophobicContact CE3-CD2 4.09Å; W297-L377 HydrophobicContact CH2-CD2 3.91Å; W297-L377 HydrophobicContact CH2-CG 4.13Å; W297-L377 HydrophobicContact CZ3-CD2 3.47Å; W297-L377 VanDerWaalsContact CZ3-CD2 3.47Å; W297-L377 HydrophobicContact CZ3-CG 3.61Å; V373-L377 HydrophobicContact CG1-CD1 4.3Å; V373-L377 HydrophobicContact CG1-CG 4.45Å; V373-L377 WeakPolarHBondContact O-CB 3.47Å; V373-L377 WeakPolarHBondContact O-CG 3.23Å; V373-L377 PolarHBondContact O-N 3.05Å; I374-L377 HydrophobicContact CD1-CD1 4.35Å; I374-L377 PolarHBondContact O-N 3.38Å; L377-R379 PolarHBondContact O-N 3.11Å; L377-V383 HydrophobicContact CD2-CB 4.07Å; L377-V383 HydrophobicContact CD2-CG1 3.88Å; L377-V383 HydrophobicContact CD2-CG2 4.31Å; L377-V385 HydrophobicContact CD2-CG2 3.94Å; L377-L395 HydrophobicContact CD1-CD2 4.37Å; L377-F399 HydrophobicContact CB-CZ 4.22Å; L377-F399 HydrophobicContact CD1-CE2 3.86Å; L377-F399 HydrophobicContact CD1-CZ 3.97Å
378	E	94.8	Very high	97	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-69.8	-19.4	177.4	-75.8	-66.8	-176	0	0	113.5	K54 Y238 N241 I242 R247 I374 M375 E376 Y398	K54-E378 WeakPolarHBondContact CE-OE1 3.41Å; K54-E378 WeakPolarHBondContact CE-OE2 3.49Å; K54-E378 IonicContact NZ-OE1 3.2Å; K54-E378 IonicContact NZ-OE2 2.73Å; K54-E378 PolarHBondContact NZ-OE2 3.4Å; Y238-E378 HydrophobicContact CE2-CG 4.32Å; N241-E378 CarbonylContact O-C 3.54Å; I242-E378 HydrophobicContact CG2-CB 4.17Å; I242-E378 HydrophobicContact CG2-CG 4.28Å; R247-E378 PolarHBondContact NH1-O 3.02Å; R247-E378 PolarHBondContact NH2-O 3.02Å; R247-E378 IonicContact NH2-OE2 2.69Å; R247-E378 PolarHBondContact NH2-OE2 3.21Å; I374-E378 HydrophobicContact CG2-CG 4.43Å; I374-E378 WeakPolarHBondContact O-CB 3.19Å; I374-E378 WeakPolarHBondContact O-CG 3.4Å; I374-E378 PolarHBondContact O-N 3.19Å; M375-E378 PolarHBondContact O-N 3.46Å; E376-E378 PolarHBondContact O-N 3.1Å; E378-Y398 HydrophobicContact CG-CE1 4.45Å; E378-Y398 WeakPolarHBondContact CG-OH 3.35Å; E378-Y398 WeakPolarHBondContact OE1-CE1 3.34Å; E378-Y398 PolarHBondContact OE1-OH 3.04Å
379	R	93.5	Very high	97.2	Very high	127 Å²	127	24 Å²	24	48%	0.479	11%	0.112	S	C	.	.	H	α-helix	trans	-94.3	-27.5	-179.8	-165	175.3	76.8	95.9	-2.8	114	N241 H243 M375 E376 L377	N241-R379 WeakPolarHBondContact O-CA 3.46Å; N241-R379 PolarHBondContact O-N 2.85Å; H243-R379 PolarHBondContact NE2-O 3.02Å; M375-R379 PolarHBondContact O-N 3.29Å; E376-R379 WeakPolarHBondContact O-CB 3.42Å; E376-R379 PolarHBondContact O-N 3.25Å; E376-R379 IonicContact OE1-CZ 3.63Å; E376-R379 IonicContact OE1-NE 3.35Å; E376-R379 PolarHBondContact OE1-NE 3.45Å; E376-R379 IonicContact OE1-NH2 2.64Å; E376-R379 PolarHBondContact OE1-NH2 3.2Å; E376-R379 IonicContact OE2-CZ 3.83Å; E376-R379 IonicContact OE2-NE 3.5Å; E376-R379 PolarHBondContact OE2-NE 3.37Å; E376-R379 IonicContact OE2-NH2 2.62Å; E376-R379 PolarHBondContact OE2-NH2 2.92Å; L377-R379 PolarHBondContact O-N 3.11Å
380	Q	93.7	Very high	97.2	Very high	28 Å²	28	21.4 Å²	21.4	13%	0.131	10%	0.102	C	C	.	.			trans	-87.3	157.1	-173.4	-69	-64.2	-27.6	0	0	113.4	H243 R247 W297 E376 V383	H243-Q380 PolarHBondContact NE2-O 3.15Å; R247-Q380 WeakPolarHBondContact CD-O 3.19Å; R247-Q380 PolarHBondContact NH1-O 2.82Å; W297-Q380 HydrophobicContact CH2-CG 4.24Å; W297-Q380 HydrophobicContact CZ2-CG 3.9Å; E376-Q380 HydrophobicContact CG-CG 4.25Å; E376-Q380 VanDerWaalsContact O-CG 3.27Å; E376-Q380 WeakPolarHBondContact O-CG 3.33Å; E376-Q380 PolarHBondContact O-N 3.05Å; E376-Q380 PolarHBondContact OE1-NE2 3.33Å; Q380-V383 HydrophobicContact CB-CG2 3.38Å; Q380-V383 HydrophobicContact CG-CG2 4.12Å
381	E	93.1	Very high	97.2	Very high	95 Å²	95	21.4 Å²	21.4	44%	0.444	10%	0.102	S	C	.	.	S	Bend	trans	-82.8	-105.1	171.9	-66.3	178	-158.5	0	0	111.5	R247	R247-E381 HydrophobicContact CB-CB 4.43Å; R247-E381 WeakPolarHBondContact CD-O 3.49Å
382	N	96.4	Very high	97.3	Very high	26 Å²	26	20.3 Å²	20.3	14%	0.139	10%	0.097	C	C	.	.	S	Bend	trans	-82.3	119.8	-179	-60.5	-47.9	0	0	0	110.4	T248 K292 L294 R295	T248-N382 PolarHBondContact N-OD1 3.02Å; T248-N382 VanDerWaalsContact N-OD1 3.12Å; T248-N382 WeakPolarHBondContact O-CA 3.42Å; K292-N382 PolarHBondContact O-ND2 3.37Å; L294-N382 HydrophobicContact CD1-CB 4.17Å; R295-N382 PolarHBondContact N-O 3.19Å
383	V	98.3	Very high	97.3	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.1	-179.2	-171.9	0	0	0	0	110.5	T248 I249 Y250 R295 W297 L377 Q380 V385	T248-V383 PolarHBondContact O-N 2.58Å; I249-V383 CarbonylContact C-O 3.59Å; I249-V383 WeakPolarHBondContact CA-O 3.31Å; Y250-V383 PolarHBondContact N-O 3.17Å; R295-V383 HydrophobicContact CB-CG1 4.46Å; R295-V383 HydrophobicContact CB-CG2 4.34Å; R295-V383 CarbonylContact O-C 3.19Å; R295-V383 WeakPolarHBondContact O-CA 3.28Å; W297-V383 HydrophobicContact CD2-CG1 3.91Å; W297-V383 HydrophobicContact CE3-CG1 4.13Å; W297-V383 HydrophobicContact CG-CG1 4.33Å; W297-V383 HydrophobicContact CZ2-CG1 4.4Å; W297-V383 HydrophobicContact CZ3-CG1 4.47Å; L377-V383 HydrophobicContact CD2-CB 4.07Å; L377-V383 HydrophobicContact CD2-CG1 3.88Å; L377-V383 HydrophobicContact CD2-CG2 4.31Å; Q380-V383 HydrophobicContact CB-CG2 3.38Å; Q380-V383 HydrophobicContact CG-CG2 4.12Å; V383-V385 HydrophobicContact CG1-CG2 3.92Å
384	L	98.8	Very high	97.3	Very high	2 Å²	2	17 Å²	17	1%	0.01	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.6	165.5	171	63.3	0	0	0	109.3	Y250 L282 V286 L294 R295 V296 W297 L311 I386	Y250-L384 CarbonylContact O-C 3.58Å; Y250-L384 WeakPolarHBondContact O-CA 3.43Å; L282-L384 HydrophobicContact CD2-CD2 4.45Å; V286-L384 HydrophobicContact CG2-CD2 3.96Å; L294-L384 HydrophobicContact CD1-CB 4.1Å; L294-L384 HydrophobicContact CD2-CB 4.36Å; L294-L384 HydrophobicContact CG-CB 4.49Å; R295-L384 PolarHBondContact O-N 3.49Å; V296-L384 CarbonylContact C-O 3.48Å; V296-L384 WeakPolarHBondContact CA-O 3.37Å; V296-L384 HydrophobicContact CG1-CD2 4.46Å; V296-L384 HydrophobicContact CG2-CB 4.48Å; V296-L384 HydrophobicContact CG2-CD2 4.49Å; W297-L384 PolarHBondContact N-O 3.2Å; L311-L384 HydrophobicContact CD1-CD2 3.69Å; L384-I386 HydrophobicContact CD1-CG1 4.43Å; L384-I386 HydrophobicContact CD2-CD1 4.3Å; L384-I386 HydrophobicContact CD2-CG1 4.29Å; L384-I386 HydrophobicContact CG-CG1 4.05Å
385	V	98.9	Very high	97.4	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.8	175.3	-172.9	0	0	0	0	109.5	Y250 L251 C252 W297 L321 L377 V383 C387 L395	Y250-V385 PolarHBondContact O-N 3Å; L251-V385 HydrophobicContact CD2-CB 3.72Å; L251-V385 HydrophobicContact CD2-CG2 3.81Å; C252-V385 PolarHBondContact N-O 3.25Å; W297-V385 HydrophobicContact CE3-CG2 4.05Å; L321-V385 HydrophobicContact CD1-CG1 3.77Å; L321-V385 HydrophobicContact CD2-CG1 3.94Å; L377-V385 HydrophobicContact CD2-CG2 3.94Å; V383-V385 HydrophobicContact CG1-CG2 3.92Å; V385-C387 HydrophobicContact CG1-CB 4.23Å; V385-L395 HydrophobicContact CG1-CD1 4.12Å
386	I	98.9	Very high	97.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	106.4	175.5	-46.6	-179.3	0	0	0	108.3	C252 L282 V296 W297 T298 T304 T307 A308 L311 L384	C252-I386 WeakPolarHBondContact O-CA 3.36Å; L282-I386 HydrophobicContact CD2-CD1 4.06Å; V296-I386 HydrophobicContact CG1-CD1 4.22Å; W297-I386 PolarHBondContact O-N 3.22Å; T298-I386 WeakPolarHBondContact CA-O 3.42Å; T298-I386 HydrophobicContact CG2-CB 4.46Å; T304-I386 HydrophobicContact CG2-CG2 4.4Å; T304-I386 WeakPolarHBondContact CG2-O 3.39Å; T307-I386 HydrophobicContact CG2-CD1 4.09Å; T307-I386 HydrophobicContact CG2-CG2 3.94Å; A308-I386 HydrophobicContact CB-CD1 3.94Å; L311-I386 HydrophobicContact CD1-CD1 4.05Å; L384-I386 HydrophobicContact CD1-CG1 4.43Å; L384-I386 HydrophobicContact CD2-CD1 4.3Å; L384-I386 HydrophobicContact CD2-CG1 4.29Å; L384-I386 HydrophobicContact CG-CG1 4.05Å
387	C	98.8	Very high	97.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	-146	-171.5	62.3	0	0	0	0	112.1	C252 R253 H254 L321 V385 V391	C252-C387 PolarHBondContact O-N 2.97Å; R253-C387 CarbonylContact C-O 3.58Å; R253-C387 VanDerWaalsContact CA-O 3.23Å; R253-C387 WeakPolarHBondContact CA-O 3.39Å; H254-C387 PolarHBondContact CD2-O 3.2Å; H254-C387 VanDerWaalsContact CD2-O 3.3Å; H254-C387 PolarHBondContact N-O 3.42Å; L321-C387 HydrophobicContact CD2-CB 4.4Å; V385-C387 HydrophobicContact CG1-CB 4.23Å; C387-V391 HydrophobicContact CB-CB 4.34Å; C387-V391 HydrophobicContact CB-CG1 3.85Å
388	H	98.9	Very high	97.6	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.032	7%	0.069	C	C	.	.			trans	-127.7	178.5	-171.9	-53	-94.2	0	0	0	111.9	H254 S299 T304 L321 E323 L392	H254-H388 AromaticContact CD2-CE1 3.71Å; H254-H388 AromaticContact CD2-CG 3.95Å; H254-H388 AromaticContact CD2-ND1 3.17Å; H254-H388 PolarHBondContact CD2-ND1 2.99Å; H254-H388 AromaticContact NE2-ND1 3.37Å; H254-H388 PolarHBondContact NE2-ND1 3.34Å; S299-H388 WeakPolarHBondContact CB-NE2 3.46Å; S299-H388 PolarHBondContact OG-NE2 2.84Å; T304-H388 WeakPolarHBondContact CG2-NE2 3.45Å; L321-H388 PolarHBondContact O-CD2 2.88Å; L321-H388 VanDerWaalsContact O-CD2 3.3Å; E323-H388 HydrophobicContact CB-CB 3.68Å; E323-H388 HydrophobicContact CG-CB 3.85Å; E323-H388 PolarHBondContact N-CD2 3.01Å; E323-H388 WeakPolarHBondContact OE1-CB 3.46Å; E323-H388 WeakPolarHBondContact OE2-CB 3.45Å; H388-L392 WeakPolarHBondContact O-CB 3.2Å; H388-L392 PolarHBondContact O-N 3.47Å
389	Q	98.6	Very high	97.7	Very high	21 Å²	21	15.7 Å²	15.7	10%	0.098	7%	0.069	C	C	.	.	H	α-helix	trans	-68.5	-47.5	-169.7	-172.7	174.3	-108.6	0	0	112.5	E323 R393 T441	E323-Q389 PolarHBondContact OE2-N 3.47Å; Q389-R393 VanDerWaalsContact O-CG 3.25Å; Q389-R393 WeakPolarHBondContact O-CG 3.47Å; Q389-R393 PolarHBondContact O-N 3.4Å; Q389-T441 PolarHBondContact NE2-O 3.24Å; Q389-T441 PolarHBondContact OE1-O 2.92Å; Q389-T441 PolarHBondContact OE1-OG1 3.13Å
390	A	98.6	Very high	97.8	Very high	3 Å²	3	11.9 Å²	11.9	3%	0.025	6%	0.058	C	C	.	.	H	α-helix	trans	-74.1	-38.9	-178	0	0	0	0	0	111.6	E323 I324 Y363 L366 R393 C394	E323-A390 WeakPolarHBondContact OE1-CA 3.43Å; E323-A390 WeakPolarHBondContact OE1-CB 3.44Å; E323-A390 PolarHBondContact OE1-N 3.05Å; E323-A390 PolarHBondContact OE2-N 2.9Å; I324-A390 HydrophobicContact CB-CB 3.93Å; I324-A390 HydrophobicContact CG2-CB 3.7Å; Y363-A390 HydrophobicContact CE1-CB 3.78Å; Y363-A390 WeakPolarHBondContact OH-CB 3.13Å; L366-A390 HydrophobicContact CD1-CB 3.65Å; A390-R393 WeakPolarHBondContact O-CB 3.43Å; A390-R393 PolarHBondContact O-N 3.03Å; A390-C394 PolarHBondContact O-N 2.91Å; A390-C394 VanDerWaalsContact O-N 3.15Å; A390-C394 PolarHBondContact O-SG 2.97Å
391	V	98.9	Very high	97.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.2	-50.4	173.6	174.7	0	0	0	0	111.7	L321 N322 E323 L366 L370 C387 R393 C394 L395	L321-V391 HydrophobicContact CD2-CG1 3.77Å; N322-V391 WeakPolarHBondContact O-CG2 3.37Å; E323-V391 PolarHBondContact OE1-N 3.05Å; L366-V391 HydrophobicContact CD2-CG2 4.42Å; L370-V391 HydrophobicContact CD1-CG1 4.07Å; L370-V391 HydrophobicContact CD2-CG1 3.89Å; C387-V391 HydrophobicContact CB-CB 4.34Å; C387-V391 HydrophobicContact CB-CG1 3.85Å; V391-R393 VanDerWaalsContact C-N 3.28Å; V391-R393 PolarHBondContact O-N 3.26Å; V391-C394 WeakPolarHBondContact O-CB 3.43Å; V391-C394 PolarHBondContact O-N 3.08Å; V391-L395 HydrophobicContact CG1-CD1 4.2Å; V391-L395 HydrophobicContact CG1-CG 4.46Å; V391-L395 WeakPolarHBondContact O-CG 3.28Å; V391-L395 PolarHBondContact O-N 3.13Å
392	L	98.8	Very high	98.1	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-60.5	-38.5	-179.5	-178	53.8	0	0	0	111.9	L251 R253 H388 C394 L395 L396 C412 L418	L251-L392 HydrophobicContact CB-CD1 3.31Å; L251-L392 HydrophobicContact CD1-CD1 3.8Å; L251-L392 HydrophobicContact CG-CD1 4.14Å; R253-L392 HydrophobicContact CG-CD2 3.76Å; H388-L392 WeakPolarHBondContact O-CB 3.2Å; H388-L392 PolarHBondContact O-N 3.47Å; L392-C394 PolarHBondContact O-N 3.31Å; L392-L395 PolarHBondContact O-N 3.35Å; L392-L396 WeakPolarHBondContact O-CB 3.34Å; L392-L396 PolarHBondContact O-N 3.44Å; L392-C412 HydrophobicContact CB-CB 4.48Å; L392-C412 HydrophobicContact CD2-CB 3.72Å; L392-C412 HydrophobicContact CG-CB 4.01Å; L392-L418 HydrophobicContact CD2-CD1 4.47Å
393	R	98.8	Very high	98.1	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.015	8%	0.084	C	C	.	.	H	α-helix	trans	-59.9	-43.4	173.3	-75.5	177.2	172.6	141.4	15.5	112.3	Y363 Q389 A390 V391 L396 A397 M407 P408 L410 H442	Y363-R393 HydrophobicContact CE1-CB 4.26Å; Y363-R393 PolarHBondContact OH-NH1 3.32Å; Q389-R393 VanDerWaalsContact O-CG 3.25Å; Q389-R393 WeakPolarHBondContact O-CG 3.47Å; Q389-R393 PolarHBondContact O-N 3.4Å; A390-R393 WeakPolarHBondContact O-CB 3.43Å; A390-R393 PolarHBondContact O-N 3.03Å; V391-R393 VanDerWaalsContact C-N 3.28Å; V391-R393 PolarHBondContact O-N 3.26Å; R393-L396 PolarHBondContact O-N 2.89Å; R393-A397 VanDerWaalsContact O-CB 3.26Å; R393-A397 WeakPolarHBondContact O-CB 3.41Å; R393-A397 PolarHBondContact O-N 3.12Å; R393-M407 WeakPolarHBondContact CB-O 3.43Å; R393-M407 WeakPolarHBondContact CD-O 3.02Å; R393-P408 VanDerWaalsContact CZ-O 3.32Å; R393-P408 PolarHBondContact NE-O 3.14Å; R393-P408 PolarHBondContact NH1-O 3.32Å; R393-P408 VanDerWaalsContact NH1-O 3.1Å; R393-L410 HydrophobicContact CG-CB 4.09Å; R393-L410 PolarHBondContact NE-O 3.31Å; R393-L410 PolarHBondContact NH2-O 3.21Å; R393-H442 PolarHBondContact NH2-ND1 2.94Å
394	C	98.8	Very high	98	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.5	-45.8	179.1	-62.4	0	0	0	0	111.8	W61 L370 A390 V391 L392 A397 Y398 M407	W61-C394 PolarHBondContact NE1-O 3.05Å; L370-C394 HydrophobicContact CD1-CB 3.49Å; L370-C394 VanDerWaalsContact CD1-CB 3.49Å; A390-C394 PolarHBondContact O-N 2.91Å; A390-C394 VanDerWaalsContact O-N 3.15Å; A390-C394 PolarHBondContact O-SG 2.97Å; V391-C394 WeakPolarHBondContact O-CB 3.43Å; V391-C394 PolarHBondContact O-N 3.08Å; L392-C394 PolarHBondContact O-N 3.31Å; C394-A397 PolarHBondContact O-N 3.49Å; C394-Y398 PolarHBondContact O-N 3.17Å; C394-M407 HydrophobicContact CB-SD 4.22Å
395	L	98.7	Very high	97.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.7	-45.6	176.6	-62.8	178.2	0	0	0	111.2	L251 L321 L370 V373 I374 L377 V385 V391 L392 A397 Y398 F399	L251-L395 HydrophobicContact CD1-CB 4.19Å; L251-L395 HydrophobicContact CD2-CD1 4.4Å; L321-L395 HydrophobicContact CD2-CD1 4.22Å; L370-L395 HydrophobicContact CD1-CD2 4.46Å; L370-L395 HydrophobicContact CD2-CD2 4.44Å; V373-L395 HydrophobicContact CG1-CD2 4.26Å; I374-L395 HydrophobicContact CD1-CD2 3.59Å; I374-L395 HydrophobicContact CG1-CD2 4.36Å; L377-L395 HydrophobicContact CD1-CD2 4.37Å; V385-L395 HydrophobicContact CG1-CD1 4.12Å; V391-L395 HydrophobicContact CG1-CD1 4.2Å; V391-L395 HydrophobicContact CG1-CG 4.46Å; V391-L395 WeakPolarHBondContact O-CG 3.28Å; V391-L395 PolarHBondContact O-N 3.13Å; L392-L395 PolarHBondContact O-N 3.35Å; L395-A397 VanDerWaalsContact C-N 3.34Å; L395-A397 PolarHBondContact O-N 3.48Å; L395-Y398 WeakPolarHBondContact O-CB 3.25Å; L395-Y398 PolarHBondContact O-N 2.94Å; L395-F399 VanDerWaalsContact O-CD2 3.23Å; L395-F399 WeakPolarHBondContact O-CD2 3.19Å; L395-F399 PolarHBondContact O-N 2.95Å
396	L	98.1	Very high	97.7	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-64.5	-39.6	179.5	-171.6	64.9	0	0	0	111.7	L392 R393 Y398 F399 L400 L410 L418 L420	L392-L396 WeakPolarHBondContact O-CB 3.34Å; L392-L396 PolarHBondContact O-N 3.44Å; R393-L396 PolarHBondContact O-N 2.89Å; L396-Y398 VanDerWaalsContact C-N 3.28Å; L396-Y398 PolarHBondContact O-N 3.25Å; L396-F399 PolarHBondContact O-N 3.39Å; L396-L400 HydrophobicContact CD1-CD1 3.6Å; L396-L400 HydrophobicContact CD1-CG 3.84Å; L396-L400 HydrophobicContact CD2-CD1 4.22Å; L396-L400 HydrophobicContact CG-CD1 3.71Å; L396-L400 HydrophobicContact CG-CG 4.13Å; L396-L400 WeakPolarHBondContact O-CB 3.18Å; L396-L400 WeakPolarHBondContact O-CG 3.35Å; L396-L400 PolarHBondContact O-N 3.07Å; L396-L410 HydrophobicContact CB-CD1 4.34Å; L396-L410 HydrophobicContact CD2-CB 4.4Å; L396-L410 HydrophobicContact CD2-CD1 4.34Å; L396-L410 HydrophobicContact CG-CD1 4.37Å; L396-L418 HydrophobicContact CD1-CD1 4.14Å; L396-L418 HydrophobicContact CD2-CD1 3.86Å; L396-L420 HydrophobicContact CD1-CD2 4.14Å
397	A	98.3	Very high	97.6	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-37.5	176.4	0	0	0	0	0	112.3	R393 C394 L395 D401 K402 M407 L410	R393-A397 VanDerWaalsContact O-CB 3.26Å; R393-A397 WeakPolarHBondContact O-CB 3.41Å; R393-A397 PolarHBondContact O-N 3.12Å; C394-A397 PolarHBondContact O-N 3.49Å; L395-A397 VanDerWaalsContact C-N 3.34Å; L395-A397 PolarHBondContact O-N 3.48Å; A397-D401 WeakPolarHBondContact O-CA 3.47Å; A397-D401 PolarHBondContact O-N 2.89Å; A397-K402 HydrophobicContact CB-CB 3.91Å; A397-K402 PolarHBondContact O-N 2.92Å; A397-M407 HydrophobicContact CB-CB 3.87Å; A397-M407 HydrophobicContact CB-CE 3.72Å; A397-M407 HydrophobicContact CB-CG 3.67Å; A397-M407 HydrophobicContact CB-SD 4.36Å; A397-L410 HydrophobicContact CB-CD1 3.84Å
398	Y	97.9	Very high	97.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-51.6	172.3	171.7	-99.4	0	0	0	111.9	R57 Y58 W61 Y238 I374 E378 C394 L395 L396 L400	R57-Y398 WeakPolarHBondContact CD-O 3.41Å; R57-Y398 VanDerWaalsContact CG-O 3.31Å; R57-Y398 WeakPolarHBondContact CG-O 3.28Å; R57-Y398 PolarHBondContact NE-O 2.79Å; Y58-Y398 HydrophobicContact CD2-CE2 4.33Å; W61-Y398 HydrophobicContact CB-CD2 4.04Å; W61-Y398 HydrophobicContact CD2-CD2 4.03Å; W61-Y398 HydrophobicContact CD2-CG 4.49Å; W61-Y398 HydrophobicContact CE3-CD2 4.32Å; W61-Y398 AromaticContact CG-CD2 3.9Å; W61-Y398 HydrophobicContact CG-CD2 3.9Å; W61-Y398 HydrophobicContact CG-CG 4.43Å; Y238-Y398 PolarHBondContact OH-OH 2.89Å; I374-Y398 HydrophobicContact CD1-CD1 3.66Å; I374-Y398 HydrophobicContact CD1-CE1 4.29Å; I374-Y398 HydrophobicContact CD1-CG 3.81Å; I374-Y398 HydrophobicContact CG1-CD1 4.47Å; I374-Y398 HydrophobicContact CG1-CG 4.33Å; I374-Y398 HydrophobicContact CG2-CD1 3.95Å; I374-Y398 HydrophobicContact CG2-CD2 3.98Å; I374-Y398 HydrophobicContact CG2-CE1 3.6Å; I374-Y398 HydrophobicContact CG2-CE2 3.62Å; I374-Y398 HydrophobicContact CG2-CG 4.12Å; I374-Y398 VanDerWaalsContact CG2-CZ 3.41Å; E378-Y398 HydrophobicContact CG-CE1 4.45Å; E378-Y398 WeakPolarHBondContact CG-OH 3.35Å; E378-Y398 WeakPolarHBondContact OE1-CE1 3.34Å; E378-Y398 PolarHBondContact OE1-OH 3.04Å; C394-Y398 PolarHBondContact O-N 3.17Å; L395-Y398 WeakPolarHBondContact O-CB 3.25Å; L395-Y398 PolarHBondContact O-N 2.94Å; L396-Y398 VanDerWaalsContact C-N 3.28Å; L396-Y398 PolarHBondContact O-N 3.25Å; Y398-L400 PolarHBondContact O-N 2.81Å
399	F	96.5	Very high	97.5	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.022	14%	0.139	C	C	.	.	H	α-helix	trans	-71.3	-29.4	-175.8	-72.9	-70.5	0	0	0	113.6	R57 I249 I374 L377 L395 L396 L420 C427	R57-F399 PolarHBondContact NH1-O 2.65Å; I249-F399 HydrophobicContact CD1-CE1 3.6Å; I249-F399 HydrophobicContact CD1-CE2 4.29Å; I249-F399 HydrophobicContact CD1-CZ 3.46Å; I249-F399 VanDerWaalsContact CD1-CZ 3.46Å; I374-F399 HydrophobicContact CD1-CE2 4.48Å; L377-F399 HydrophobicContact CB-CZ 4.22Å; L377-F399 HydrophobicContact CD1-CE2 3.86Å; L377-F399 HydrophobicContact CD1-CZ 3.97Å; L395-F399 VanDerWaalsContact O-CD2 3.23Å; L395-F399 WeakPolarHBondContact O-CD2 3.19Å; L395-F399 PolarHBondContact O-N 2.95Å; L396-F399 PolarHBondContact O-N 3.39Å; F399-L420 HydrophobicContact CB-CD1 3.83Å; F399-L420 HydrophobicContact CD2-CD1 3.57Å; F399-L420 HydrophobicContact CE2-CD1 4.29Å; F399-L420 HydrophobicContact CG-CD1 3.71Å; F399-C427 HydrophobicContact CB-CB 4.41Å; F399-C427 WeakPolarHBondContact O-CB 3.34Å
400	L	96.1	Very high	97.5	Very high	47 Å²	47	27 Å²	27	25%	0.246	14%	0.141	C	C	.	.	H	α-helix	trans	-98.6	6.1	-178.6	-60.1	-171.3	0	0	0	114.3	L396 Y398 K402 C427 V429	L396-L400 HydrophobicContact CD1-CD1 3.6Å; L396-L400 HydrophobicContact CD1-CG 3.84Å; L396-L400 HydrophobicContact CD2-CD1 4.22Å; L396-L400 HydrophobicContact CG-CD1 3.71Å; L396-L400 HydrophobicContact CG-CG 4.13Å; L396-L400 WeakPolarHBondContact O-CB 3.18Å; L396-L400 WeakPolarHBondContact O-CG 3.35Å; L396-L400 PolarHBondContact O-N 3.07Å; Y398-L400 PolarHBondContact O-N 2.81Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 HydrophobicContact CB-CG 3.94Å; L400-K402 PolarHBondContact O-N 2.94Å; L400-C427 HydrophobicContact CD2-CB 4.42Å; L400-V429 HydrophobicContact CD1-CG1 4.37Å; L400-V429 HydrophobicContact CD2-CB 4.29Å; L400-V429 HydrophobicContact CD2-CG1 4.26Å
401	D	96.1	Very high	97.4	Very high	102 Å²	102	33 Å²	33	55%	0.545	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	48.6	-179.8	-162.9	32.6	0	0	0	112.4	R57 A397	R57-D401 HydrophobicContact CG-CB 4.07Å; R57-D401 WeakPolarHBondContact CG-OD1 3.49Å; A397-D401 WeakPolarHBondContact O-CA 3.47Å; A397-D401 PolarHBondContact O-N 2.89Å
402	K	97.4	Very high	97.4	Very high	78 Å²	78	33 Å²	33	34%	0.339	17%	0.167	S	C	.	.			trans	-93.1	140.5	-179.7	-62.1	-63.9	-172.6	178.1	0	111.4	A397 L400 E406 L410	A397-K402 HydrophobicContact CB-CB 3.91Å; A397-K402 PolarHBondContact O-N 2.92Å; L400-K402 VanDerWaalsContact C-N 3.34Å; L400-K402 HydrophobicContact CB-CG 3.94Å; L400-K402 PolarHBondContact O-N 2.94Å; K402-E406 HydrophobicContact CB-CB 4.48Å; K402-E406 IonicContact NZ-OE1 3.17Å; K402-E406 PolarHBondContact NZ-OE1 3.26Å; K402-L410 HydrophobicContact CB-CD1 4.21Å; K402-L410 HydrophobicContact CB-CD2 4.49Å; K402-L410 HydrophobicContact CD-CD2 4.38Å; K402-L410 HydrophobicContact CG-CD1 4.12Å; K402-L410 HydrophobicContact CG-CD2 3.96Å
403	S	97.1	Very high	97.4	Very high	52 Å²	52	36 Å²	36	36%	0.364	19%	0.186	S	C	.	.			trans	-66	159.3	-179.2	64.9	0	0	0	0	112.2	E405 E406 M407	S403-E405 PolarHBondContact O-N 2.91Å; S403-E406 WeakPolarHBondContact CB-OE2 3.01Å; S403-E406 PolarHBondContact N-OE2 3.2Å; S403-E406 PolarHBondContact O-N 3.06Å; S403-E406 WeakPolarHBondContact OG-CG 3.48Å; S403-E406 PolarHBondContact OG-N 3.06Å; S403-E406 PolarHBondContact OG-OE2 3.47Å; S403-M407 WeakPolarHBondContact O-CB 3.23Å; S403-M407 PolarHBondContact O-N 3.01Å
404	A	95.4	Very high	97.4	Very high	33 Å²	33	36 Å²	36	27%	0.273	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-33.5	171.6	0	0	0	0	0	112.3	Y353 P408	Y353-A404 WeakPolarHBondContact CB-O 3.45Å; Y353-A404 HydrophobicContact CD1-CB 3.82Å; Y353-A404 HydrophobicContact CD2-CB 3.84Å; Y353-A404 WeakPolarHBondContact CD2-O 3.41Å; Y353-A404 HydrophobicContact CE1-CB 3.68Å; Y353-A404 HydrophobicContact CE2-CB 3.71Å; Y353-A404 HydrophobicContact CG-CB 3.9Å; A404-P408 WeakPolarHBondContact O-CD 3.38Å
405	E	94.1	Very high	97.3	Very high	81 Å²	81	36.1 Å²	36.1	38%	0.379	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-41.2	178.8	-177.7	168.9	-165.7	0	0	112.9	S403 Y409 R445 H453	S403-E405 PolarHBondContact O-N 2.91Å; E405-Y409 WeakPolarHBondContact O-CD2 3.36Å; E405-R445 IonicContact OE1-CZ 3.36Å; E405-R445 IonicContact OE1-NH1 3.98Å; E405-R445 PolarHBondContact OE1-NH1 3.17Å; E405-R445 IonicContact OE1-NH2 2.72Å; E405-R445 PolarHBondContact OE1-NH2 3.36Å; E405-H453 IonicContact OE1-CE1 3.38Å; E405-H453 PolarHBondContact OE1-CE1 3.42Å; E405-H453 IonicContact OE1-CG 2.76Å; E405-H453 IonicContact OE1-ND1 3.7Å; E405-H453 PolarHBondContact OE1-ND1 2.94Å; E405-H453 IonicContact OE1-NE2 3.16Å; E405-H453 IonicContact OE2-CE1 2.82Å; E405-H453 PolarHBondContact OE2-CE1 3.43Å; E405-H453 IonicContact OE2-ND1 3.06Å
406	E	96.2	Very high	97.4	Very high	86 Å²	86	36.5 Å²	36.5	40%	0.402	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-32.1	179	-69.8	166.6	96.4	0	0	112.6	K402 S403 Y409 L410	K402-E406 HydrophobicContact CB-CB 4.48Å; K402-E406 IonicContact NZ-OE1 3.17Å; K402-E406 PolarHBondContact NZ-OE1 3.26Å; S403-E406 WeakPolarHBondContact CB-OE2 3.01Å; S403-E406 PolarHBondContact N-OE2 3.2Å; S403-E406 PolarHBondContact O-N 3.06Å; S403-E406 WeakPolarHBondContact OG-CG 3.48Å; S403-E406 PolarHBondContact OG-N 3.06Å; S403-E406 PolarHBondContact OG-OE2 3.47Å; E406-Y409 PolarHBondContact O-N 3.13Å; E406-L410 PolarHBondContact O-N 2.73Å
407	M	97.9	Very high	97.4	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-50.1	-49.8	-171	173.5	-167.1	-53.9	0	0	113.8	Y353 Y363 V367 R393 C394 A397 S403 Y409 L410	Y353-M407 HydrophobicContact CD2-SD 4.3Å; Y353-M407 HydrophobicContact CE2-CE 4.11Å; Y353-M407 HydrophobicContact CE2-SD 3.87Å; Y363-M407 HydrophobicContact CD1-CG 4.33Å; Y363-M407 HydrophobicContact CD1-SD 4.22Å; V367-M407 HydrophobicContact CG2-CE 3.9Å; V367-M407 HydrophobicContact CG2-SD 3.95Å; R393-M407 WeakPolarHBondContact CB-O 3.43Å; R393-M407 WeakPolarHBondContact CD-O 3.02Å; C394-M407 HydrophobicContact CB-SD 4.22Å; A397-M407 HydrophobicContact CB-CB 3.87Å; A397-M407 HydrophobicContact CB-CE 3.72Å; A397-M407 HydrophobicContact CB-CG 3.67Å; A397-M407 HydrophobicContact CB-SD 4.36Å; S403-M407 WeakPolarHBondContact O-CB 3.23Å; S403-M407 PolarHBondContact O-N 3.01Å; M407-Y409 PolarHBondContact O-N 3.01Å; M407-L410 PolarHBondContact O-N 3.23Å
408	P	98.3	Very high	97.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-65.5	-6.6	-179.1	-23.7	36.1	0	0	0	115.5	K352 Y353 Y363 R393 A404	K352-P408 HydrophobicContact CB-CB 4.13Å; K352-P408 HydrophobicContact CB-CG 4.41Å; K352-P408 HydrophobicContact CD-CB 3.67Å; K352-P408 HydrophobicContact CG-CB 3.77Å; K352-P408 HydrophobicContact CG-CG 4.45Å; K352-P408 PolarHBondContact NZ-O 3.25Å; Y353-P408 HydrophobicContact CD2-CG 4.33Å; Y363-P408 HydrophobicContact CD1-CG 4.26Å; Y363-P408 HydrophobicContact CD2-CB 3.97Å; Y363-P408 HydrophobicContact CD2-CG 3.9Å; Y363-P408 HydrophobicContact CE1-CB 4.28Å; Y363-P408 HydrophobicContact CE2-CB 3.68Å; Y363-P408 HydrophobicContact CE2-CG 4.14Å; Y363-P408 HydrophobicContact CG-CB 4.38Å; Y363-P408 HydrophobicContact CG-CG 3.96Å; R393-P408 VanDerWaalsContact CZ-O 3.32Å; R393-P408 PolarHBondContact NE-O 3.14Å; R393-P408 PolarHBondContact NH1-O 3.32Å; R393-P408 VanDerWaalsContact NH1-O 3.1Å; A404-P408 WeakPolarHBondContact O-CD 3.38Å
409	Y	97.6	Very high	97.4	Very high	38 Å²	38	38.5 Å²	38.5	15%	0.149	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-117.5	-0.5	-175.1	-57.7	-79	0	0	0	113.3	K352 E405 E406 M407 K411 H442 R445	K352-Y409 HydrophobicContact CB-CE2 4.34Å; K352-Y409 WeakPolarHBondContact CB-OH 3.37Å; K352-Y409 HydrophobicContact CD-CD1 4.43Å; K352-Y409 HydrophobicContact CD-CE1 3.68Å; K352-Y409 HydrophobicContact CD-CE2 4.22Å; E405-Y409 WeakPolarHBondContact O-CD2 3.36Å; E406-Y409 PolarHBondContact O-N 3.13Å; M407-Y409 PolarHBondContact O-N 3.01Å; Y409-K411 PolarHBondContact O-N 2.91Å; Y409-H442 PolarHBondContact O-CE1 2.96Å; Y409-R445 HydrophobicContact CD1-CB 4.12Å; Y409-R445 HydrophobicContact CE1-CB 3.75Å; Y409-R445 HydrophobicContact CE1-CG 4.07Å
410	L	97.5	Very high	97.5	Very high	24 Å²	24	38.2 Å²	38.2	13%	0.126	20%	0.197	C	C	.	.			trans	-58.4	138.8	175.1	-62	174.5	0	0	0	111	R393 L396 A397 K402 E406 M407 C412	R393-L410 HydrophobicContact CG-CB 4.09Å; R393-L410 PolarHBondContact NE-O 3.31Å; R393-L410 PolarHBondContact NH2-O 3.21Å; L396-L410 HydrophobicContact CB-CD1 4.34Å; L396-L410 HydrophobicContact CD2-CB 4.4Å; L396-L410 HydrophobicContact CD2-CD1 4.34Å; L396-L410 HydrophobicContact CG-CD1 4.37Å; A397-L410 HydrophobicContact CB-CD1 3.84Å; K402-L410 HydrophobicContact CB-CD1 4.21Å; K402-L410 HydrophobicContact CB-CD2 4.49Å; K402-L410 HydrophobicContact CD-CD2 4.38Å; K402-L410 HydrophobicContact CG-CD1 4.12Å; K402-L410 HydrophobicContact CG-CD2 3.96Å; E406-L410 PolarHBondContact O-N 2.73Å; M407-L410 PolarHBondContact O-N 3.23Å; L410-C412 PolarHBondContact O-N 2.87Å
411	K	97.6	Very high	97.4	Very high	129 Å²	129	37.5 Å²	37.5	56%	0.561	19%	0.194	S	C	*	.			trans	-82	116.8	-178.4	-70.7	-176.5	179.5	-176.4	0	109.7	Y409 H442 E444	Y409-K411 PolarHBondContact O-N 2.91Å; K411-H442 WeakPolarHBondContact CE-NE2 3.47Å; K411-E444 WeakPolarHBondContact CE-OE1 3.23Å; K411-E444 IonicContact NZ-OE1 2.93Å; K411-E444 PolarHBondContact NZ-OE1 2.89Å
412	C	97.8	Very high	96.9	Very high	2 Å²	2	35 Å²	35	1%	0.014	18%	0.184	C	C	.	.			trans	-135.7	72.2	-178.8	-57.7	0	0	0	0	108.5	R253 L392 L410	R253-C412 WeakPolarHBondContact CD-O 3.28Å; R253-C412 PolarHBondContact NH1-O 3.29Å; R253-C412 VanDerWaalsContact NH1-O 3.08Å; L392-C412 HydrophobicContact CB-CB 4.48Å; L392-C412 HydrophobicContact CD2-CB 3.72Å; L392-C412 HydrophobicContact CG-CB 4.01Å; L410-C412 PolarHBondContact O-N 2.87Å
413	P	98.3	Very high	96.1	Very high	64 Å²	64	34.4 Å²	34.4	42%	0.416	19%	0.186	S	C	.	.			trans	-63.6	157.6	-174.9	25.6	-32.2	0	0	0	112	T416	P413-T416 HydrophobicContact CG-CG2 4.27Å
414	L	98.6	Very high	95	Very high	5 Å²	5	33 Å²	33	3%	0.026	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	154.2	168.3	-78	171.7	0	0	0	109.9	R253 H254 E256 N260 T416 S438 V439 T441	R253-L414 HydrophobicContact CB-CD2 4.16Å; R253-L414 VanDerWaalsContact CZ-CD2 3.48Å; H254-L414 WeakPolarHBondContact O-CD2 3.37Å; E256-L414 HydrophobicContact CB-CD1 4.15Å; E256-L414 HydrophobicContact CG-CD1 4.25Å; N260-L414 HydrophobicContact CB-CD1 4.38Å; L414-T416 PolarHBondContact O-N 3.37Å; L414-T416 VanDerWaalsContact O-N 3.15Å; L414-T416 PolarHBondContact O-OG1 3.44Å; L414-S438 VanDerWaalsContact CB-OG 3.32Å; L414-S438 WeakPolarHBondContact CB-OG 3.04Å; L414-V439 HydrophobicContact CD1-CG2 4.19Å; L414-T441 HydrophobicContact CD1-CG2 4.35Å
415	H	98.7	Very high	94	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	22.7	173.2	-54.2	173.3	0	0	0	115.8	E256 F278 Y433 L434 V436 E437	E256-H415 PolarHBondContact N-NE2 3.36Å; F278-H415 HydrophobicContact CB-CB 4.42Å; F278-H415 WeakPolarHBondContact CB-CD2 3.27Å; F278-H415 AromaticContact CD1-CD2 3.78Å; F278-H415 VanDerWaalsContact CD2-CA 3.41Å; F278-H415 HydrophobicContact CD2-CB 3.56Å; F278-H415 AromaticContact CD2-CD2 3.75Å; F278-H415 AromaticContact CD2-CG 3.75Å; F278-H415 HydrophobicContact CE2-CB 4.05Å; F278-H415 HydrophobicContact CG-CB 4.09Å; F278-H415 AromaticContact CG-CD2 3.32Å; F278-H415 WeakPolarHBondContact CG-CD2 3.41Å; F278-H415 AromaticContact CG-CG 3.74Å; F278-H415 AromaticContact CG-NE2 3.95Å; H415-Y433 HydrophobicContact CB-CD2 4.47Å; H415-Y433 HydrophobicContact CB-CE2 4.16Å; H415-Y433 WeakPolarHBondContact O-CD2 3.26Å; H415-L434 PolarHBondContact O-N 3.06Å; H415-V436 PolarHBondContact ND1-O 3.16Å; H415-E437 PolarHBondContact CE1-O 3.17Å; H415-E437 PolarHBondContact ND1-O 3.4Å; H415-E437 VanDerWaalsContact ND1-O 3.15Å
416	T	98.9	Very high	93.6	Very high	8 Å²	8	33 Å²	33	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.3	178.4	-57.5	0	0	0	0	110	P413 L414 L418 S431 I432	P413-T416 HydrophobicContact CG-CG2 4.27Å; L414-T416 PolarHBondContact O-N 3.37Å; L414-T416 VanDerWaalsContact O-N 3.15Å; L414-T416 PolarHBondContact O-OG1 3.44Å; T416-L418 HydrophobicContact CG2-CD2 4.36Å; T416-S431 WeakPolarHBondContact CG2-OG 3.31Å; T416-I432 CarbonylContact C-O 3.54Å; T416-I432 WeakPolarHBondContact CA-O 3.03Å
417	V	98.9	Very high	93.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.5	172	-179	0	0	0	0	108.9	Y250 C252 L282 F285 I432 L434	Y250-V417 HydrophobicContact CD1-CG1 3.73Å; Y250-V417 HydrophobicContact CG-CG1 4.44Å; C252-V417 HydrophobicContact CB-CG2 4.29Å; L282-V417 HydrophobicContact CD1-CG2 3.57Å; F285-V417 HydrophobicContact CD1-CG2 4.26Å; F285-V417 HydrophobicContact CE1-CB 4.32Å; F285-V417 HydrophobicContact CE1-CG1 3.88Å; F285-V417 HydrophobicContact CE1-CG2 4.19Å; F285-V417 HydrophobicContact CZ-CB 4.49Å; F285-V417 HydrophobicContact CZ-CG1 4.17Å; V417-I432 HydrophobicContact CB-CB 4.5Å; V417-I432 PolarHBondContact N-O 3.25Å; V417-I432 PolarHBondContact O-N 3.1Å; V417-L434 HydrophobicContact CG2-CD1 4.03Å; V417-L434 HydrophobicContact CG2-CD2 4.4Å; V417-L434 HydrophobicContact CG2-CG 4.27Å
418	L	98.8	Very high	93.1	Very high	11 Å²	11	36.1 Å²	36.1	6%	0.058	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	106.4	169.6	-57.1	-178.4	0	0	0	108.1	L251 L392 L396 T416 V429 E430	L251-L418 HydrophobicContact CB-CB 4.43Å; L251-L418 PolarHBondContact N-O 3.27Å; L251-L418 PolarHBondContact O-N 3.38Å; L392-L418 HydrophobicContact CD2-CD1 4.47Å; L396-L418 HydrophobicContact CD1-CD1 4.14Å; L396-L418 HydrophobicContact CD2-CD1 3.86Å; T416-L418 HydrophobicContact CG2-CD2 4.36Å; L418-V429 HydrophobicContact CB-CG2 4.45Å; L418-E430 WeakPolarHBondContact CA-O 3.47Å
419	K	98.4	Very high	93.1	Very high	40 Å²	40	39.2 Å²	39.2	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.7	176	178.8	-179.5	-176.8	170.8	0	109	T248 Y250 V429 E430 I432	T248-K419 HydrophobicContact CG2-CD 4.23Å; T248-K419 HydrophobicContact CG2-CG 3.56Å; Y250-K419 HydrophobicContact CD1-CB 4.09Å; Y250-K419 HydrophobicContact CD1-CG 4.16Å; Y250-K419 HydrophobicContact CE1-CB 4.06Å; Y250-K419 HydrophobicContact CE1-CD 3.88Å; Y250-K419 HydrophobicContact CE1-CG 3.73Å; K419-V429 WeakPolarHBondContact O-CA 3.3Å; K419-E430 HydrophobicContact CB-CB 4.24Å; K419-E430 PolarHBondContact N-O 3.05Å; K419-E430 PolarHBondContact O-N 2.96Å; K419-I432 HydrophobicContact CB-CD1 3.69Å
420	L	97.6	Very high	93.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.6	-179.4	-64	-175.1	0	0	0	109.8	T248 I249 L251 L396 F399 C427 R428 V429	T248-L420 WeakPolarHBondContact CA-O 3.41Å; I249-L420 HydrophobicContact CB-CB 4.14Å; I249-L420 PolarHBondContact N-O 2.85Å; I249-L420 WeakPolarHBondContact O-CA 3.36Å; I249-L420 WeakPolarHBondContact O-CB 3.43Å; I249-L420 PolarHBondContact O-N 3.32Å; L251-L420 HydrophobicContact CD1-CD1 3.56Å; L251-L420 HydrophobicContact CD1-CG 4.47Å; L251-L420 HydrophobicContact CG-CD1 4.06Å; L396-L420 HydrophobicContact CD1-CD2 4.14Å; F399-L420 HydrophobicContact CB-CD1 3.83Å; F399-L420 HydrophobicContact CD2-CD1 3.57Å; F399-L420 HydrophobicContact CE2-CD1 4.29Å; F399-L420 HydrophobicContact CG-CD1 3.71Å; L420-C427 VanDerWaalsContact CB-SG 3.56Å; L420-R428 WeakPolarHBondContact CA-O 3.4Å; L420-V429 HydrophobicContact CD2-CB 3.79Å; L420-V429 HydrophobicContact CD2-CG2 3.76Å
421	T	93.8	Very high	93.1	Very high	32 Å²	32	43.5 Å²	43.5	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	110.2	173.7	-55.2	0	0	0	0	108.6	V423 R428	T421-V423 PolarHBondContact O-N 3.24Å; T421-R428 PolarHBondContact N-O 3.32Å; T421-R428 PolarHBondContact O-N 3.32Å
422	P	85.6	Confident	93.2	Very high	49 Å²	49	39.7 Å²	39.7	32%	0.318	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	132.4	173.4	-22.9	34.2	0	0	0	110.2	R247	R247-P422 HydrophobicContact CG-CG 4.27Å; R247-P422 WeakPolarHBondContact O-CD 3.43Å
423	V	81.7	Confident	93.2	Very high	65 Å²	65	44.8 Å²	44.8	39%	0.394	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	144.4	175.8	-68.1	0	0	0	0	107.8	T421 Y425 G426 R428	T421-V423 PolarHBondContact O-N 3.24Å; V423-Y425 PolarHBondContact O-N 3.31Å; V423-G426 PolarHBondContact N-O 2.93Å; V423-G426 VanDerWaalsContact N-O 3.11Å; V423-G426 CarbonylContact O-C 3.58Å; V423-G426 PolarHBondContact O-N 3.03Å; V423-R428 HydrophobicContact CG1-CB 4.45Å
424	A	72.6	Confident	93.2	Very high	23 Å²	23	42.8 Å²	42.8	19%	0.19	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	25	-81.6	164.6	0	0	0	0	0	117.5	Y50 E167 V168	Y50-A424 VanDerWaalsContact CD2-O 3.31Å; Y50-A424 WeakPolarHBondContact CD2-O 3.47Å; E167-A424 PolarHBondContact OE1-N 3.37Å; V168-A424 HydrophobicContact CG1-CB 3.3Å
425	Y	76.1	Confident	93.2	Very high	86 Å²	86	49.3 Å²	49.3	34%	0.337	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	13.9	-175	-57	-56.9	0	0	0	114.5	T49 K53 V168 K169 V423	T49-Y425 HydrophobicContact CG2-CD1 4.15Å; T49-Y425 HydrophobicContact CG2-CE1 3.55Å; K53-Y425 HydrophobicContact CD-CD1 3.76Å; K53-Y425 HydrophobicContact CD-CG 3.92Å; V168-Y425 HydrophobicContact CB-CE2 4.07Å; V168-Y425 WeakPolarHBondContact CB-OH 3.5Å; V168-Y425 HydrophobicContact CG1-CE2 4.34Å; K169-Y425 PolarHBondContact NZ-OH 3.13Å; K169-Y425 VanDerWaalsContact NZ-OH 3.12Å; V423-Y425 PolarHBondContact O-N 3.31Å
426	G	84.6	Confident	93.2	Very high	27 Å²	27	50.1 Å²	50.1	28%	0.278	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	-147.1	-174.5	0	0	0	0	0	112.9	V423	V423-G426 PolarHBondContact N-O 2.93Å; V423-G426 VanDerWaalsContact N-O 3.11Å; V423-G426 CarbonylContact O-C 3.58Å; V423-G426 PolarHBondContact O-N 3.03Å
427	C	90.8	Very high	93.1	Very high	22 Å²	22	56.3 Å²	56.3	15%	0.149	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	130.1	179.4	-164.5	0	0	0	0	109.5	F399 L400 L420	F399-C427 HydrophobicContact CB-CB 4.41Å; F399-C427 WeakPolarHBondContact O-CB 3.34Å; L400-C427 HydrophobicContact CD2-CB 4.42Å; L420-C427 VanDerWaalsContact CB-SG 3.56Å
428	R	93.8	Very high	93.1	Very high	133 Å²	133	58.1 Å²	58.1	50%	0.502	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	138	166.5	-171.4	175.1	77.4	-160.3	4.8	108.3	L420 T421 V423 E430	L420-R428 WeakPolarHBondContact CA-O 3.4Å; T421-R428 PolarHBondContact N-O 3.32Å; T421-R428 PolarHBondContact O-N 3.32Å; V423-R428 HydrophobicContact CG1-CB 4.45Å; R428-E430 IonicContact CZ-OE1 2.91Å; R428-E430 IonicContact NE-OE1 3.75Å; R428-E430 PolarHBondContact NE-OE1 3.09Å; R428-E430 IonicContact NH2-OE1 2.73Å; R428-E430 PolarHBondContact NH2-OE1 2.92Å
429	V	96.8	Very high	93	Very high	65 Å²	65	59.7 Å²	59.7	39%	0.394	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.2	174	60.5	0	0	0	0	109.8	L400 L418 K419 L420	L400-V429 HydrophobicContact CD1-CG1 4.37Å; L400-V429 HydrophobicContact CD2-CB 4.29Å; L400-V429 HydrophobicContact CD2-CG1 4.26Å; L418-V429 HydrophobicContact CB-CG2 4.45Å; K419-V429 WeakPolarHBondContact O-CA 3.3Å; L420-V429 HydrophobicContact CD2-CB 3.79Å; L420-V429 HydrophobicContact CD2-CG2 3.76Å
430	E	98.1	Very high	92.9	Very high	68 Å²	68	62.9 Å²	62.9	32%	0.318	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.7	172.5	-66.7	166.6	-112.4	0	0	108.2	L418 K419 R428 I432	L418-E430 WeakPolarHBondContact CA-O 3.47Å; K419-E430 HydrophobicContact CB-CB 4.24Å; K419-E430 PolarHBondContact N-O 3.05Å; K419-E430 PolarHBondContact O-N 2.96Å; R428-E430 IonicContact CZ-OE1 2.91Å; R428-E430 IonicContact NE-OE1 3.75Å; R428-E430 PolarHBondContact NE-OE1 3.09Å; R428-E430 IonicContact NH2-OE1 2.73Å; R428-E430 PolarHBondContact NH2-OE1 2.92Å; E430-I432 HydrophobicContact CB-CD1 4.31Å
431	S	98.3	Very high	92.8	Very high	84 Å²	84	64.4 Å²	64.4	59%	0.587	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.2	-178.6	174.9	0	0	0	0	109.5	T416	T416-S431 WeakPolarHBondContact CG2-OG 3.31Å
432	I	98.7	Very high	92.9	Very high	48 Å²	48	64.9 Å²	64.9	25%	0.246	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	105.6	-178.3	-51.6	97.5	0	0	0	109.3	F285 T416 V417 K419 E430 L434	F285-I432 HydrophobicContact CD2-CG2 4.35Å; F285-I432 HydrophobicContact CE2-CB 4.34Å; F285-I432 HydrophobicContact CE2-CG1 4.37Å; F285-I432 HydrophobicContact CE2-CG2 3.98Å; F285-I432 HydrophobicContact CZ-CD1 4.34Å; T416-I432 CarbonylContact C-O 3.54Å; T416-I432 WeakPolarHBondContact CA-O 3.03Å; V417-I432 HydrophobicContact CB-CB 4.5Å; V417-I432 PolarHBondContact N-O 3.25Å; V417-I432 PolarHBondContact O-N 3.1Å; K419-I432 HydrophobicContact CB-CD1 3.69Å; E430-I432 HydrophobicContact CB-CD1 4.31Å; I432-L434 HydrophobicContact CG2-CD2 3.95Å
433	Y	98.7	Very high	93.2	Very high	110 Å²	110	66.8 Å²	66.8	43%	0.431	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	126.6	173.2	172.7	-120.5	0	0	0	110.2	H415 N435 V436 E437	H415-Y433 HydrophobicContact CB-CD2 4.47Å; H415-Y433 HydrophobicContact CB-CE2 4.16Å; H415-Y433 WeakPolarHBondContact O-CD2 3.26Å; Y433-N435 PolarHBondContact O-N 3.06Å; Y433-V436 WeakPolarHBondContact CE2-O 3.33Å; Y433-V436 PolarHBondContact OH-N 3.29Å; Y433-V436 PolarHBondContact OH-O 3.12Å; Y433-E437 PolarHBondContact OH-N 3.42Å
434	L	98.3	Very high	93.6	Very high	22 Å²	22	68.8 Å²	68.8	12%	0.115	36%	0.36	C	S	.	.			trans	-87.9	22.9	-172.8	-56.3	-168.5	0	0	0	114.1	F278 A281 L282 F285 H415 V417 I432 V436	F278-L434 HydrophobicContact CD2-CB 4.28Å; F278-L434 HydrophobicContact CD2-CD1 4.07Å; F278-L434 HydrophobicContact CE2-CB 4.36Å; F278-L434 HydrophobicContact CE2-CD1 3.6Å; F278-L434 HydrophobicContact CE2-CG 4.11Å; A281-L434 HydrophobicContact CB-CB 4.07Å; A281-L434 HydrophobicContact CB-CD1 4.4Å; L282-L434 HydrophobicContact CB-CD1 3.95Å; L282-L434 HydrophobicContact CD1-CD1 3.9Å; F285-L434 HydrophobicContact CB-CD1 4.18Å; F285-L434 HydrophobicContact CB-CD2 4.01Å; F285-L434 HydrophobicContact CD2-CD2 3.94Å; F285-L434 HydrophobicContact CG-CD2 4Å; H415-L434 PolarHBondContact O-N 3.06Å; V417-L434 HydrophobicContact CG2-CD1 4.03Å; V417-L434 HydrophobicContact CG2-CD2 4.4Å; V417-L434 HydrophobicContact CG2-CG 4.27Å; I432-L434 HydrophobicContact CG2-CD2 3.95Å; L434-V436 VanDerWaalsContact C-N 3.29Å; L434-V436 PolarHBondContact O-N 2.94Å
435	N	98	Very high	94.3	Very high	141 Å²	141	70 Å²	70	75%	0.754	36%	0.36	S	S	*	.	S	Bend	trans	55.3	38	173.9	-159	37.4	0	0	0	115	Y433	Y433-N435 PolarHBondContact O-N 3.06Å
436	V	98.3	Very high	94.4	Very high	19 Å²	19	67.4 Å²	67.4	12%	0.115	36%	0.355	C	S	.	.			trans	-123.5	119.5	172	-177.9	0	0	0	0	108.3	R274 K277 F278 A281 H415 Y433 L434	R274-V436 HydrophobicContact CB-CG1 4.32Å; R274-V436 WeakPolarHBondContact O-CG1 3.31Å; K277-V436 HydrophobicContact CB-CG1 3.87Å; K277-V436 HydrophobicContact CB-CG2 4.29Å; F278-V436 HydrophobicContact CB-CB 4.38Å; F278-V436 HydrophobicContact CB-CG1 4.36Å; A281-V436 HydrophobicContact CB-CG2 4.17Å; H415-V436 PolarHBondContact ND1-O 3.16Å; Y433-V436 WeakPolarHBondContact CE2-O 3.33Å; Y433-V436 PolarHBondContact OH-N 3.29Å; Y433-V436 PolarHBondContact OH-O 3.12Å; L434-V436 VanDerWaalsContact C-N 3.29Å; L434-V436 PolarHBondContact O-N 2.94Å
437	E	98	Very high	93.5	Very high	138 Å²	138	71.1 Å²	71.1	65%	0.645	37%	0.368	S	S	*	.			trans	-58.4	152.3	180	-64.7	-174.8	162.9	0	0	112.6	R274 H415 Y433	R274-E437 WeakPolarHBondContact CD-O 3.42Å; H415-E437 PolarHBondContact CE1-O 3.17Å; H415-E437 PolarHBondContact ND1-O 3.4Å; H415-E437 VanDerWaalsContact ND1-O 3.15Å; Y433-E437 PolarHBondContact OH-N 3.42Å
438	S	97.8	Very high	91.9	Very high	38 Å²	38	73.4 Å²	73.4	27%	0.266	39%	0.388	S	S	.	.			trans	-155.4	164.4	173.3	52.6	0	0	0	0	110.7	E256 L414	E256-S438 WeakPolarHBondContact OE1-CA 3.26Å; L414-S438 VanDerWaalsContact CB-OG 3.32Å; L414-S438 WeakPolarHBondContact CB-OG 3.04Å
439	V	97.3	Very high	90.3	Very high	44 Å²	44	67.8 Å²	67.8	27%	0.267	37%	0.369	S	S	.	.			trans	-66	153.9	165.8	-61.6	0	0	0	0	111.6	E256 N260 L261 L414 T441	E256-V439 HydrophobicContact CG-CG2 4.5Å; E256-V439 PolarHBondContact OE1-N 2.86Å; N260-V439 HydrophobicContact CB-CG2 3.78Å; L261-V439 HydrophobicContact CD2-CG1 4.09Å; L414-V439 HydrophobicContact CD1-CG2 4.19Å; V439-T441 HydrophobicContact CG2-CG2 4.2Å
440	S	96.8	Very high	88.5	Confident	107 Å²	107	69.2 Å²	69.2	75%	0.748	37%	0.37	S	S	*	.			trans	-90.2	122	169.1	-177.9	0	0	0	0	110.4
441	T	94.8	Very high	86.4	Confident	31 Å²	31	71.5 Å²	71.5	19%	0.19	38%	0.383	C	S	.	.			trans	-102.9	4.9	175.3	61.8	0	0	0	0	112.9	R253 N260 Q389 L414 V439	R253-T441 PolarHBondContact NH1-OG1 3.35Å; R253-T441 PolarHBondContact NH2-OG1 3.24Å; N260-T441 HydrophobicContact CB-CG2 4.42Å; Q389-T441 PolarHBondContact NE2-O 3.24Å; Q389-T441 PolarHBondContact OE1-O 2.92Å; Q389-T441 PolarHBondContact OE1-OG1 3.13Å; L414-T441 HydrophobicContact CD1-CG2 4.35Å; V439-T441 HydrophobicContact CG2-CG2 4.2Å
442	H	95.3	Very high	84.2	Confident	42 Å²	42	72.2 Å²	72.2	19%	0.194	38%	0.377	C	S	.	.			trans	-80.5	135.7	-179.3	179.8	66	0	0	0	110.6	R393 Y409 K411 E444	R393-H442 PolarHBondContact NH2-ND1 2.94Å; Y409-H442 PolarHBondContact O-CE1 2.96Å; K411-H442 WeakPolarHBondContact CE-NE2 3.47Å; H442-E444 IonicContact CD2-OE1 3.14Å; H442-E444 IonicContact NE2-OE1 3.62Å; H442-E444 PolarHBondContact NE2-OE1 3.39Å; H442-E444 IonicContact NE2-OE2 3.08Å
443	R	91.6	Very high	82	Confident	90 Å²	90	72.6 Å²	72.6	34%	0.34	38%	0.378	S	S	.	.			trans	-127	117.1	175.8	-55.9	-173	76.7	-156.9	-0.7	108.2	Y334 Y345	Y334-R443 VanDerWaalsContact CB-NH1 3.3Å; Y345-R443 PolarHBondContact OH-NH1 2.85Å; Y345-R443 PolarHBondContact OH-NH2 2.87Å
444	E	91.4	Very high	79.5	Confident	107 Å²	107	74.8 Å²	74.8	50%	0.5	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-67.6	162.5	176.8	-67.1	-74.1	-175.2	0	0	110.6	K411 H442	K411-E444 WeakPolarHBondContact CE-OE1 3.23Å; K411-E444 IonicContact NZ-OE1 2.93Å; K411-E444 PolarHBondContact NZ-OE1 2.89Å; H442-E444 IonicContact CD2-OE1 3.14Å; H442-E444 IonicContact NE2-OE1 3.62Å; H442-E444 PolarHBondContact NE2-OE1 3.39Å; H442-E444 IonicContact NE2-OE2 3.08Å
445	R	86.1	Confident	76.8	Confident	47 Å²	47	77.6 Å²	77.6	18%	0.177	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-67.4	133.3	169.3	-161.9	174.4	-169.5	175.8	3.8	108.6	E405 Y409 V449 K450	E405-R445 IonicContact OE1-CZ 3.36Å; E405-R445 IonicContact OE1-NH1 3.98Å; E405-R445 PolarHBondContact OE1-NH1 3.17Å; E405-R445 IonicContact OE1-NH2 2.72Å; E405-R445 PolarHBondContact OE1-NH2 3.36Å; Y409-R445 HydrophobicContact CD1-CB 4.12Å; Y409-R445 HydrophobicContact CE1-CB 3.75Å; Y409-R445 HydrophobicContact CE1-CG 4.07Å; R445-V449 HydrophobicContact CG-CB 4.15Å; R445-V449 HydrophobicContact CG-CG1 4.27Å; R445-K450 WeakPolarHBondContact O-CE 3.46Å; R445-K450 PolarHBondContact O-NZ 3.35Å
446	S	78.8	Confident	74.2	Confident	33 Å²	33	75.1 Å²	75.1	23%	0.231	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-67.4	150.8	176.7	54.3	0	0	0	0	111.8	E349 A448 V449 K450	E349-S446 WeakPolarHBondContact OE1-CB 3.08Å; E349-S446 PolarHBondContact OE1-OG 3.2Å; S446-A448 PolarHBondContact O-N 3.5Å; S446-V449 PolarHBondContact O-N 2.96Å; S446-V449 VanDerWaalsContact O-N 3.11Å; S446-K450 PolarHBondContact O-N 2.99Å; S446-K450 VanDerWaalsContact O-N 3.15Å
447	D	65.4	Low	71.6	Confident	105 Å²	105	78.5 Å²	78.5	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-63.7	-31	-175.5	-62	-35.7	0	0	0	112.6	V449 K450 I451	D447-V449 VanDerWaalsContact C-N 3.27Å; D447-V449 PolarHBondContact O-N 3.39Å; D447-K450 PolarHBondContact O-N 3.34Å; D447-K450 IonicContact OD1-NZ 3.97Å; D447-K450 PolarHBondContact OD1-NZ 2.99Å; D447-I451 WeakPolarHBondContact O-CG1 3.38Å; D447-I451 PolarHBondContact O-N 3.49Å; D447-I451 VanDerWaalsContact O-N 3.13Å
448	A	57	Low	68.6	Low	69 Å²	69	75.6 Å²	75.6	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-59.4	-36.5	174.8	0	0	0	0	0	112.8	S446	S446-A448 PolarHBondContact O-N 3.5Å
449	V	60	Low	65.8	Low	15 Å²	15	83.8 Å²	83.8	9%	0.091	45%	0.447	C	S	.	.	H	α-helix	trans	-82.5	-31.6	177.6	-172.6	0	0	0	0	111.2	E349 R445 S446 D447 I451 Q452 H453	E349-V449 HydrophobicContact CG-CG2 4.13Å; R445-V449 HydrophobicContact CG-CB 4.15Å; R445-V449 HydrophobicContact CG-CG1 4.27Å; S446-V449 PolarHBondContact O-N 2.96Å; S446-V449 VanDerWaalsContact O-N 3.11Å; D447-V449 VanDerWaalsContact C-N 3.27Å; D447-V449 PolarHBondContact O-N 3.39Å; V449-I451 VanDerWaalsContact C-N 3.31Å; V449-I451 PolarHBondContact O-N 3.17Å; V449-Q452 PolarHBondContact O-N 2.72Å; V449-H453 WeakPolarHBondContact O-CB 3.28Å; V449-H453 PolarHBondContact O-N 2.8Å
450	K	59.8	Low	62.8	Low	96 Å²	96	86.9 Å²	86.9	42%	0.417	47%	0.468	S	S	.	.	H	α-helix	trans	-59.4	-40.4	173.8	-67.6	179	-169.1	152.8	0	112.2	R445 S446 D447 H453 F454	R445-K450 WeakPolarHBondContact O-CE 3.46Å; R445-K450 PolarHBondContact O-NZ 3.35Å; S446-K450 PolarHBondContact O-N 2.99Å; S446-K450 VanDerWaalsContact O-N 3.15Å; D447-K450 PolarHBondContact O-N 3.34Å; D447-K450 IonicContact OD1-NZ 3.97Å; D447-K450 PolarHBondContact OD1-NZ 2.99Å; K450-H453 PolarHBondContact O-N 3.31Å; K450-F454 PolarHBondContact O-N 2.61Å
451	I	53.2	Low	59.9	Low	115 Å²	115	87.1 Å²	87.1	59%	0.59	47%	0.469	S	S	*	.	H	α-helix	trans	-67.2	-42.3	179.9	-65.1	165.8	0	0	0	111.5	D447 V449 H453 F454 A455	D447-I451 WeakPolarHBondContact O-CG1 3.38Å; D447-I451 PolarHBondContact O-N 3.49Å; D447-I451 VanDerWaalsContact O-N 3.13Å; V449-I451 VanDerWaalsContact C-N 3.31Å; V449-I451 PolarHBondContact O-N 3.17Å; I451-H453 VanDerWaalsContact C-N 3.32Å; I451-H453 PolarHBondContact O-N 3.14Å; I451-F454 PolarHBondContact O-N 3.38Å; I451-A455 PolarHBondContact O-N 3.28Å
452	Q	52.4	Low	57.3	Low	100 Å²	100	90.1 Å²	90.1	47%	0.467	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-38.1	175.3	-70.5	-179.4	-4.4	0	0	112.1	V449 A455 S456	V449-Q452 PolarHBondContact O-N 2.72Å; Q452-A455 PolarHBondContact O-N 3.44Å; Q452-S456 PolarHBondContact O-N 2.92Å
453	H	52.8	Low	54.8	Low	56 Å²	56	93 Å²	93	26%	0.259	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-48.3	175.9	179.6	68.1	0	0	0	111.9	E405 V449 K450 I451 A455 S456 V457	E405-H453 IonicContact OE1-CE1 3.38Å; E405-H453 PolarHBondContact OE1-CE1 3.42Å; E405-H453 IonicContact OE1-CG 2.76Å; E405-H453 IonicContact OE1-ND1 3.7Å; E405-H453 PolarHBondContact OE1-ND1 2.94Å; E405-H453 IonicContact OE1-NE2 3.16Å; E405-H453 IonicContact OE2-CE1 2.82Å; E405-H453 PolarHBondContact OE2-CE1 3.43Å; E405-H453 IonicContact OE2-ND1 3.06Å; V449-H453 WeakPolarHBondContact O-CB 3.28Å; V449-H453 PolarHBondContact O-N 2.8Å; K450-H453 PolarHBondContact O-N 3.31Å; I451-H453 VanDerWaalsContact C-N 3.32Å; I451-H453 PolarHBondContact O-N 3.14Å; H453-A455 PolarHBondContact O-N 3.05Å; H453-S456 PolarHBondContact O-N 2.98Å; H453-S456 PolarHBondContact O-OG 3.26Å; H453-V457 VanDerWaalsContact CE1-CG2 3.4Å; H453-V457 WeakPolarHBondContact CE1-CG2 3.23Å; H453-V457 WeakPolarHBondContact O-CG2 3.38Å; H453-V457 PolarHBondContact O-N 2.72Å; H453-V457 VanDerWaalsContact O-N 3.13Å
454	F	47.3	Very low	52.7	Low	156 Å²	156	93 Å²	93	68%	0.684	51%	0.512	S	S	*	.	H	α-helix	trans	-57	-39.3	178.1	-151.7	-90.2	0	0	0	111.9	K450 I451 S456 V458	K450-F454 PolarHBondContact O-N 2.61Å; I451-F454 PolarHBondContact O-N 3.38Å; F454-S456 VanDerWaalsContact C-N 3.3Å; F454-S456 PolarHBondContact O-N 3.42Å; F454-V458 HydrophobicContact CD1-CG2 4.22Å; F454-V458 HydrophobicContact CE1-CG2 4.15Å; F454-V458 WeakPolarHBondContact O-CG2 3.26Å
455	A	40.4	Very low	50	Low	81 Å²	81	96.6 Å²	96.6	67%	0.669	53%	0.529	S	S	*	.	H	α-helix	trans	-67.7	-25.1	176.2	0	0	0	0	0	114.2	I451 Q452 H453	I451-A455 PolarHBondContact O-N 3.28Å; Q452-A455 PolarHBondContact O-N 3.44Å; H453-A455 PolarHBondContact O-N 3.05Å
456	S	43.4	Very low	47.9	Very low	88 Å²	88	100.9 Å²	100.9	62%	0.615	55%	0.554	S	S	*	*	H	α-helix	trans	-88.6	-24.1	-179.2	70.1	0	0	0	0	114.4	Q452 H453 F454	Q452-S456 PolarHBondContact O-N 2.92Å; H453-S456 PolarHBondContact O-N 2.98Å; H453-S456 PolarHBondContact O-OG 3.26Å; F454-S456 VanDerWaalsContact C-N 3.3Å; F454-S456 PolarHBondContact O-N 3.42Å
457	V	44.3	Very low	46.2	Very low	91 Å²	91	102.5 Å²	102.5	55%	0.552	56%	0.56	S	S	*	*	H	α-helix	trans	-89.4	-24.7	-175.5	176.4	0	0	0	0	112.4	H453 R459	H453-V457 VanDerWaalsContact CE1-CG2 3.4Å; H453-V457 WeakPolarHBondContact CE1-CG2 3.23Å; H453-V457 WeakPolarHBondContact O-CG2 3.38Å; H453-V457 PolarHBondContact O-N 2.72Å; H453-V457 VanDerWaalsContact O-N 3.13Å; V457-R459 PolarHBondContact O-N 2.95Å
458	V	34.3	Very low	44.9	Very low	76 Å²	76	103.2 Å²	103.2	46%	0.461	56%	0.558	S	S	.	*			trans	-78.6	105.7	-179.1	179.4	0	0	0	0	110.9	F454	F454-V458 HydrophobicContact CD1-CG2 4.22Å; F454-V458 HydrophobicContact CE1-CG2 4.15Å; F454-V458 WeakPolarHBondContact O-CG2 3.26Å
459	R	38.8	Very low	44	Very low	211 Å²	211	105.7 Å²	105.7	80%	0.796	56%	0.562	S	S	*	*			trans	-88.8	143.3	168.2	-71.8	-173.8	-178.4	-175.9	2	111.1	V457 S461	V457-R459 PolarHBondContact O-N 2.95Å; R459-S461 PolarHBondContact O-N 2.73Å
460	P	35.1	Very low	43.2	Very low	109 Å²	109	108.8 Å²	108.8	71%	0.708	58%	0.584	S	S	*	*	S	Bend	trans	-81	80.1	-177.8	33	-33.3	0	0	0	110.8	Y463	P460-Y463 HydrophobicContact CB-CE2 4.3Å
461	S	35.1	Very low	42.3	Very low	111 Å²	111	106 Å²	106	78%	0.776	58%	0.575	S	S	*	*	S	Bend	trans	-147.3	8.8	170	66.4	0	0	0	0	115.8	R459	R459-S461 PolarHBondContact O-N 2.73Å
462	S	41.8	Very low	41.5	Very low	95 Å²	95	106.2 Å²	106.2	66%	0.664	57%	0.573	S	S	*	*			trans	-147	100.1	172	56.9	0	0	0	0	109
463	Y	42.5	Very low	40.7	Very low	101 Å²	101	104.6 Å²	104.6	40%	0.396	57%	0.573	S	S	.	*			trans	-120.4	130.6	171.8	-75.3	-64.5	0	0	0	109.7	P460 D467 F468 V471	P460-Y463 HydrophobicContact CB-CE2 4.3Å; Y463-D467 HydrophobicContact CD1-CB 3.68Å; Y463-D467 HydrophobicContact CE1-CB 4.3Å; Y463-F468 HydrophobicContact CD1-CD2 4.34Å; Y463-F468 HydrophobicContact CD1-CE2 4.49Å; Y463-F468 HydrophobicContact CD2-CE2 4.25Å; Y463-F468 HydrophobicContact CG-CD2 4.27Å; Y463-F468 HydrophobicContact CG-CE2 4.07Å; Y463-V471 HydrophobicContact CE1-CG2 4.02Å
464	T	46.2	Very low	40	Very low	92 Å²	92	104.7 Å²	104.7	56%	0.564	58%	0.584	S	S	*	*			trans	-100.9	160.2	152.9	59.5	0	0	0	0	109.4	L466 D467	T464-L466 PolarHBondContact O-N 3.47Å; T464-L466 VanDerWaalsContact O-N 3.09Å; T464-D467 PolarHBondContact N-OD2 2.92Å; T464-D467 VanDerWaalsContact O-CB 3.31Å; T464-D467 WeakPolarHBondContact O-CB 3.46Å; T464-D467 PolarHBondContact O-N 3.32Å; T464-D467 PolarHBondContact OG1-OD2 3.32Å
465	E	35.9	Very low	39.5	Very low	182 Å²	182	103.7 Å²	103.7	85%	0.85	58%	0.579	S	S	*	*	H	α-helix	trans	-57	-25.7	-174.8	-115.4	171.4	170.9	0	0	114.3
466	L	41.4	Very low	39.3	Very low	136 Å²	136	106.8 Å²	106.8	71%	0.712	58%	0.58	S	S	*	*	H	α-helix	trans	-74	-24	175.3	-78.9	158.2	0	0	0	113.4	T464 F468	T464-L466 PolarHBondContact O-N 3.47Å; T464-L466 VanDerWaalsContact O-N 3.09Å; L466-F468 VanDerWaalsContact C-N 3.35Å
467	D	44.1	Very low	39	Very low	67 Å²	67	107.6 Å²	107.6	36%	0.358	58%	0.577	S	S	.	*	H	α-helix	trans	-76.1	-24.9	177.7	-62.1	-49.3	0	0	0	111.8	Y463 T464 V471	Y463-D467 HydrophobicContact CD1-CB 3.68Å; Y463-D467 HydrophobicContact CE1-CB 4.3Å; T464-D467 PolarHBondContact N-OD2 2.92Å; T464-D467 VanDerWaalsContact O-CB 3.31Å; T464-D467 WeakPolarHBondContact O-CB 3.46Å; T464-D467 PolarHBondContact O-N 3.32Å; T464-D467 PolarHBondContact OG1-OD2 3.32Å; D467-V471 WeakPolarHBondContact O-CB 3.38Å; D467-V471 WeakPolarHBondContact O-CG2 3.32Å; D467-V471 PolarHBondContact O-N 3.07Å; D467-V471 VanDerWaalsContact O-N 3.07Å
468	F	38.2	Very low	38.7	Very low	120 Å²	120	106.1 Å²	106.1	53%	0.526	57%	0.574	S	S	.	*	H	α-helix	trans	-68	-41.4	-179.6	-110.2	-94.6	0	0	0	112.6	Y463 L466 V471 E472	Y463-F468 HydrophobicContact CD1-CD2 4.34Å; Y463-F468 HydrophobicContact CD1-CE2 4.49Å; Y463-F468 HydrophobicContact CD2-CE2 4.25Å; Y463-F468 HydrophobicContact CG-CD2 4.27Å; Y463-F468 HydrophobicContact CG-CE2 4.07Å; L466-F468 VanDerWaalsContact C-N 3.35Å; F468-V471 PolarHBondContact O-N 3.37Å; F468-E472 PolarHBondContact O-N 3Å
469	L	37.3	Very low	38.8	Very low	122 Å²	122	110.1 Å²	110.1	64%	0.639	59%	0.585	S	S	*	*	H	α-helix	trans	-68.8	-36	178.8	-75	161.4	0	0	0	112.3	S473	L469-S473 PolarHBondContact O-N 3.45Å
470	S	42.6	Very low	39	Very low	79 Å²	79	108.4 Å²	108.4	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-71.7	-34.4	176.4	-60.3	0	0	0	0	112.1	A474	S470-A474 WeakPolarHBondContact O-CB 3.31Å; S470-A474 PolarHBondContact O-N 3.38Å
471	V	41.5	Very low	39.2	Very low	37 Å²	37	104.9 Å²	104.9	22%	0.224	57%	0.567	C	S	.	*	H	α-helix	trans	-73.9	-34.1	176.9	170	0	0	0	0	112.4	Y463 D467 F468 K475	Y463-V471 HydrophobicContact CE1-CG2 4.02Å; D467-V471 WeakPolarHBondContact O-CB 3.38Å; D467-V471 WeakPolarHBondContact O-CG2 3.32Å; D467-V471 PolarHBondContact O-N 3.07Å; D467-V471 VanDerWaalsContact O-N 3.07Å; F468-V471 PolarHBondContact O-N 3.37Å; V471-K475 HydrophobicContact CG1-CD 4.02Å; V471-K475 HydrophobicContact CG1-CG 4.41Å; V471-K475 WeakPolarHBondContact O-CB 3.27Å; V471-K475 VanDerWaalsContact O-CG 3.23Å; V471-K475 WeakPolarHBondContact O-CG 3.43Å; V471-K475 PolarHBondContact O-N 3.05Å
472	E	35.7	Very low	39.7	Very low	121 Å²	121	104.5 Å²	104.5	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-69.3	-40.6	173.9	-80.9	-171.4	149.4	0	0	112.5	F468 K475 Q476	F468-E472 PolarHBondContact O-N 3Å; E472-K475 PolarHBondContact O-N 2.92Å; E472-Q476 PolarHBondContact O-N 3.35Å
473	S	35.3	Very low	40.1	Very low	66 Å²	66	104.2 Å²	104.2	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-59	-47.9	170.6	162.2	0	0	0	0	111.5	L469 K475 Q476 D477	L469-S473 PolarHBondContact O-N 3.45Å; S473-K475 VanDerWaalsContact C-N 3.34Å; S473-K475 PolarHBondContact O-N 2.96Å; S473-Q476 PolarHBondContact O-N 3.23Å; S473-D477 PolarHBondContact O-N 3.09Å
474	A	39.8	Very low	40.6	Very low	58 Å²	58	103 Å²	103	48%	0.479	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-32.2	178.4	0	0	0	0	0	113.4	S470 A478	S470-A474 WeakPolarHBondContact O-CB 3.31Å; S470-A474 PolarHBondContact O-N 3.38Å; A474-A478 VanDerWaalsContact O-CB 3.24Å; A474-A478 WeakPolarHBondContact O-CB 3.38Å; A474-A478 PolarHBondContact O-N 3.37Å
475	K	36.3	Very low	41	Very low	134 Å²	134	106.3 Å²	106.3	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-71.7	-30.1	174.5	-79.1	173.5	-179.5	173.7	0	112.8	V471 E472 S473 K479	V471-K475 HydrophobicContact CG1-CD 4.02Å; V471-K475 HydrophobicContact CG1-CG 4.41Å; V471-K475 WeakPolarHBondContact O-CB 3.27Å; V471-K475 VanDerWaalsContact O-CG 3.23Å; V471-K475 WeakPolarHBondContact O-CG 3.43Å; V471-K475 PolarHBondContact O-N 3.05Å; E472-K475 PolarHBondContact O-N 2.92Å; S473-K475 VanDerWaalsContact C-N 3.34Å; S473-K475 PolarHBondContact O-N 2.96Å; K475-K479 PolarHBondContact O-N 3.13Å
476	Q	35.6	Very low	41.9	Very low	147 Å²	147	105.3 Å²	105.3	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-71	-38.6	174	-102.2	168.7	-13.6	0	0	111.9	E472 S473 K479	E472-Q476 PolarHBondContact O-N 3.35Å; S473-Q476 PolarHBondContact O-N 3.23Å; Q476-K479 PolarHBondContact O-N 3.1Å
477	D	36.3	Very low	42.6	Very low	104 Å²	104	105.8 Å²	105.8	56%	0.556	56%	0.56	S	S	*	*	H	α-helix	trans	-76.7	-30.4	174.7	-76.4	-34.4	0	0	0	113.2	S473 K479 K480	S473-D477 PolarHBondContact O-N 3.09Å; D477-K479 PolarHBondContact O-N 2.72Å; D477-K480 PolarHBondContact O-N 3.48Å
478	A	38	Very low	42.9	Very low	60 Å²	60	114.2 Å²	114.2	50%	0.496	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-67	-13.8	172.7	0	0	0	0	0	114	A474 K480	A474-A478 VanDerWaalsContact O-CB 3.24Å; A474-A478 WeakPolarHBondContact O-CB 3.38Å; A474-A478 PolarHBondContact O-N 3.37Å; A478-K480 PolarHBondContact O-N 2.8Å
479	K	37.4	Very low	43.8	Very low	161 Å²	161	115.9 Å²	115.9	70%	0.7	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-71.7	-15.5	168.8	-78.3	-176.8	179.1	177.8	0	112.8	K475 Q476 D477 R487	K475-K479 PolarHBondContact O-N 3.13Å; Q476-K479 PolarHBondContact O-N 3.1Å; D477-K479 PolarHBondContact O-N 2.72Å; K479-R487 PolarHBondContact O-NH1 2.78Å
480	K	42.5	Very low	44.4	Very low	175 Å²	175	112.5 Å²	112.5	76%	0.761	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-99.9	50	173.3	-64.8	178.1	-179.6	169.4	0	112	D477 A478	D477-K480 PolarHBondContact O-N 3.48Å; A478-K480 PolarHBondContact O-N 2.8Å
481	G	40.7	Very low	44.5	Very low	34 Å²	34	114.7 Å²	114.7	35%	0.351	60%	0.598	S	S	.	*			trans	-61.4	166.9	167.1	0	0	0	0	0	111.9	N483	G481-N483 PolarHBondContact O-N 2.92Å
482	P	45.2	Very low	44.6	Very low	104 Å²	104	118.9 Å²	118.9	68%	0.675	62%	0.623	S	S	*	*	S	Bend	trans	-67.1	6.1	-175	29.5	-35.4	0	0	0	114.3	P484	P482-P484 WeakPolarHBondContact O-CD 3.26Å
483	N	49.3	Very low	44.7	Very low	88 Å²	88	118.8 Å²	118.8	47%	0.471	63%	0.634	S	S	.	*			trans	-115.1	68.9	-177.6	-61.7	-21.7	0	0	0	111.3	G481 L485 M486	G481-N483 PolarHBondContact O-N 2.92Å; N483-L485 VanDerWaalsContact C-N 3.31Å; N483-M486 HydrophobicContact CB-CB 4.06Å; N483-M486 HydrophobicContact CB-CG 4.27Å
484	P	53.9	Low	44.5	Very low	75 Å²	75	124 Å²	124	49%	0.487	66%	0.655	S	S	.	*	S	Bend	trans	-55.9	-51.2	166.8	-18.8	28.7	0	0	0	109.8	P482 M486 R487 S490	P482-P484 WeakPolarHBondContact O-CD 3.26Å; P484-M486 VanDerWaalsContact C-N 3.35Å; P484-M486 PolarHBondContact O-N 3.15Å; P484-R487 PolarHBondContact O-N 2.99Å; P484-S490 VanDerWaalsContact C-CB 3.45Å; P484-S490 WeakPolarHBondContact O-CB 3.49Å; P484-S490 PolarHBondContact O-OG 3.17Å
485	L	53.3	Low	44.3	Very low	162 Å²	162	125.8 Å²	125.8	85%	0.848	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-18.7	-169.8	-63.4	172.3	0	0	0	115.4	N483 R487	N483-L485 VanDerWaalsContact C-N 3.31Å; L485-R487 VanDerWaalsContact C-N 3.3Å
486	M	54.9	Low	43.9	Very low	161 Å²	161	124.7 Å²	124.7	79%	0.793	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-1.9	177.5	-63.4	-168.1	154.6	0	0	113.3	N483 P484	N483-M486 HydrophobicContact CB-CB 4.06Å; N483-M486 HydrophobicContact CB-CG 4.27Å; P484-M486 VanDerWaalsContact C-N 3.35Å; P484-M486 PolarHBondContact O-N 3.15Å
487	R	56.4	Low	43.8	Very low	146 Å²	146	123.6 Å²	123.6	55%	0.551	69%	0.685	S	S	*	*	S	Bend	trans	-112.4	126.8	174.7	-68	-176.3	175.9	173.6	0.1	109.2	K479 P484 L485 N489	K479-R487 PolarHBondContact O-NH1 2.78Å; P484-R487 PolarHBondContact O-N 2.99Å; L485-R487 VanDerWaalsContact C-N 3.3Å; R487-N489 PolarHBondContact O-N 3.12Å; R487-N489 VanDerWaalsContact O-N 3.15Å
488	R	50.9	Low	43.6	Very low	245 Å²	245	127.1 Å²	127.1	93%	0.925	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	123.8	170	-81.2	-179.4	173.2	171.6	-2.3	108.1
489	N	56.6	Low	43.3	Very low	155 Å²	155	129.7 Å²	129.7	83%	0.829	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.6	31.1	176.4	-46.5	-16	0	0	0	118	R487 V491	R487-N489 PolarHBondContact O-N 3.12Å; R487-N489 VanDerWaalsContact O-N 3.15Å; N489-V491 PolarHBondContact O-N 2.63Å
490	S	50.3	Low	43.2	Very low	51 Å²	51	127.5 Å²	127.5	36%	0.357	71%	0.71	S	S	.	*			trans	-78	69.4	163.8	68.4	0	0	0	0	111.9	P484	P484-S490 VanDerWaalsContact C-CB 3.45Å; P484-S490 WeakPolarHBondContact O-CB 3.49Å; P484-S490 PolarHBondContact O-OG 3.17Å
491	V	43.7	Very low	42.7	Very low	124 Å²	124	129.6 Å²	129.6	75%	0.752	72%	0.719	S	S	*	*			trans	-110.5	112.2	171.7	-174.5	0	0	0	0	108	N489	N489-V491 PolarHBondContact O-N 2.63Å
492	T	44.1	Very low	42.2	Very low	125 Å²	125	137.7 Å²	137.7	77%	0.767	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-65.7	123.9	167.4	-28.9	0	0	0	0	108	L494	T492-L494 PolarHBondContact O-N 2.85Å
493	P	37.4	Very low	41.7	Very low	120 Å²	120	138.5 Å²	138.5	78%	0.779	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.9	118.8	174.2	-9.5	24.8	0	0	0	108.7	A495	P493-A495 PolarHBondContact O-N 3.5Å
494	L	32.6	Very low	40.7	Very low	174 Å²	174	146 Å²	146	91%	0.911	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-60.3	123.2	165.3	-83.4	156.9	0	0	0	108.5	T492 S496	T492-L494 PolarHBondContact O-N 2.85Å; L494-S496 PolarHBondContact O-N 3.26Å
495	A	34.7	Very low	39.6	Very low	97 Å²	97	149.7 Å²	149.7	80%	0.802	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-64.6	129.8	173	0	0	0	0	0	110.2	P493	P493-A495 PolarHBondContact O-N 3.5Å
496	S	28.5	Very low	38.5	Very low	111 Å²	111	149.1 Å²	149.1	78%	0.776	78%	0.784	S	S	*	*			trans	-152.4	147.9	158.4	-78.2	0	0	0	0	108.8	L494	L494-S496 PolarHBondContact O-N 3.26Å
497	P	33.3	Very low	37.1	Very low	123 Å²	123	147.3 Å²	147.3	80%	0.799	79%	0.787	S	S	*	*			trans	-81.6	151.7	-142.8	31.6	-35	0	0	0	113.9
498	E	31.5	Very low	35.8	Very low	178 Å²	178	149.7 Å²	149.7	83%	0.832	80%	0.802	S	S	*	*			trans	-51.2	157	175.2	-68.9	-169.5	156.9	0	0	113.4
499	P	33	Very low	34.7	Very low	115 Å²	115	146.9 Å²	146.9	75%	0.747	80%	0.799	S	S	*	*				-133.4	123.2	120.3	31.5	-17.8	0	0	0	113.3
500	T	35.3	Very low	33.4	Very low	115 Å²	115	147.6 Å²	147.6	71%	0.706	80%	0.797	S	S	*	*			trans	21.5	120.7	141.1	53.1	0	0	0	0	119.2
501	K	30.9	Very low	32.4	Very low	219 Å²	219	154.1 Å²	154.1	95%	0.952	82%	0.822	S	S	*	*				-166.5	148.3	128.7	-105.4	165.3	-170.6	-179.6	0	113.5
502	K	30.5	Very low	31.7	Very low	204 Å²	204	155 Å²	155	89%	0.887	83%	0.827	S	S	*	*			trans	-65.5	167.8	-163.8	-80.1	177.1	177.5	180	0	117.1
503	P	34	Very low	30.9	Very low	120 Å²	120	153.6 Å²	153.6	78%	0.779	83%	0.828	S	S	*	*			trans	-92.3	159.1	-165.5	37.3	-33.2	0	0	0	114
504	R	29.2	Very low	30.3	Very low	246 Å²	246	152.7 Å²	152.7	93%	0.928	83%	0.825	S	S	*	*			trans	-142.1	104.8	163.9	-92.5	-172.7	176.2	169.6	-1.6	112.3
505	I	30.9	Very low	30.2	Very low	152 Å²	152	150.7 Å²	150.7	78%	0.779	82%	0.82	S	S	*	*			trans	22.8	125.3	131.8	-57.7	173.1	0	0	0	119.7
506	N	29.2	Very low	29.9	Very low	151 Å²	151	151.8 Å²	151.8	81%	0.807	82%	0.821	S	S	*	*			trans	18.3	134.7	143.7	-59.8	-7.5	0	0	0	121.7
507	S	26.8	Very low	29.9	Very low	123 Å²	123	150.9 Å²	150.9	86%	0.86	82%	0.821	S	S	*	*				-165.2	138.4	119.4	32.6	0	0	0	0	112
508	F	28.8	Very low	29.8	Very low	196 Å²	196	150 Å²	150	86%	0.86	82%	0.824	S	S	*	*			trans	-60.3	151.3	165.8	-91.4	-114.2	0	0	0	111.3
509	E	28.1	Very low	29.8	Very low	185 Å²	185	149.4 Å²	149.4	86%	0.864	83%	0.825	S	S	*	*				-176.3	137.7	114.3	-100.9	172.7	179.4	0	0	112.4
510	E	29.6	Very low	30.1	Very low	170 Å²	170	149.7 Å²	149.7	79%	0.794	83%	0.827	S	S	*	*			trans	-69.6	148.3	170.5	-65.2	170.3	128.9	0	0	110.9
511	H	28.3	Very low	29.7	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.875	83%	0.826	S	S	*	*			trans	-153.3	119.6	143.7	-95	-56.3	0	0	0	112
512	V	28.4	Very low	29.6	Very low	142 Å²	142	143.9 Å²	143.9	86%	0.861	82%	0.818	S	S	*	*			trans	-90.5	133.8	164.2	175.5	0	0	0	0	108
513	A	27.6	Very low	29.7	Very low	96 Å²	96	142.1 Å²	142.1	79%	0.793	82%	0.817	S	S	*	*			trans	176.8	140.1	135.1	0	0	0	0	0	113.3
514	S	26.3	Very low	29.9	Very low	101 Å²	101	141.6 Å²	141.6	71%	0.706	81%	0.814	S	S	*	*			trans	-66.3	158.1	173.1	52.3	0	0	0	0	115.9
515	T	29.1	Very low	30.3	Very low	131 Å²	131	136 Å²	136	80%	0.804	81%	0.81	S	S	*	*				170.3	137.5	113.7	32.3	0	0	0	0	114.5
516	S	28.7	Very low	30.2	Very low	120 Å²	120	138 Å²	138	84%	0.839	82%	0.815	S	S	*	*			trans	58.3	150.5	141.5	114	0	0	0	0	120.6
517	A	29.5	Very low	30.7	Very low	92 Å²	92	136.9 Å²	136.9	76%	0.76	81%	0.814	S	S	*	*			cis	-171.8	157.8	0.4	0	0	0	0	0	108.4
518	A	30.1	Very low	31.2	Very low	105 Å²	105	137 Å²	137	87%	0.868	81%	0.812	S	S	*	*			trans	152.9	125.6	131	0	0	0	0	0	113.9
519	L	30.8	Very low	31.4	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	81%	0.805	S	S	*	*			trans	-89	171.4	167.8	-73.7	159.9	0	0	0	110.4
520	P	40	Very low	31.6	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	80%	0.8	S	S	*	*				-145.5	140.4	85	29	-6.8	0	0	0	117.6
521	S	27.6	Very low	31.7	Very low	96 Å²	96	131 Å²	131	67%	0.671	80%	0.799	S	S	*	*			trans	21.2	135	141.9	58.3	0	0	0	0	123.9
522	C	27.7	Very low	32.7	Very low	116 Å²	116	127.9 Å²	127.9	78%	0.784	80%	0.795	S	S	*	*				176	121	108.7	-86.4	0	0	0	0	115.2
523	L	32.4	Very low	32.8	Very low	167 Å²	167	124.5 Å²	124.5	87%	0.874	79%	0.789	S	S	*	*			trans	45.1	142.3	142.9	-65.1	164.1	0	0	0	125
524	P	38.6	Very low	33	Very low	110 Å²	110	129.5 Å²	129.5	71%	0.714	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-102	165.7	176.7	40.1	-32.3	0	0	0	114.1
525	P	37.3	Very low	33.9	Very low	129 Å²	129	129.9 Å²	129.9	84%	0.838	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-99.1	140.6	171.2	34.5	-25.8	0	0	0	113.6
526	E	30.2	Very low	34	Very low	193 Å²	193	132.2 Å²	132.2	90%	0.902	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.3	158.2	177.4	-69.1	-178.3	144.7	0	0	114
527	V	38.2	Very low	34.1	Very low	127 Å²	127	134.5 Å²	134.5	77%	0.77	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-88.2	156.4	169.7	176.8	0	0	0	0	109.7
528	P	38.4	Very low	34	Very low	126 Å²	126	133.9 Å²	133.9	82%	0.818	81%	0.807	S	S	*	*			trans	-137.8	148.7	139.6	28.1	-9.9	0	0	0	115.8
529	T	32.1	Very low	34	Very low	116 Å²	116	138.5 Å²	138.5	71%	0.712	81%	0.808	S	S	*	*			trans	-105.6	136.2	-179.3	-11.9	0	0	0	0	110.8
530	Q	32.4	Very low	34	Very low	165 Å²	165	135.2 Å²	135.2	77%	0.771	81%	0.805	S	S	*	*			trans	53.6	136.5	132.4	-89.5	-171.8	17	0	0	121.5
531	L	32.6	Very low	33.4	Very low	145 Å²	145	134.8 Å²	134.8	76%	0.759	80%	0.803	S	S	*	*				176.5	-164.7	52.8	-97.4	148.4	0	0	0	107.7
532	P	49.5	Very low	33.4	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	81%	0.808	S	S	*	*				-131.4	176.3	-55.1	36.4	-19.2	0	0	0	114.7
533	G	29.3	Very low	33.4	Very low	72 Å²	72	143 Å²	143	74%	0.742	81%	0.813	S	S	*	*			trans	146.7	94.6	149.1	0	0	0	0	0	121.4
534	Q	32.1	Very low	33.3	Very low	201 Å²	201	140.4 Å²	140.4	94%	0.939	80%	0.804	S	S	*	*			trans	64.9	158.1	135.4	-80.9	-157	-14.4	0	0	125.2
535	P	46.3	Very low	32.8	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	81%	0.813	S	S	*	*			trans	-119.4	168.1	-137.7	43.2	-32.3	0	0	0	116.1
536	L	30.1	Very low	32.4	Very low	179 Å²	179	140.6 Å²	140.6	94%	0.937	80%	0.804	S	S	*	*			trans	-142.1	139.4	163.9	-89.2	169	0	0	0	113.3
537	L	30.7	Very low	32.4	Very low	168 Å²	168	139.6 Å²	139.6	88%	0.88	80%	0.799	S	S	*	*			trans	-65.9	154.4	174.4	-88.3	86.5	0	0	0	113.7
538	G	27.9	Very low	32.1	Very low	80 Å²	80	139.1 Å²	139.1	83%	0.825	79%	0.79	S	S	*	*			trans	-167.7	115.9	158.4	0	0	0	0	0	112.9
539	K	29.8	Very low	31.6	Very low	201 Å²	201	142.8 Å²	142.8	87%	0.874	79%	0.794	S	S	*	*			trans	-88.7	165.3	178.4	-80.8	175.8	170.6	176.2	0	112.4
540	A	30.4	Very low	31.6	Very low	97 Å²	97	141.4 Å²	141.4	80%	0.802	79%	0.789	S	S	*	*			trans	78.6	144.7	160	0	0	0	0	0	116.1
541	C	27.5	Very low	31.6	Very low	112 Å²	112	142.5 Å²	142.5	76%	0.757	79%	0.791	S	S	*	*			cis	-165.1	131.3	30.8	-147.4	0	0	0	0	112.3
542	L	27.8	Very low	31.6	Very low	146 Å²	146	146.1 Å²	146.1	76%	0.764	80%	0.801	S	S	*	*			trans	21.7	128.6	132.3	-93.1	126.4	0	0	0	122.5
543	R	28.2	Very low	30.8	Very low	239 Å²	239	145.3 Å²	145.3	90%	0.902	80%	0.799	S	S	*	*				170.4	105.3	127.7	-95.5	173.3	-178.9	-171.3	0.8	107.9
544	T	29.3	Very low	32.3	Very low	111 Å²	111	147.2 Å²	147.2	68%	0.681	80%	0.798	S	S	*	*				49.2	101.5	77.8	-40.8	0	0	0	0	114.3
545	V	29.8	Very low	33.2	Very low	148 Å²	148	152.3 Å²	152.3	90%	0.897	81%	0.811	S	S	*	*			trans	-139.6	111.8	137.8	-179.6	0	0	0	0	107.6
546	C	28.7	Very low	32.5	Very low	96 Å²	96	154.5 Å²	154.5	65%	0.649	82%	0.816	S	S	*	*			trans	-90.1	170.2	164.1	-84.7	0	0	0	0	110
547	H	29.8	Very low	32.6	Very low	171 Å²	171	153.2 Å²	153.2	79%	0.792	81%	0.809	S	S	*	*			trans	88.8	136.5	154.5	-75.5	-18.3	0	0	0	117.1
548	I	30.6	Very low	32.7	Very low	117 Å²	117	152.4 Å²	152.4	60%	0.6	81%	0.805	S	S	*	*			cis	-161.3	140.6	10.3	-94.3	148.7	0	0	0	104.6
549	F	29	Very low	33	Very low	204 Å²	204	156.6 Å²	156.6	90%	0.895	80%	0.804	S	S	*	*				-166.1	139.5	99.9	-107.4	-75.7	0	0	0	112.6
550	S	32	Very low	33.2	Very low	87 Å²	87	153.9 Å²	153.9	61%	0.608	80%	0.8	S	S	*	*			trans	-98.4	155.1	-174.9	56.2	0	0	0	0	113
551	K	32.7	Very low	33.4	Very low	188 Å²	188	157.7 Å²	157.7	82%	0.817	80%	0.8	S	S	*	*			trans	65.3	115.9	140.8	-74.2	176.5	177.7	-175.1	0	118.9
552	F	33.1	Very low	33.8	Very low	221 Å²	221	160.9 Å²	160.9	97%	0.969	80%	0.803	S	S	*	*			trans	-131.2	131.7	131.1	-95.6	-86.1	0	0	0	109.1
553	S	32.6	Very low	34.3	Very low	105 Å²	105	162.1 Å²	162.1	73%	0.734	81%	0.806	S	S	*	*			trans	-112.4	152.1	171.5	-174.8	0	0	0	0	107.2
554	P	59.4	Low	34.8	Very low	111 Å²	111	155.7 Å²	155.7	72%	0.721	80%	0.798	S	S	*	*			trans	-88.7	156.2	-168.5	35.1	-32.5	0	0	0	112.8
555	Y	50.5	Low	35.3	Very low	309 Å²	309	159.7 Å²	159.7	100%	1.212	81%	0.809	S	S	*	*			trans	-115.9	0	148.4	-85.8	-77.7	0	0	0	108.1

Retrieved 555 of 555 residues in 123.7 ms (Link to these results)

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