A0A087Y070_POEFO Loading...

Rac GTPase-activating protein 1

AlphaFold DB , UniProt , Accession A0A087Y070, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 630 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	52.8	Low	62.9	Low	187 Å²	187	113.5 Å²	113.5	92%	0.921	60%	0.602	S	S	*	*				0	-46	0	-84.7	-172.2	-85.3	0	0	111.9	T3 T4 I5	M1-T3 PolarHBondContact O-N 3.11Å; M1-T4 WeakPolarHBondContact CA-OG1 3.08Å; M1-T4 PolarHBondContact O-N 2.86Å; M1-T4 PolarHBondContact O-OG1 3.17Å; M1-I5 WeakPolarHBondContact O-CG1 3.33Å; M1-I5 PolarHBondContact O-N 3.18Å; M1-I5 VanDerWaalsContact O-N 3.11Å
2	E	50.4	Low	64.4	Low	157 Å²	157	115.9 Å²	115.9	73%	0.734	60%	0.598	S	S	*	*	H	α-helix	trans	-59.2	-45.3	-178.6	-64.4	157.3	134.3	0	0	113.2	T4 I5 L6	E2-T4 VanDerWaalsContact C-N 3.3Å; E2-T4 PolarHBondContact O-N 3.32Å; E2-I5 PolarHBondContact O-N 3.27Å; E2-L6 WeakPolarHBondContact O-CG 3.45Å; E2-L6 PolarHBondContact O-N 2.96Å
3	T	53.5	Low	65.7	Low	112 Å²	112	113.5 Å²	113.5	69%	0.687	58%	0.582	S	S	*	*	H	α-helix	trans	-57.8	-37	176.8	48.1	0	0	0	0	113.9	M1 N7	M1-T3 PolarHBondContact O-N 3.11Å; T3-N7 PolarHBondContact O-N 2.85Å
4	T	54.8	Low	66.4	Low	85 Å²	85	111.6 Å²	111.6	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-74.2	-30.9	175.7	37.8	0	0	0	0	112.8	M1 E2 L8	M1-T4 WeakPolarHBondContact CA-OG1 3.08Å; M1-T4 PolarHBondContact O-N 2.86Å; M1-T4 PolarHBondContact O-OG1 3.17Å; E2-T4 VanDerWaalsContact C-N 3.3Å; E2-T4 PolarHBondContact O-N 3.32Å; T4-L8 WeakPolarHBondContact O-CG 3.43Å; T4-L8 PolarHBondContact O-N 3.41Å
5	I	58.4	Low	67.1	Low	100 Å²	100	112.1 Å²	112.1	51%	0.513	58%	0.577	S	S	.	*	H	α-helix	trans	-72.9	-45.2	176.4	-67.2	163.4	0	0	0	110.2	M1 E2 N7 L8 Q9	M1-I5 WeakPolarHBondContact O-CG1 3.33Å; M1-I5 PolarHBondContact O-N 3.18Å; M1-I5 VanDerWaalsContact O-N 3.11Å; E2-I5 PolarHBondContact O-N 3.27Å; I5-N7 VanDerWaalsContact C-N 3.28Å; I5-N7 PolarHBondContact O-N 3.29Å; I5-L8 PolarHBondContact O-N 3.47Å; I5-Q9 PolarHBondContact O-N 3.4Å
6	L	59.2	Low	67.8	Low	113 Å²	113	113.3 Å²	113.3	59%	0.592	57%	0.572	S	S	*	*	H	α-helix	trans	-57.5	-39.1	175.6	-72.3	166.1	0	0	0	112.3	E2 Q9 S10	E2-L6 WeakPolarHBondContact O-CG 3.45Å; E2-L6 PolarHBondContact O-N 2.96Å; L6-Q9 PolarHBondContact O-N 3.49Å; L6-S10 WeakPolarHBondContact O-CB 3.43Å; L6-S10 PolarHBondContact O-N 3.45Å
7	N	66.1	Low	68.1	Low	103 Å²	103	110.8 Å²	110.8	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-69	-40	177.8	-162	15.3	0	0	0	112.4	T3 I5 S10 L11	T3-N7 PolarHBondContact O-N 2.85Å; I5-N7 VanDerWaalsContact C-N 3.28Å; I5-N7 PolarHBondContact O-N 3.29Å; N7-S10 PolarHBondContact O-N 2.9Å; N7-L11 WeakPolarHBondContact O-CG 3.42Å; N7-L11 PolarHBondContact O-N 2.84Å
8	L	72.1	Confident	68	Low	120 Å²	120	111.4 Å²	111.4	63%	0.628	56%	0.564	S	S	*	*	H	α-helix	trans	-66.7	-38.3	174.6	-76.1	166.9	0	0	0	112.4	T4 I5 L11 Y12	T4-L8 WeakPolarHBondContact O-CG 3.43Å; T4-L8 PolarHBondContact O-N 3.41Å; I5-L8 PolarHBondContact O-N 3.47Å; L8-L11 PolarHBondContact O-N 2.88Å; L8-Y12 WeakPolarHBondContact O-CB 3.42Å; L8-Y12 PolarHBondContact O-N 3.42Å
9	Q	75.7	Confident	68.3	Low	110 Å²	110	109.5 Å²	109.5	51%	0.514	56%	0.558	S	S	.	*	H	α-helix	trans	-66.7	-42.3	175.5	-169.5	171.7	0.9	0	0	111.4	I5 L6 L11 Y12 E13	I5-Q9 PolarHBondContact O-N 3.4Å; L6-Q9 PolarHBondContact O-N 3.49Å; Q9-L11 VanDerWaalsContact C-N 3.34Å; Q9-L11 PolarHBondContact O-N 2.88Å; Q9-Y12 PolarHBondContact O-N 3.47Å; Q9-E13 PolarHBondContact O-N 2.83Å
10	S	74.7	Confident	68.4	Low	62 Å²	62	107.6 Å²	107.6	43%	0.434	55%	0.549	S	S	.	.	H	α-helix	trans	-57.3	-43.8	171.8	178.6	0	0	0	0	112.6	L6 N7 N14	L6-S10 WeakPolarHBondContact O-CB 3.43Å; L6-S10 PolarHBondContact O-N 3.45Å; N7-S10 PolarHBondContact O-N 2.9Å; S10-N14 PolarHBondContact O-N 3.13Å; S10-N14 VanDerWaalsContact O-N 3.1Å; S10-N14 PolarHBondContact O-ND2 2.98Å
11	L	73.9	Confident	68.2	Low	100 Å²	100	107.1 Å²	107.1	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-66.2	-39.1	175.9	-78.3	163.8	0	0	0	112.6	N7 L8 Q9 L15	N7-L11 WeakPolarHBondContact O-CG 3.42Å; N7-L11 PolarHBondContact O-N 2.84Å; L8-L11 PolarHBondContact O-N 2.88Å; Q9-L11 VanDerWaalsContact C-N 3.34Å; Q9-L11 PolarHBondContact O-N 2.88Å; L11-L15 WeakPolarHBondContact O-CB 3.46Å; L11-L15 PolarHBondContact O-N 2.87Å
12	Y	80.9	Confident	68.7	Low	142 Å²	142	104.8 Å²	104.8	56%	0.557	54%	0.536	S	S	*	.	H	α-helix	trans	-64.7	-46.7	177.5	179.1	-101	0	0	0	112.3	L8 Q9 N14 L15 R16	L8-Y12 WeakPolarHBondContact O-CB 3.42Å; L8-Y12 PolarHBondContact O-N 3.42Å; Q9-Y12 PolarHBondContact O-N 3.47Å; Y12-N14 PolarHBondContact O-N 3.11Å; Y12-L15 PolarHBondContact O-N 3.23Å; Y12-R16 WeakPolarHBondContact O-CB 3.35Å; Y12-R16 PolarHBondContact O-N 3.06Å
13	E	82.1	Confident	69.6	Low	85 Å²	85	101.7 Å²	101.7	40%	0.397	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-39.5	177.3	-65	-57.4	154	0	0	111.7	Q9 L15 R16 T17	Q9-E13 PolarHBondContact O-N 2.83Å; E13-L15 PolarHBondContact O-N 3.48Å; E13-R16 WeakPolarHBondContact O-CB 3.42Å; E13-R16 PolarHBondContact O-N 2.89Å; E13-T17 PolarHBondContact O-N 2.82Å; E13-T17 PolarHBondContact O-OG1 2.85Å
14	N	75.5	Confident	70.1	Confident	86 Å²	86	102.7 Å²	102.7	46%	0.46	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-43.4	173.3	-85.8	-79.8	0	0	0	112.5	S10 Y12 R16 T17 H18	S10-N14 PolarHBondContact O-N 3.13Å; S10-N14 VanDerWaalsContact O-N 3.1Å; S10-N14 PolarHBondContact O-ND2 2.98Å; Y12-N14 PolarHBondContact O-N 3.11Å; N14-R16 VanDerWaalsContact C-N 3.31Å; N14-R16 PolarHBondContact O-N 2.81Å; N14-T17 WeakPolarHBondContact CA-OG1 3.28Å; N14-T17 PolarHBondContact O-N 3.47Å; N14-T17 PolarHBondContact O-OG1 3.31Å; N14-H18 WeakPolarHBondContact O-CB 3.36Å; N14-H18 PolarHBondContact O-CD2 2.72Å; N14-H18 PolarHBondContact O-N 2.96Å
15	L	76.3	Confident	70.5	Confident	119 Å²	119	103.4 Å²	103.4	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-40.7	175.9	-112.1	158.5	0	0	0	111.5	L11 Y12 E13 H18 V19	L11-L15 WeakPolarHBondContact O-CB 3.46Å; L11-L15 PolarHBondContact O-N 2.87Å; Y12-L15 PolarHBondContact O-N 3.23Å; E13-L15 PolarHBondContact O-N 3.48Å; L15-H18 PolarHBondContact O-N 3.3Å; L15-V19 WeakPolarHBondContact O-CG2 3.42Å; L15-V19 PolarHBondContact O-N 3.16Å
16	R	78.3	Confident	71	Confident	132 Å²	132	103.4 Å²	103.4	50%	0.498	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-52.2	176.1	-174.6	177	-171.7	158.5	7	111.8	Y12 E13 N14 H18 V19 D20	Y12-R16 WeakPolarHBondContact O-CB 3.35Å; Y12-R16 PolarHBondContact O-N 3.06Å; E13-R16 WeakPolarHBondContact O-CB 3.42Å; E13-R16 PolarHBondContact O-N 2.89Å; N14-R16 VanDerWaalsContact C-N 3.31Å; N14-R16 PolarHBondContact O-N 2.81Å; R16-H18 PolarHBondContact O-N 2.82Å; R16-V19 PolarHBondContact O-N 3.22Å; R16-D20 WeakPolarHBondContact CG-OD2 3.39Å; R16-D20 IonicContact NE-OD2 3.98Å; R16-D20 PolarHBondContact O-N 2.68Å
17	T	72.3	Confident	72	Confident	71 Å²	71	104.8 Å²	104.8	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-33.7	177.8	52.6	0	0	0	0	112.4	E13 N14 L21	E13-T17 PolarHBondContact O-N 2.82Å; E13-T17 PolarHBondContact O-OG1 2.85Å; N14-T17 WeakPolarHBondContact CA-OG1 3.28Å; N14-T17 PolarHBondContact O-N 3.47Å; N14-T17 PolarHBondContact O-OG1 3.31Å; T17-L21 VanDerWaalsContact O-CB 3.27Å; T17-L21 WeakPolarHBondContact O-CB 3.15Å; T17-L21 WeakPolarHBondContact O-CD1 3.41Å; T17-L21 WeakPolarHBondContact O-CG 3.48Å; T17-L21 PolarHBondContact O-N 3.05Å
18	H	67.8	Low	72.6	Confident	122 Å²	122	103.4 Å²	103.4	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-68	-39.8	173.6	-95.4	-67.7	0	0	0	113	N14 L15 R16 M22	N14-H18 WeakPolarHBondContact O-CB 3.36Å; N14-H18 PolarHBondContact O-CD2 2.72Å; N14-H18 PolarHBondContact O-N 2.96Å; L15-H18 PolarHBondContact O-N 3.3Å; R16-H18 PolarHBondContact O-N 2.82Å; H18-M22 WeakPolarHBondContact O-CB 3.43Å; H18-M22 VanDerWaalsContact O-CG 3.32Å; H18-M22 WeakPolarHBondContact O-CG 3.4Å; H18-M22 PolarHBondContact O-N 3.42Å
19	V	73.9	Confident	72.8	Confident	74 Å²	74	101.3 Å²	101.3	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-42.6	175.1	168.5	0	0	0	0	111.1	L15 R16 M22 N23	L15-V19 WeakPolarHBondContact O-CG2 3.42Å; L15-V19 PolarHBondContact O-N 3.16Å; R16-V19 PolarHBondContact O-N 3.22Å; V19-M22 PolarHBondContact O-N 2.86Å; V19-N23 PolarHBondContact O-N 2.75Å; V19-N23 PolarHBondContact O-ND2 2.96Å
20	D	68.7	Low	73.1	Confident	71 Å²	71	101.8 Å²	101.8	38%	0.38	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-47.2	179.4	-66	-28.1	0	0	0	110.9	R16 M22 N23 E24	R16-D20 WeakPolarHBondContact CG-OD2 3.39Å; R16-D20 IonicContact NE-OD2 3.98Å; R16-D20 PolarHBondContact O-N 2.68Å; D20-M22 VanDerWaalsContact C-N 3.28Å; D20-M22 PolarHBondContact O-N 3.48Å; D20-N23 PolarHBondContact O-N 3.49Å; D20-E24 WeakPolarHBondContact O-CG 3.49Å; D20-E24 PolarHBondContact O-N 3.13Å
21	L	64.7	Low	73.6	Confident	99 Å²	99	102.4 Å²	102.4	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-58.5	-34.9	173.3	-76.8	168.7	0	0	0	113.6	T17 N25	T17-L21 VanDerWaalsContact O-CB 3.27Å; T17-L21 WeakPolarHBondContact O-CB 3.15Å; T17-L21 WeakPolarHBondContact O-CD1 3.41Å; T17-L21 WeakPolarHBondContact O-CG 3.48Å; T17-L21 PolarHBondContact O-N 3.05Å; L21-N25 PolarHBondContact O-ND2 3.42Å
22	M	64.6	Low	74	Confident	138 Å²	138	102.3 Å²	102.3	68%	0.68	51%	0.512	S	S	*	.	H	α-helix	trans	-71.1	-33.4	174.1	-78.1	-166.6	73.7	0	0	112.4	H18 V19 D20 I26	H18-M22 WeakPolarHBondContact O-CB 3.43Å; H18-M22 VanDerWaalsContact O-CG 3.32Å; H18-M22 WeakPolarHBondContact O-CG 3.4Å; H18-M22 PolarHBondContact O-N 3.42Å; V19-M22 PolarHBondContact O-N 2.86Å; D20-M22 VanDerWaalsContact C-N 3.28Å; D20-M22 PolarHBondContact O-N 3.48Å; M22-I26 VanDerWaalsContact O-CD1 3.3Å; M22-I26 WeakPolarHBondContact O-CD1 3.48Å; M22-I26 VanDerWaalsContact O-CG1 3.29Å; M22-I26 WeakPolarHBondContact O-CG1 3.38Å
23	N	67.4	Low	74.2	Confident	92 Å²	92	100.2 Å²	100.2	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-77.1	-42.2	178.9	-75.5	-37.8	0	0	0	113.1	V19 D20 N25 I26	V19-N23 PolarHBondContact O-N 2.75Å; V19-N23 PolarHBondContact O-ND2 2.96Å; D20-N23 PolarHBondContact O-N 3.49Å; N23-N25 PolarHBondContact O-N 3.43Å; N23-I26 PolarHBondContact O-N 3.14Å; N23-I26 VanDerWaalsContact O-N 3.07Å
24	E	65.1	Low	74.6	Confident	133 Å²	133	100.4 Å²	100.4	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-53.2	-27.6	-174.6	-78.8	179.4	161.8	0	0	114.2	D20	D20-E24 WeakPolarHBondContact O-CG 3.49Å; D20-E24 PolarHBondContact O-N 3.13Å
25	N	62	Low	75.3	Confident	99 Å²	99	101.3 Å²	101.3	53%	0.529	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-7.3	-175	-67.4	-81.8	0	0	0	114.4	L21 N23 S29	L21-N25 PolarHBondContact O-ND2 3.42Å; N23-N25 PolarHBondContact O-N 3.43Å; N25-S29 VanDerWaalsContact O-CB 3.32Å; N25-S29 WeakPolarHBondContact O-CB 3.48Å; N25-S29 PolarHBondContact O-OG 3.39Å
26	I	70.8	Confident	76	Confident	100 Å²	100	99.8 Å²	99.8	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-75.1	-49.7	-175.6	-68.5	169.9	0	0	0	111.4	M22 N23 S29 F30	M22-I26 VanDerWaalsContact O-CD1 3.3Å; M22-I26 WeakPolarHBondContact O-CD1 3.48Å; M22-I26 VanDerWaalsContact O-CG1 3.29Å; M22-I26 WeakPolarHBondContact O-CG1 3.38Å; N23-I26 PolarHBondContact O-N 3.14Å; N23-I26 VanDerWaalsContact O-N 3.07Å; I26-S29 PolarHBondContact O-N 3.4Å; I26-F30 WeakPolarHBondContact O-CB 3.24Å; I26-F30 PolarHBondContact O-N 3.26Å
27	E	78.1	Confident	76.7	Confident	142 Å²	142	99.4 Å²	99.4	66%	0.664	51%	0.508	S	S	*	.	H	α-helix	trans	-59.5	-52.3	-176.9	-175.4	170.6	-169.5	0	0	113.7	S29 F30 I31	E27-S29 VanDerWaalsContact C-N 3.29Å; E27-S29 PolarHBondContact O-N 3.27Å; E27-F30 PolarHBondContact O-N 3.03Å; E27-I31 HydrophobicContact CG-CD1 3.88Å; E27-I31 WeakPolarHBondContact O-CG1 3.35Å; E27-I31 PolarHBondContact O-N 3.34Å
28	P	79.6	Confident	77.8	Confident	74 Å²	74	98.8 Å²	98.8	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-35.7	177.6	23.8	-33.9	0	0	0	112.6	I31 Q32	P28-I31 PolarHBondContact O-N 2.92Å; P28-Q32 PolarHBondContact O-N 3.12Å
29	S	75.8	Confident	79	Confident	76 Å²	76	96 Å²	96	53%	0.531	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-40.6	175.6	-60.3	0	0	0	0	112	N25 I26 E27 Q32 M33	N25-S29 VanDerWaalsContact O-CB 3.32Å; N25-S29 WeakPolarHBondContact O-CB 3.48Å; N25-S29 PolarHBondContact O-OG 3.39Å; I26-S29 PolarHBondContact O-N 3.4Å; E27-S29 VanDerWaalsContact C-N 3.29Å; E27-S29 PolarHBondContact O-N 3.27Å; S29-Q32 PolarHBondContact O-N 2.78Å; S29-M33 WeakPolarHBondContact O-CB 3.03Å; S29-M33 PolarHBondContact O-N 2.66Å
30	F	83.3	Confident	80	Confident	120 Å²	120	96 Å²	96	53%	0.526	49%	0.493	S	S	.	.	H	α-helix	trans	-69.5	-39.2	176.6	-173.4	-109.8	0	0	0	112	I26 E27 M33 L34	I26-F30 WeakPolarHBondContact O-CB 3.24Å; I26-F30 PolarHBondContact O-N 3.26Å; E27-F30 PolarHBondContact O-N 3.03Å; F30-M33 WeakPolarHBondContact O-CB 3.14Å; F30-M33 PolarHBondContact O-N 3.25Å; F30-L34 HydrophobicContact CD1-CD1 3.97Å; F30-L34 HydrophobicContact CD1-CG 4.41Å; F30-L34 HydrophobicContact CE1-CD1 3.62Å; F30-L34 HydrophobicContact CE1-CG 4.13Å; F30-L34 HydrophobicContact CZ-CD1 4.19Å; F30-L34 HydrophobicContact CZ-CD2 4.3Å; F30-L34 HydrophobicContact CZ-CG 4.29Å; F30-L34 WeakPolarHBondContact O-CG 3.29Å; F30-L34 PolarHBondContact O-N 3.39Å
31	I	84.3	Confident	81.3	Confident	75 Å²	75	99.9 Å²	99.9	39%	0.385	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-45.4	172.8	-69.4	166.7	0	0	0	110.6	E27 P28 M33 L34 Q35	E27-I31 HydrophobicContact CG-CD1 3.88Å; E27-I31 WeakPolarHBondContact O-CG1 3.35Å; E27-I31 PolarHBondContact O-N 3.34Å; P28-I31 PolarHBondContact O-N 2.92Å; I31-M33 VanDerWaalsContact C-N 3.32Å; I31-M33 PolarHBondContact O-N 2.79Å; I31-L34 PolarHBondContact O-N 3.42Å; I31-Q35 WeakPolarHBondContact O-CG 3.25Å; I31-Q35 PolarHBondContact O-N 3.27Å
32	Q	83.5	Confident	82.8	Confident	98 Å²	98	101.1 Å²	101.1	46%	0.458	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-39	175.4	-172.9	62.8	72.2	0	0	112	P28 S29 Q35 N36	P28-Q32 PolarHBondContact O-N 3.12Å; S29-Q32 PolarHBondContact O-N 2.78Å; Q32-Q35 PolarHBondContact O-N 2.95Å; Q32-N36 PolarHBondContact NE2-OD1 2.75Å; Q32-N36 WeakPolarHBondContact O-CB 3.49Å; Q32-N36 PolarHBondContact O-N 3.12Å; Q32-N36 PolarHBondContact O-ND2 2.89Å; Q32-N36 PolarHBondContact O-OD1 3.19Å
33	M	84.1	Confident	84.2	Confident	98 Å²	98	101.4 Å²	101.4	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-43.4	175.3	-173.4	177.2	-171.3	0	0	112	S29 F30 I31 N36 F37	S29-M33 WeakPolarHBondContact O-CB 3.03Å; S29-M33 PolarHBondContact O-N 2.66Å; F30-M33 WeakPolarHBondContact O-CB 3.14Å; F30-M33 PolarHBondContact O-N 3.25Å; I31-M33 VanDerWaalsContact C-N 3.32Å; I31-M33 PolarHBondContact O-N 2.79Å; M33-N36 PolarHBondContact O-N 2.91Å; M33-F37 HydrophobicContact CE-CE2 3.68Å; M33-F37 HydrophobicContact CE-CZ 3.73Å; M33-F37 HydrophobicContact CG-CD2 4.1Å; M33-F37 HydrophobicContact CG-CE2 3.61Å; M33-F37 HydrophobicContact CG-CZ 4.3Å; M33-F37 WeakPolarHBondContact O-CD2 3.36Å; M33-F37 PolarHBondContact O-N 2.71Å; M33-F37 HydrophobicContact SD-CE2 4.28Å
34	L	90.7	Very high	85.5	Confident	89 Å²	89	105.8 Å²	105.8	47%	0.466	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-42.3	174.9	-71.3	176.7	0	0	0	112.4	F30 I31 N36 F37 E38	F30-L34 HydrophobicContact CD1-CD1 3.97Å; F30-L34 HydrophobicContact CD1-CG 4.41Å; F30-L34 HydrophobicContact CE1-CD1 3.62Å; F30-L34 HydrophobicContact CE1-CG 4.13Å; F30-L34 HydrophobicContact CZ-CD1 4.19Å; F30-L34 HydrophobicContact CZ-CD2 4.3Å; F30-L34 HydrophobicContact CZ-CG 4.29Å; F30-L34 WeakPolarHBondContact O-CG 3.29Å; F30-L34 PolarHBondContact O-N 3.39Å; I31-L34 PolarHBondContact O-N 3.42Å; L34-N36 VanDerWaalsContact C-N 3.33Å; L34-N36 PolarHBondContact O-N 3.01Å; L34-F37 PolarHBondContact O-N 3.36Å; L34-E38 WeakPolarHBondContact O-CB 3.5Å; L34-E38 PolarHBondContact O-N 2.87Å
35	Q	90.6	Very high	87	Confident	105 Å²	105	102 Å²	102	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-60.2	-44.1	174.3	-71.6	175.8	11.1	0	0	111.3	I31 Q32 F37 E38 D39	I31-Q35 WeakPolarHBondContact O-CG 3.25Å; I31-Q35 PolarHBondContact O-N 3.27Å; Q32-Q35 PolarHBondContact O-N 2.95Å; Q35-F37 PolarHBondContact O-N 3.43Å; Q35-E38 PolarHBondContact O-N 2.96Å; Q35-D39 PolarHBondContact O-N 3.35Å
36	N	91.1	Very high	88.7	Confident	87 Å²	87	104.2 Å²	104.2	47%	0.465	50%	0.495	S	S	.	.	H	α-helix	trans	-62.3	-40.6	177.2	-67.1	-10	0	0	0	112	Q32 M33 L34 C40	Q32-N36 PolarHBondContact NE2-OD1 2.75Å; Q32-N36 WeakPolarHBondContact O-CB 3.49Å; Q32-N36 PolarHBondContact O-N 3.12Å; Q32-N36 PolarHBondContact O-ND2 2.89Å; Q32-N36 PolarHBondContact O-OD1 3.19Å; M33-N36 PolarHBondContact O-N 2.91Å; L34-N36 VanDerWaalsContact C-N 3.33Å; L34-N36 PolarHBondContact O-N 3.01Å; N36-C40 WeakPolarHBondContact O-CB 3.43Å; N36-C40 PolarHBondContact O-N 3.45Å; N36-C40 PolarHBondContact O-SG 3.12Å; N36-C40 VanDerWaalsContact O-SG 3.35Å
37	F	92.6	Very high	89.7	Confident	124 Å²	124	102.6 Å²	102.6	54%	0.544	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-42.7	174.8	-74.4	-50.3	0	0	0	112.9	M33 L34 Q35 C40 R41	M33-F37 HydrophobicContact CE-CE2 3.68Å; M33-F37 HydrophobicContact CE-CZ 3.73Å; M33-F37 HydrophobicContact CG-CD2 4.1Å; M33-F37 HydrophobicContact CG-CE2 3.61Å; M33-F37 HydrophobicContact CG-CZ 4.3Å; M33-F37 WeakPolarHBondContact O-CD2 3.36Å; M33-F37 PolarHBondContact O-N 2.71Å; M33-F37 HydrophobicContact SD-CE2 4.28Å; L34-F37 PolarHBondContact O-N 3.36Å; Q35-F37 PolarHBondContact O-N 3.43Å; F37-C40 PolarHBondContact O-N 3.26Å; F37-R41 WeakPolarHBondContact O-CB 3.46Å; F37-R41 PolarHBondContact O-N 3.32Å
38	E	94.2	Very high	90.6	Very high	58 Å²	58	100.3 Å²	100.3	27%	0.271	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-40.6	177.3	168.8	58	-170.1	0	0	111.5	L34 Q35 R41 R42	L34-E38 WeakPolarHBondContact O-CB 3.5Å; L34-E38 PolarHBondContact O-N 2.87Å; Q35-E38 PolarHBondContact O-N 2.96Å; E38-R41 WeakPolarHBondContact O-CB 3.24Å; E38-R41 PolarHBondContact O-N 3.19Å; E38-R41 IonicContact OE1-CZ 3.91Å; E38-R41 IonicContact OE1-NH2 2.88Å; E38-R41 PolarHBondContact OE1-NH2 3.42Å; E38-R41 IonicContact OE2-CZ 3.18Å; E38-R41 IonicContact OE2-NE 2.73Å; E38-R41 PolarHBondContact OE2-NE 3.45Å; E38-R41 IonicContact OE2-NH2 2.8Å; E38-R41 PolarHBondContact OE2-NH2 3.03Å; E38-R42 VanDerWaalsContact CG-CZ 3.48Å; E38-R42 VanDerWaalsContact CG-NH2 3.31Å; E38-R42 VanDerWaalsContact O-CG 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.2Å; E38-R42 PolarHBondContact O-N 3.38Å; E38-R42 IonicContact OE1-CZ 3.68Å; E38-R42 VanDerWaalsContact OE1-CZ 3.26Å; E38-R42 IonicContact OE1-NE 3.19Å; E38-R42 PolarHBondContact OE1-NE 3.19Å; E38-R42 IonicContact OE1-NH2 3.23Å; E38-R42 PolarHBondContact OE1-NH2 3.24Å
39	D	94.1	Very high	91.4	Very high	64 Å²	64	102.9 Å²	102.9	34%	0.342	49%	0.494	S	S	.	.	H	α-helix	trans	-69.2	-36.2	174.2	-101.5	18.2	0	0	0	113	Q35 R41 R42 R43	Q35-D39 PolarHBondContact O-N 3.35Å; D39-R41 VanDerWaalsContact C-N 3.34Å; D39-R42 PolarHBondContact O-N 3.01Å; D39-R42 WeakPolarHBondContact OD1-CD 3.39Å; D39-R42 IonicContact OD1-CZ 2.68Å; D39-R42 IonicContact OD1-NE 3.95Å; D39-R42 IonicContact OD1-NH1 2.7Å; D39-R42 PolarHBondContact OD1-NH1 3.42Å; D39-R43 VanDerWaalsContact O-CG 3.24Å; D39-R43 WeakPolarHBondContact O-CG 3.44Å; D39-R43 PolarHBondContact O-N 2.93Å
40	C	93.8	Very high	92.4	Very high	75 Å²	75	104.3 Å²	104.3	51%	0.507	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-42.1	168.9	-78.9	0	0	0	0	111.8	N36 F37 R42 R43 W44	N36-C40 WeakPolarHBondContact O-CB 3.43Å; N36-C40 PolarHBondContact O-N 3.45Å; N36-C40 PolarHBondContact O-SG 3.12Å; N36-C40 VanDerWaalsContact O-SG 3.35Å; F37-C40 PolarHBondContact O-N 3.26Å; C40-R42 PolarHBondContact O-N 3.07Å; C40-R43 PolarHBondContact O-N 3.34Å; C40-W44 WeakPolarHBondContact O-CB 3.23Å; C40-W44 PolarHBondContact O-N 2.81Å
41	R	96.3	Very high	92.9	Very high	151 Å²	151	102.5 Å²	102.5	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-61.7	-41.2	175.1	-168.5	-174	69	85.7	3.6	111.8	F37 E38 D39 A45	F37-R41 WeakPolarHBondContact O-CB 3.46Å; F37-R41 PolarHBondContact O-N 3.32Å; E38-R41 WeakPolarHBondContact O-CB 3.24Å; E38-R41 PolarHBondContact O-N 3.19Å; E38-R41 IonicContact OE1-CZ 3.91Å; E38-R41 IonicContact OE1-NH2 2.88Å; E38-R41 PolarHBondContact OE1-NH2 3.42Å; E38-R41 IonicContact OE2-CZ 3.18Å; E38-R41 IonicContact OE2-NE 2.73Å; E38-R41 PolarHBondContact OE2-NE 3.45Å; E38-R41 IonicContact OE2-NH2 2.8Å; E38-R41 PolarHBondContact OE2-NH2 3.03Å; D39-R41 VanDerWaalsContact C-N 3.34Å; R41-A45 WeakPolarHBondContact O-CB 3.41Å; R41-A45 PolarHBondContact O-N 3.21Å
42	R	96.6	Very high	93.6	Very high	125 Å²	125	100.3 Å²	100.3	47%	0.472	48%	0.484	S	S	.	.	H	α-helix	trans	-68.3	-34.6	175.1	-68.4	166.4	-171.1	169.8	-3.1	113.5	E38 D39 C40 R46	E38-R42 VanDerWaalsContact CG-CZ 3.48Å; E38-R42 VanDerWaalsContact CG-NH2 3.31Å; E38-R42 VanDerWaalsContact O-CG 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.2Å; E38-R42 PolarHBondContact O-N 3.38Å; E38-R42 IonicContact OE1-CZ 3.68Å; E38-R42 VanDerWaalsContact OE1-CZ 3.26Å; E38-R42 IonicContact OE1-NE 3.19Å; E38-R42 PolarHBondContact OE1-NE 3.19Å; E38-R42 IonicContact OE1-NH2 3.23Å; E38-R42 PolarHBondContact OE1-NH2 3.24Å; D39-R42 PolarHBondContact O-N 3.01Å; D39-R42 WeakPolarHBondContact OD1-CD 3.39Å; D39-R42 IonicContact OD1-CZ 2.68Å; D39-R42 IonicContact OD1-NE 3.95Å; D39-R42 IonicContact OD1-NH1 2.7Å; D39-R42 PolarHBondContact OD1-NH1 3.42Å; C40-R42 PolarHBondContact O-N 3.07Å; R42-R46 PolarHBondContact O-N 3.26Å; R42-R46 PolarHBondContact O-NE 3.32Å
43	R	94.9	Very high	94.2	Very high	144 Å²	144	98.8 Å²	98.8	54%	0.543	48%	0.484	S	S	.	.	H	α-helix	trans	-66.8	-49.4	173.1	-70.6	167.7	-163.3	-149.4	5.2	110	D39 C40 A45 R46 S47	D39-R43 VanDerWaalsContact O-CG 3.24Å; D39-R43 WeakPolarHBondContact O-CG 3.44Å; D39-R43 PolarHBondContact O-N 2.93Å; C40-R43 PolarHBondContact O-N 3.34Å; R43-A45 PolarHBondContact O-N 2.95Å; R43-R46 PolarHBondContact O-N 3.48Å; R43-S47 PolarHBondContact O-N 3.13Å; R43-S47 PolarHBondContact O-OG 3.31Å
44	W	95.1	Very high	94.6	Very high	184 Å²	184	97.5 Å²	97.5	70%	0.697	48%	0.484	S	S	*	.	H	α-helix	trans	-56.9	-45.1	175.9	-175.4	-93.6	0	0	0	112.7	C40 R46 S47 L48	C40-W44 WeakPolarHBondContact O-CB 3.23Å; C40-W44 PolarHBondContact O-N 2.81Å; W44-R46 PolarHBondContact O-N 3.01Å; W44-S47 PolarHBondContact O-N 2.92Å; W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3Å
45	A	95.9	Very high	94.9	Very high	53 Å²	53	98.7 Å²	98.7	44%	0.438	49%	0.485	S	S	.	.	H	α-helix	trans	-59.9	-42	176.7	0	0	0	0	0	112.8	R41 R43 L48 D49	R41-A45 WeakPolarHBondContact O-CB 3.41Å; R41-A45 PolarHBondContact O-N 3.21Å; R43-A45 PolarHBondContact O-N 2.95Å; A45-L48 PolarHBondContact O-N 2.71Å; A45-D49 PolarHBondContact O-N 3.48Å
46	R	96.9	Very high	95.3	Very high	147 Å²	147	97.8 Å²	97.8	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-65.5	-44.4	174.7	-76.7	-176.4	-72.5	150.2	-10	112.3	R42 R43 W44 L48 D49 E50	R42-R46 PolarHBondContact O-N 3.26Å; R42-R46 PolarHBondContact O-NE 3.32Å; R43-R46 PolarHBondContact O-N 3.48Å; W44-R46 PolarHBondContact O-N 3.01Å; R46-L48 PolarHBondContact O-N 3.3Å; R46-D49 WeakPolarHBondContact O-CB 3.23Å; R46-D49 PolarHBondContact O-N 3.01Å; R46-E50 WeakPolarHBondContact O-CB 3.48Å; R46-E50 VanDerWaalsContact O-CG 3.31Å; R46-E50 WeakPolarHBondContact O-CG 3.21Å; R46-E50 PolarHBondContact O-N 3.16Å
47	S	91.9	Very high	95.5	Very high	66 Å²	66	99 Å²	99	46%	0.462	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-24.5	178.1	-60.1	0	0	0	0	113.7	R43 W44 E50 L51	R43-S47 PolarHBondContact O-N 3.13Å; R43-S47 PolarHBondContact O-OG 3.31Å; W44-S47 PolarHBondContact O-N 2.92Å; S47-E50 WeakPolarHBondContact CA-OE2 3.48Å; S47-L51 WeakPolarHBondContact O-CB 3.42Å; S47-L51 PolarHBondContact O-N 3.01Å
48	L	96.8	Very high	95.6	Very high	94 Å²	94	97.8 Å²	97.8	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-71	-38.5	168.7	-74.6	179.5	0	0	0	112.8	W44 A45 R46 L51 G52	W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3Å; A45-L48 PolarHBondContact O-N 2.71Å; R46-L48 PolarHBondContact O-N 3.3Å; L48-L51 PolarHBondContact O-N 2.96Å; L48-G52 PolarHBondContact O-N 3.4Å
49	D	96.9	Very high	95.7	Very high	127 Å²	127	102.2 Å²	102.2	68%	0.679	50%	0.501	S	S	*	.	H	α-helix	trans	-70.8	-44.4	177.3	-167.3	53.4	0	0	0	111.5	A45 R46 L51 G52 S53	A45-D49 PolarHBondContact O-N 3.48Å; R46-D49 WeakPolarHBondContact O-CB 3.23Å; R46-D49 PolarHBondContact O-N 3.01Å; D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 PolarHBondContact O-N 3.2Å; D49-G52 WeakPolarHBondContact O-CA 3.44Å; D49-G52 PolarHBondContact O-N 3.12Å; D49-S53 PolarHBondContact O-N 2.95Å
50	E	96.6	Very high	95.9	Very high	106 Å²	106	105.3 Å²	105.3	50%	0.495	51%	0.511	S	S	.	.	H	α-helix	trans	-56.4	-42.8	170.1	-69.9	162.9	-179	0	0	111.4	R46 S47 G52 S53 C54	R46-E50 WeakPolarHBondContact O-CB 3.48Å; R46-E50 VanDerWaalsContact O-CG 3.31Å; R46-E50 WeakPolarHBondContact O-CG 3.21Å; R46-E50 PolarHBondContact O-N 3.16Å; S47-E50 WeakPolarHBondContact CA-OE2 3.48Å; E50-G52 VanDerWaalsContact C-N 3.34Å; E50-S53 PolarHBondContact O-N 3.1Å; E50-C54 WeakPolarHBondContact O-CB 3.44Å; E50-C54 PolarHBondContact O-N 3.32Å; E50-C54 PolarHBondContact O-SG 2.78Å
51	L	94.7	Very high	95.9	Very high	83 Å²	83	104.4 Å²	104.4	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-33.6	174.3	179	62.5	0	0	0	112.6	S47 L48 D49 K55	S47-L51 WeakPolarHBondContact O-CB 3.42Å; S47-L51 PolarHBondContact O-N 3.01Å; L48-L51 PolarHBondContact O-N 2.96Å; D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 PolarHBondContact O-N 3.2Å; L51-K55 HydrophobicContact CG-CD 4.42Å; L51-K55 VanDerWaalsContact O-CG 3.28Å; L51-K55 WeakPolarHBondContact O-CG 3.38Å; L51-K55 PolarHBondContact O-N 3.17Å; L51-K55 VanDerWaalsContact O-N 3.1Å
52	G	97.3	Very high	95.9	Very high	29 Å²	29	101.2 Å²	101.2	30%	0.299	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-54.6	171.1	0	0	0	0	0	111.4	L48 D49 E50 C54 K55 D56	L48-G52 PolarHBondContact O-N 3.4Å; D49-G52 WeakPolarHBondContact O-CA 3.44Å; D49-G52 PolarHBondContact O-N 3.12Å; E50-G52 VanDerWaalsContact C-N 3.34Å; G52-C54 VanDerWaalsContact C-N 3.31Å; G52-C54 PolarHBondContact O-N 3.3Å; G52-K55 WeakPolarHBondContact O-CB 3.44Å; G52-K55 PolarHBondContact O-N 2.93Å; G52-D56 PolarHBondContact O-N 2.84Å
53	S	96.4	Very high	95.9	Very high	65 Å²	65	102.2 Å²	102.2	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-55.7	-43.3	177.1	-167.9	0	0	0	0	112.5	D49 E50 K55 D56 M57	D49-S53 PolarHBondContact O-N 2.95Å; E50-S53 PolarHBondContact O-N 3.1Å; S53-K55 PolarHBondContact O-N 3.16Å; S53-D56 PolarHBondContact O-N 2.84Å; S53-M57 WeakPolarHBondContact O-CG 3.48Å; S53-M57 PolarHBondContact O-N 2.94Å
54	C	93.8	Very high	96	Very high	71 Å²	71	100.3 Å²	100.3	48%	0.48	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-39.3	174.8	-76	0	0	0	0	113.4	E50 G52 D56 L58	E50-C54 WeakPolarHBondContact O-CB 3.44Å; E50-C54 PolarHBondContact O-N 3.32Å; E50-C54 PolarHBondContact O-SG 2.78Å; G52-C54 VanDerWaalsContact C-N 3.31Å; G52-C54 PolarHBondContact O-N 3.3Å; C54-D56 VanDerWaalsContact C-N 3.32Å; C54-L58 WeakPolarHBondContact O-CB 3.24Å; C54-L58 PolarHBondContact O-N 3.39Å
55	K	96.9	Very high	95.9	Very high	114 Å²	114	98.6 Å²	98.6	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-32.6	174.7	-75.3	168.2	179.7	175.1	0	112.3	L51 G52 S53 R59	L51-K55 HydrophobicContact CG-CD 4.42Å; L51-K55 VanDerWaalsContact O-CG 3.28Å; L51-K55 WeakPolarHBondContact O-CG 3.38Å; L51-K55 PolarHBondContact O-N 3.17Å; L51-K55 VanDerWaalsContact O-N 3.1Å; G52-K55 WeakPolarHBondContact O-CB 3.44Å; G52-K55 PolarHBondContact O-N 2.93Å; S53-K55 PolarHBondContact O-N 3.16Å; K55-R59 WeakPolarHBondContact O-CG 3.37Å; K55-R59 PolarHBondContact O-N 3.01Å
56	D	97.4	Very high	95.9	Very high	87 Å²	87	97.6 Å²	97.6	47%	0.465	50%	0.498	S	S	.	.	H	α-helix	trans	-74.9	-40.8	179.1	-72.6	13	0	0	0	111.4	G52 S53 C54 R59 K60	G52-D56 PolarHBondContact O-N 2.84Å; S53-D56 PolarHBondContact O-N 2.84Å; C54-D56 VanDerWaalsContact C-N 3.32Å; D56-R59 PolarHBondContact O-N 2.81Å; D56-R59 IonicContact OD1-CZ 3.55Å; D56-R59 IonicContact OD1-NE 3.71Å; D56-R59 IonicContact OD1-NH2 2.64Å; D56-R59 PolarHBondContact OD1-NH2 3.04Å; D56-R59 IonicContact OD2-NH2 3.93Å; D56-K60 WeakPolarHBondContact O-CB 3.25Å; D56-K60 PolarHBondContact O-N 3.21Å
57	M	96.1	Very high	95.9	Very high	112 Å²	112	93 Å²	93	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-61.9	-41.5	170.1	-70.7	-171.6	-72.9	0	0	112.2	S53 K60 A61	S53-M57 WeakPolarHBondContact O-CG 3.48Å; S53-M57 PolarHBondContact O-N 2.94Å; M57-K60 PolarHBondContact O-N 3.44Å; M57-A61 WeakPolarHBondContact O-CB 3.44Å; M57-A61 PolarHBondContact O-N 3.38Å
58	L	94.1	Very high	96	Very high	99 Å²	99	95.1 Å²	95.1	52%	0.518	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-53.3	175.4	178.1	61.1	0	0	0	111.4	C54 K60 A61 E62	C54-L58 WeakPolarHBondContact O-CB 3.24Å; C54-L58 PolarHBondContact O-N 3.39Å; L58-K60 VanDerWaalsContact C-N 3.27Å; L58-K60 PolarHBondContact O-N 2.68Å; L58-A61 PolarHBondContact O-N 3.17Å; L58-E62 HydrophobicContact CD1-CG 4.2Å; L58-E62 HydrophobicContact CG-CG 4.49Å; L58-E62 WeakPolarHBondContact O-CG 3.3Å; L58-E62 PolarHBondContact O-N 3.02Å
59	R	97.5	Very high	95.8	Very high	150 Å²	150	94 Å²	94	57%	0.566	49%	0.492	S	S	*	.	H	α-helix	trans	-57.1	-40.1	178.7	-74.3	-172.7	-68.4	160.4	-7.8	112.2	K55 D56 E62 M63	K55-R59 WeakPolarHBondContact O-CG 3.37Å; K55-R59 PolarHBondContact O-N 3.01Å; D56-R59 PolarHBondContact O-N 2.81Å; D56-R59 IonicContact OD1-CZ 3.55Å; D56-R59 IonicContact OD1-NE 3.71Å; D56-R59 IonicContact OD1-NH2 2.64Å; D56-R59 PolarHBondContact OD1-NH2 3.04Å; D56-R59 IonicContact OD2-NH2 3.93Å; R59-E62 PolarHBondContact O-N 3.3Å; R59-M63 WeakPolarHBondContact O-CG 2.96Å; R59-M63 PolarHBondContact O-N 3.49Å; R59-M63 VanDerWaalsContact O-N 3.07Å
60	K	97.7	Very high	95.8	Very high	130 Å²	130	93 Å²	93	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-46.9	174.7	-178.3	179.4	168.2	-176.3	0	111.8	D56 M57 L58 E62 M63 E64	D56-K60 WeakPolarHBondContact O-CB 3.25Å; D56-K60 PolarHBondContact O-N 3.21Å; M57-K60 PolarHBondContact O-N 3.44Å; L58-K60 VanDerWaalsContact C-N 3.27Å; L58-K60 PolarHBondContact O-N 2.68Å; K60-E62 VanDerWaalsContact C-N 3.31Å; K60-E62 PolarHBondContact O-N 2.95Å; K60-M63 PolarHBondContact O-N 2.9Å; K60-E64 WeakPolarHBondContact CE-OE1 3.24Å; K60-E64 IonicContact NZ-OE1 2.69Å; K60-E64 WeakPolarHBondContact O-CG 3.45Å; K60-E64 PolarHBondContact O-N 3.36Å
61	A	94.3	Very high	95.8	Very high	55 Å²	55	94.5 Å²	94.5	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-63.8	-35.3	178.3	0	0	0	0	0	112.5	M57 L58 E64 R65	M57-A61 WeakPolarHBondContact O-CB 3.44Å; M57-A61 PolarHBondContact O-N 3.38Å; L58-A61 PolarHBondContact O-N 3.17Å; A61-E64 PolarHBondContact O-N 3.42Å; A61-R65 WeakPolarHBondContact O-CB 3.01Å; A61-R65 PolarHBondContact O-N 3.39Å
62	E	95.8	Very high	95.6	Very high	85 Å²	85	94 Å²	94	40%	0.397	49%	0.492	S	S	.	.	H	α-helix	trans	-66.6	-40.8	174.7	-70.2	174.7	140.4	0	0	112.3	L58 R59 K60 R65 G66	L58-E62 HydrophobicContact CD1-CG 4.2Å; L58-E62 HydrophobicContact CG-CG 4.49Å; L58-E62 WeakPolarHBondContact O-CG 3.3Å; L58-E62 PolarHBondContact O-N 3.02Å; R59-E62 PolarHBondContact O-N 3.3Å; K60-E62 VanDerWaalsContact C-N 3.31Å; K60-E62 PolarHBondContact O-N 2.95Å; E62-R65 PolarHBondContact O-N 3.5Å; E62-G66 PolarHBondContact O-N 3.38Å
63	M	97.3	Very high	95.5	Very high	146 Å²	146	98.1 Å²	98.1	72%	0.719	50%	0.502	S	S	*	.	H	α-helix	trans	-64.7	-42.3	172.9	-70.5	176.5	68	0	0	112	R59 K60 G66 A67	R59-M63 WeakPolarHBondContact O-CG 2.96Å; R59-M63 PolarHBondContact O-N 3.49Å; R59-M63 VanDerWaalsContact O-N 3.07Å; K60-M63 PolarHBondContact O-N 2.9Å; M63-G66 PolarHBondContact O-N 2.79Å; M63-A67 WeakPolarHBondContact O-CB 3.35Å; M63-A67 PolarHBondContact O-N 2.82Å
64	E	96.4	Very high	95.5	Very high	104 Å²	104	100.3 Å²	100.3	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-65.3	-40.4	176.6	-74	177.8	-176	0	0	111.8	K60 A61 A67 L68	K60-E64 WeakPolarHBondContact CE-OE1 3.24Å; K60-E64 IonicContact NZ-OE1 2.69Å; K60-E64 WeakPolarHBondContact O-CG 3.45Å; K60-E64 PolarHBondContact O-N 3.36Å; A61-E64 PolarHBondContact O-N 3.42Å; E64-A67 PolarHBondContact O-N 3.27Å; E64-L68 WeakPolarHBondContact O-CG 3.09Å; E64-L68 PolarHBondContact O-N 2.95Å
65	R	93.7	Very high	95.4	Very high	148 Å²	148	99.4 Å²	99.4	56%	0.558	50%	0.502	S	S	*	.	H	α-helix	trans	-57.5	-53.9	171.7	-175	-175	69.1	-152.4	-5.5	111.2	A61 E62 A67 L68 D69	A61-R65 WeakPolarHBondContact O-CB 3.01Å; A61-R65 PolarHBondContact O-N 3.39Å; E62-R65 PolarHBondContact O-N 3.5Å; R65-A67 VanDerWaalsContact C-N 3.28Å; R65-A67 PolarHBondContact O-N 3.43Å; R65-L68 CarbonylContact O-C 3.57Å; R65-L68 WeakPolarHBondContact O-CA 3.18Å; R65-L68 WeakPolarHBondContact O-CB 3.48Å; R65-L68 PolarHBondContact O-N 2.86Å; R65-D69 PolarHBondContact O-N 3.29Å
66	G	95.4	Very high	95.1	Very high	32 Å²	32	101.8 Å²	101.8	33%	0.33	51%	0.508	S	S	.	.	H	α-helix	trans	-59.3	-36.8	179.4	0	0	0	0	0	113.3	E62 M63 D69 V70	E62-G66 PolarHBondContact O-N 3.38Å; M63-G66 PolarHBondContact O-N 2.79Å; G66-D69 PolarHBondContact O-N 3.43Å; G66-V70 WeakPolarHBondContact O-CG2 3.09Å; G66-V70 PolarHBondContact O-N 3.45Å; G66-V70 VanDerWaalsContact O-N 3.11Å
67	A	96.4	Very high	95	Very high	50 Å²	50	102.6 Å²	102.6	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-67.9	-31.8	174.2	0	0	0	0	0	113.3	M63 E64 R65 K71	M63-A67 WeakPolarHBondContact O-CB 3.35Å; M63-A67 PolarHBondContact O-N 2.82Å; E64-A67 PolarHBondContact O-N 3.27Å; R65-A67 VanDerWaalsContact C-N 3.28Å; R65-A67 PolarHBondContact O-N 3.43Å; A67-K71 VanDerWaalsContact O-CG 3.32Å; A67-K71 WeakPolarHBondContact O-CG 3.28Å; A67-K71 PolarHBondContact O-N 3.08Å
68	L	94.3	Very high	94.9	Very high	110 Å²	110	102.6 Å²	102.6	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-74	-40.3	172.4	-70.4	170.4	0	0	0	111.8	E64 R65 V70 K71 L72	E64-L68 WeakPolarHBondContact O-CG 3.09Å; E64-L68 PolarHBondContact O-N 2.95Å; R65-L68 CarbonylContact O-C 3.57Å; R65-L68 WeakPolarHBondContact O-CA 3.18Å; R65-L68 WeakPolarHBondContact O-CB 3.48Å; R65-L68 PolarHBondContact O-N 2.86Å; L68-V70 VanDerWaalsContact C-N 3.33Å; L68-V70 PolarHBondContact O-N 3.27Å; L68-K71 HydrophobicContact CD2-CD 4.47Å; L68-K71 WeakPolarHBondContact O-CB 3.48Å; L68-K71 PolarHBondContact O-N 2.85Å; L68-K71 VanDerWaalsContact O-N 3.16Å; L68-L72 VanDerWaalsContact O-CB 3.3Å; L68-L72 WeakPolarHBondContact O-CB 3.34Å; L68-L72 PolarHBondContact O-N 3.45Å
69	D	92.6	Very high	94.7	Very high	72 Å²	72	101.9 Å²	101.9	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-40.6	176.8	-69.4	-40.2	0	0	0	111.9	R65 G66 L72 K73	R65-D69 PolarHBondContact O-N 3.29Å; G66-D69 PolarHBondContact O-N 3.43Å; D69-L72 PolarHBondContact O-N 3.3Å; D69-K73 WeakPolarHBondContact O-CB 3.35Å; D69-K73 WeakPolarHBondContact O-CG 3.49Å; D69-K73 PolarHBondContact O-N 2.69Å
70	V	97	Very high	94.3	Very high	104 Å²	104	97.2 Å²	97.2	63%	0.63	50%	0.497	S	S	*	.	H	α-helix	trans	-63.9	-44.1	173.8	172	0	0	0	0	111.6	G66 L68 L72 K73 H74	G66-V70 WeakPolarHBondContact O-CG2 3.09Å; G66-V70 PolarHBondContact O-N 3.45Å; G66-V70 VanDerWaalsContact O-N 3.11Å; L68-V70 VanDerWaalsContact C-N 3.33Å; L68-V70 PolarHBondContact O-N 3.27Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 2.98Å; V70-K73 PolarHBondContact O-N 3.19Å; V70-H74 WeakPolarHBondContact O-CB 3.14Å; V70-H74 PolarHBondContact O-N 3.33Å
71	K	95.9	Very high	94.3	Very high	139 Å²	139	94.1 Å²	94.1	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-39.4	175.6	-72.4	168.9	-177.7	175.5	0	111.7	A67 L68 H74 A75	A67-K71 VanDerWaalsContact O-CG 3.32Å; A67-K71 WeakPolarHBondContact O-CG 3.28Å; A67-K71 PolarHBondContact O-N 3.08Å; L68-K71 HydrophobicContact CD2-CD 4.47Å; L68-K71 WeakPolarHBondContact O-CB 3.48Å; L68-K71 PolarHBondContact O-N 2.85Å; L68-K71 VanDerWaalsContact O-N 3.16Å; K71-H74 PolarHBondContact O-N 3.1Å; K71-A75 WeakPolarHBondContact O-CB 3.44Å; K71-A75 PolarHBondContact O-N 3.11Å
72	L	92.2	Very high	94.2	Very high	73 Å²	73	96.4 Å²	96.4	38%	0.382	49%	0.49	S	S	.	.	H	α-helix	trans	-70.5	-43.2	178.6	172.2	154.6	0	0	0	112	L68 D69 V70 H74 A75 R76	L68-L72 VanDerWaalsContact O-CB 3.3Å; L68-L72 WeakPolarHBondContact O-CB 3.34Å; L68-L72 PolarHBondContact O-N 3.45Å; D69-L72 PolarHBondContact O-N 3.3Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 2.98Å; L72-H74 VanDerWaalsContact C-N 3.29Å; L72-H74 PolarHBondContact O-N 3.4Å; L72-A75 PolarHBondContact O-N 3.45Å; L72-R76 VanDerWaalsContact CD2-CZ 3.48Å; L72-R76 WeakPolarHBondContact O-CG 3.46Å; L72-R76 PolarHBondContact O-N 2.73Å
73	K	94.5	Very high	93.8	Very high	115 Å²	115	95.8 Å²	95.8	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-59.7	-40.5	170.7	-75.1	-173.4	177.7	-171.1	0	110.5	D69 V70 N77 D164	D69-K73 WeakPolarHBondContact O-CB 3.35Å; D69-K73 WeakPolarHBondContact O-CG 3.49Å; D69-K73 PolarHBondContact O-N 2.69Å; V70-K73 PolarHBondContact O-N 3.19Å; K73-N77 VanDerWaalsContact O-CG 3.26Å; K73-N77 PolarHBondContact O-N 3.02Å; K73-N77 VanDerWaalsContact O-N 3.16Å; K73-N77 PolarHBondContact O-ND2 3.27Å; K73-D164 IonicContact NZ-OD1 3.84Å
74	H	96.5	Very high	93.6	Very high	110 Å²	110	96.1 Å²	96.1	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-66.6	-45	175.7	-175.6	71.1	0	0	0	113.4	V70 K71 L72 N77 Q78	V70-H74 WeakPolarHBondContact O-CB 3.14Å; V70-H74 PolarHBondContact O-N 3.33Å; K71-H74 PolarHBondContact O-N 3.1Å; L72-H74 VanDerWaalsContact C-N 3.29Å; L72-H74 PolarHBondContact O-N 3.4Å; H74-N77 PolarHBondContact O-N 2.88Å; H74-Q78 PolarHBondContact CD2-NE2 3.36Å; H74-Q78 PolarHBondContact NE2-NE2 3.48Å; H74-Q78 PolarHBondContact O-N 2.9Å
75	A	91.9	Very high	93.5	Very high	52 Å²	52	98.7 Å²	98.7	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-42.5	178.3	0	0	0	0	0	112.3	K71 L72 N77 Q78 V79	K71-A75 WeakPolarHBondContact O-CB 3.44Å; K71-A75 PolarHBondContact O-N 3.11Å; L72-A75 PolarHBondContact O-N 3.45Å; A75-N77 VanDerWaalsContact C-N 3.34Å; A75-N77 PolarHBondContact O-N 3.01Å; A75-Q78 PolarHBondContact O-N 3.03Å; A75-V79 PolarHBondContact O-N 2.95Å; A75-V79 VanDerWaalsContact O-N 3.14Å
76	R	91.1	Very high	93.4	Very high	165 Å²	165	97.2 Å²	97.2	62%	0.623	48%	0.481	S	S	*	.	H	α-helix	trans	-56.7	-47.6	172.2	-73.9	176.7	178.6	173.6	0.4	111.2	L72 Q78 V79 D80	L72-R76 VanDerWaalsContact CD2-CZ 3.48Å; L72-R76 WeakPolarHBondContact O-CG 3.46Å; L72-R76 PolarHBondContact O-N 2.73Å; R76-Q78 VanDerWaalsContact C-N 3.31Å; R76-Q78 PolarHBondContact O-N 3.48Å; R76-V79 PolarHBondContact O-N 3.02Å; R76-D80 PolarHBondContact O-N 3.31Å
77	N	94.8	Very high	93.2	Very high	104 Å²	104	101.2 Å²	101.2	56%	0.556	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-33.4	178	-72.2	-15.7	0	0	0	113.7	K73 H74 A75 V81	K73-N77 VanDerWaalsContact O-CG 3.26Å; K73-N77 PolarHBondContact O-N 3.02Å; K73-N77 VanDerWaalsContact O-N 3.16Å; K73-N77 PolarHBondContact O-ND2 3.27Å; H74-N77 PolarHBondContact O-N 2.88Å; A75-N77 VanDerWaalsContact C-N 3.34Å; A75-N77 PolarHBondContact O-N 3.01Å; N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 3.31Å
78	Q	93.5	Very high	93.1	Very high	112 Å²	112	105.3 Å²	105.3	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-46.2	173.5	-68.4	-171.6	26.1	0	0	111.8	H74 A75 R76 D80 V81 E82	H74-Q78 PolarHBondContact CD2-NE2 3.36Å; H74-Q78 PolarHBondContact NE2-NE2 3.48Å; H74-Q78 PolarHBondContact O-N 2.9Å; A75-Q78 PolarHBondContact O-N 3.03Å; R76-Q78 VanDerWaalsContact C-N 3.31Å; R76-Q78 PolarHBondContact O-N 3.48Å; Q78-D80 VanDerWaalsContact C-N 3.31Å; Q78-D80 PolarHBondContact O-N 2.79Å; Q78-V81 PolarHBondContact O-N 2.85Å; Q78-V81 VanDerWaalsContact O-N 3.14Å; Q78-E82 PolarHBondContact O-N 2.95Å
79	V	89.9	Confident	93	Very high	83 Å²	83	102.5 Å²	102.5	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-42.9	177.3	173	0	0	0	0	110.9	A75 R76 V81 E82 I83	A75-V79 PolarHBondContact O-N 2.95Å; A75-V79 VanDerWaalsContact O-N 3.14Å; R76-V79 PolarHBondContact O-N 3.02Å; V79-V81 VanDerWaalsContact C-N 3.29Å; V79-V81 PolarHBondContact O-N 3.11Å; V79-E82 PolarHBondContact O-N 3.14Å; V79-I83 HydrophobicContact CG1-CD1 3.7Å; V79-I83 HydrophobicContact CG1-CG1 4.27Å; V79-I83 WeakPolarHBondContact O-CB 3.27Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.21Å; V79-I83 PolarHBondContact O-N 3.43Å
80	D	89.9	Confident	92.9	Very high	53 Å²	53	102.5 Å²	102.5	28%	0.283	49%	0.49	S	S	.	.	H	α-helix	trans	-57	-38.7	174.4	-111.1	58.1	0	0	0	113.3	R76 Q78 R84	R76-D80 PolarHBondContact O-N 3.31Å; Q78-D80 VanDerWaalsContact C-N 3.31Å; Q78-D80 PolarHBondContact O-N 2.79Å; D80-R84 WeakPolarHBondContact O-CD 3.25Å; D80-R84 VanDerWaalsContact O-CG 3.22Å; D80-R84 WeakPolarHBondContact O-CG 3.49Å; D80-R84 PolarHBondContact O-N 3.37Å; D80-R84 PolarHBondContact O-NE 3.35Å; D80-R84 IonicContact OD2-CZ 3.68Å; D80-R84 IonicContact OD2-NE 2.8Å; D80-R84 IonicContact OD2-NH2 3.26Å; D80-R84 PolarHBondContact OD2-NH2 2.83Å
81	V	96	Very high	92.6	Very high	65 Å²	65	100 Å²	100	39%	0.394	48%	0.48	S	S	.	.	H	α-helix	trans	-71.5	-43.1	177.7	166.5	0	0	0	0	111.1	N77 Q78 V79 R84 R85	N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 3.31Å; Q78-V81 PolarHBondContact O-N 2.85Å; Q78-V81 VanDerWaalsContact O-N 3.14Å; V79-V81 VanDerWaalsContact C-N 3.29Å; V79-V81 PolarHBondContact O-N 3.11Å; V81-R84 PolarHBondContact O-N 2.93Å; V81-R85 VanDerWaalsContact O-CG 3.31Å; V81-R85 WeakPolarHBondContact O-CG 3.22Å; V81-R85 PolarHBondContact O-N 3.14Å
82	E	92.3	Very high	92.4	Very high	102 Å²	102	97.3 Å²	97.3	48%	0.477	47%	0.472	S	S	.	.	H	α-helix	trans	-69.7	-36.2	178.1	-68	-49.5	130.3	0	0	113	Q78 V79 R84 R85 R86	Q78-E82 PolarHBondContact O-N 2.95Å; V79-E82 PolarHBondContact O-N 3.14Å; E82-R84 VanDerWaalsContact C-N 3.34Å; E82-R84 PolarHBondContact O-N 3.1Å; E82-R85 PolarHBondContact O-N 3.12Å; E82-R85 VanDerWaalsContact OE1-CD 3.26Å; E82-R85 WeakPolarHBondContact OE1-CD 3.34Å; E82-R85 IonicContact OE1-CZ 3.25Å; E82-R85 IonicContact OE1-NE 3.95Å; E82-R85 IonicContact OE1-NH1 2.71Å; E82-R85 PolarHBondContact OE1-NH1 3.17Å; E82-R86 WeakPolarHBondContact O-CB 3.42Å; E82-R86 PolarHBondContact O-N 3.38Å
83	I	88	Confident	92.3	Very high	72 Å²	72	97.3 Å²	97.3	37%	0.369	48%	0.478	S	S	.	.	H	α-helix	trans	-58.9	-46.5	171.9	-72	170.1	0	0	0	110.4	V79 R86 Q87	V79-I83 HydrophobicContact CG1-CD1 3.7Å; V79-I83 HydrophobicContact CG1-CG1 4.27Å; V79-I83 WeakPolarHBondContact O-CB 3.27Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.21Å; V79-I83 PolarHBondContact O-N 3.43Å; I83-R86 PolarHBondContact O-N 3.13Å; I83-Q87 HydrophobicContact CG2-CG 4.4Å; I83-Q87 WeakPolarHBondContact O-CB 3.45Å; I83-Q87 VanDerWaalsContact O-CG 3.29Å; I83-Q87 WeakPolarHBondContact O-CG 2.97Å; I83-Q87 PolarHBondContact O-N 3.19Å
84	R	92.8	Very high	92	Very high	154 Å²	154	96.6 Å²	96.6	58%	0.581	48%	0.476	S	S	*	.	H	α-helix	trans	-67.6	-36.9	178.7	-66.7	172.7	-145.1	-167.6	5.5	112.6	D80 V81 E82 K88	D80-R84 WeakPolarHBondContact O-CD 3.25Å; D80-R84 VanDerWaalsContact O-CG 3.22Å; D80-R84 WeakPolarHBondContact O-CG 3.49Å; D80-R84 PolarHBondContact O-N 3.37Å; D80-R84 PolarHBondContact O-NE 3.35Å; D80-R84 IonicContact OD2-CZ 3.68Å; D80-R84 IonicContact OD2-NE 2.8Å; D80-R84 IonicContact OD2-NH2 3.26Å; D80-R84 PolarHBondContact OD2-NH2 2.83Å; V81-R84 PolarHBondContact O-N 2.93Å; E82-R84 VanDerWaalsContact C-N 3.34Å; E82-R84 PolarHBondContact O-N 3.1Å; R84-K88 PolarHBondContact O-N 2.84Å; R84-K88 VanDerWaalsContact O-N 3.11Å
85	R	94.6	Very high	91.8	Very high	158 Å²	158	96.3 Å²	96.3	60%	0.596	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-47.7	173.2	-76.6	168.5	171	-172.9	-4.4	111.1	V81 E82 K88 A89	V81-R85 VanDerWaalsContact O-CG 3.31Å; V81-R85 WeakPolarHBondContact O-CG 3.22Å; V81-R85 PolarHBondContact O-N 3.14Å; E82-R85 PolarHBondContact O-N 3.12Å; E82-R85 VanDerWaalsContact OE1-CD 3.26Å; E82-R85 WeakPolarHBondContact OE1-CD 3.34Å; E82-R85 IonicContact OE1-CZ 3.25Å; E82-R85 IonicContact OE1-NE 3.95Å; E82-R85 IonicContact OE1-NH1 2.71Å; E82-R85 PolarHBondContact OE1-NH1 3.17Å; R85-K88 PolarHBondContact O-N 3.33Å; R85-A89 PolarHBondContact O-N 2.8Å; R85-A89 VanDerWaalsContact O-N 3.1Å
86	R	92.2	Very high	91.8	Very high	117 Å²	117	98.4 Å²	98.4	44%	0.442	48%	0.48	S	S	.	.	H	α-helix	trans	-59.7	-52.9	176.2	-178.9	-172.1	168.2	140.8	9.8	111.6	E82 I83 K88 A89 E90 T146	E82-R86 WeakPolarHBondContact O-CB 3.42Å; E82-R86 PolarHBondContact O-N 3.38Å; I83-R86 PolarHBondContact O-N 3.13Å; R86-K88 PolarHBondContact O-N 3.03Å; R86-A89 PolarHBondContact O-N 2.91Å; R86-E90 HydrophobicContact CG-CG 4.26Å; R86-E90 WeakPolarHBondContact CG-OE2 3.41Å; R86-E90 IonicContact CZ-OE1 2.75Å; R86-E90 VanDerWaalsContact NE-CD 3.27Å; R86-E90 IonicContact NE-OE1 3.64Å; R86-E90 PolarHBondContact NE-OE1 3.06Å; R86-E90 IonicContact NE-OE2 2.75Å; R86-E90 PolarHBondContact NE-OE2 2.99Å; R86-E90 IonicContact NH2-OE1 3.38Å; R86-E90 PolarHBondContact NH2-OE1 3.48Å; R86-E90 WeakPolarHBondContact O-CG 3.29Å; R86-E90 PolarHBondContact O-N 2.91Å; R86-T146 VanDerWaalsContact NH1-CG2 3.3Å
87	Q	90.9	Very high	91.4	Very high	115 Å²	115	95.3 Å²	95.3	54%	0.537	48%	0.476	S	S	.	.	H	α-helix	trans	-57	-38	-179.7	-76.3	172.6	-11.6	0	0	112.4	I83 A91	I83-Q87 HydrophobicContact CG2-CG 4.4Å; I83-Q87 WeakPolarHBondContact O-CB 3.45Å; I83-Q87 VanDerWaalsContact O-CG 3.29Å; I83-Q87 WeakPolarHBondContact O-CG 2.97Å; I83-Q87 PolarHBondContact O-N 3.19Å; Q87-A91 WeakPolarHBondContact O-CB 3.25Å; Q87-A91 PolarHBondContact O-N 3.49Å
88	K	94.9	Very high	91.1	Very high	136 Å²	136	97.1 Å²	97.1	59%	0.591	48%	0.475	S	S	*	.	H	α-helix	trans	-64.2	-49.6	173.4	-170	-169.9	171	-167.7	0	111.3	R84 R85 R86 E90 A91 D92	R84-K88 PolarHBondContact O-N 2.84Å; R84-K88 VanDerWaalsContact O-N 3.11Å; R85-K88 PolarHBondContact O-N 3.33Å; R86-K88 PolarHBondContact O-N 3.03Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 3.21Å; K88-A91 PolarHBondContact O-N 3.25Å; K88-D92 WeakPolarHBondContact CE-OD2 3.41Å; K88-D92 PolarHBondContact O-N 3.38Å
89	A	91.8	Very high	90.7	Very high	51 Å²	51	96.9 Å²	96.9	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-61.7	-37.7	179.8	0	0	0	0	0	112.4	R85 R86 D92 C93	R85-A89 PolarHBondContact O-N 2.8Å; R85-A89 VanDerWaalsContact O-N 3.1Å; R86-A89 PolarHBondContact O-N 2.91Å; A89-D92 PolarHBondContact O-N 3.47Å; A89-C93 WeakPolarHBondContact O-CB 3.19Å; A89-C93 PolarHBondContact O-N 3.21Å; A89-C93 PolarHBondContact O-SG 2.79Å; A89-C93 VanDerWaalsContact O-SG 3.36Å
90	E	89.4	Confident	90.4	Very high	73 Å²	73	95.9 Å²	95.9	34%	0.341	47%	0.465	S	S	.	.	H	α-helix	trans	-65.2	-41.9	174.9	-72.1	175.3	142	0	0	111.8	R86 K88 C93 E94	R86-E90 HydrophobicContact CG-CG 4.26Å; R86-E90 WeakPolarHBondContact CG-OE2 3.41Å; R86-E90 IonicContact CZ-OE1 2.75Å; R86-E90 VanDerWaalsContact NE-CD 3.27Å; R86-E90 IonicContact NE-OE1 3.64Å; R86-E90 PolarHBondContact NE-OE1 3.06Å; R86-E90 IonicContact NE-OE2 2.75Å; R86-E90 PolarHBondContact NE-OE2 2.99Å; R86-E90 IonicContact NH2-OE1 3.38Å; R86-E90 PolarHBondContact NH2-OE1 3.48Å; R86-E90 WeakPolarHBondContact O-CG 3.29Å; R86-E90 PolarHBondContact O-N 2.91Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 3.21Å; E90-C93 PolarHBondContact O-N 3.41Å; E90-E94 PolarHBondContact O-N 2.94Å
91	A	91.4	Very high	90	Very high	51 Å²	51	97.2 Å²	97.2	42%	0.421	47%	0.469	S	S	.	.	H	α-helix	trans	-66.3	-40.9	174.1	0	0	0	0	0	113	Q87 K88 C93 E94 M95	Q87-A91 WeakPolarHBondContact O-CB 3.25Å; Q87-A91 PolarHBondContact O-N 3.49Å; K88-A91 PolarHBondContact O-N 3.25Å; A91-C93 VanDerWaalsContact C-N 3.33Å; A91-E94 PolarHBondContact O-N 2.96Å; A91-M95 WeakPolarHBondContact O-CG 3.27Å; A91-M95 PolarHBondContact O-N 3.2Å
92	D	92.3	Very high	89.3	Confident	82 Å²	82	99.3 Å²	99.3	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-40	175.2	-69.9	-25.5	0	0	0	110.5	K88 A89 M95 L96	K88-D92 WeakPolarHBondContact CE-OD2 3.41Å; K88-D92 PolarHBondContact O-N 3.38Å; A89-D92 PolarHBondContact O-N 3.47Å; D92-M95 PolarHBondContact O-N 3.35Å; D92-L96 WeakPolarHBondContact O-CG 3.48Å; D92-L96 PolarHBondContact O-N 2.9Å
93	C	89.1	Confident	88.7	Confident	74 Å²	74	98.8 Å²	98.8	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-46.9	172.3	-76.7	0	0	0	0	113.1	A89 E90 A91 M95 L96 D97	A89-C93 WeakPolarHBondContact O-CB 3.19Å; A89-C93 PolarHBondContact O-N 3.21Å; A89-C93 PolarHBondContact O-SG 2.79Å; A89-C93 VanDerWaalsContact O-SG 3.36Å; E90-C93 PolarHBondContact O-N 3.41Å; A91-C93 VanDerWaalsContact C-N 3.33Å; C93-M95 VanDerWaalsContact C-N 3.25Å; C93-M95 PolarHBondContact O-N 3.35Å; C93-L96 PolarHBondContact O-N 3.36Å; C93-L96 VanDerWaalsContact O-N 3.12Å; C93-D97 PolarHBondContact O-N 2.94Å
94	E	89.1	Confident	88	Confident	100 Å²	100	98.4 Å²	98.4	47%	0.467	47%	0.471	S	S	.	.	H	α-helix	trans	-59.4	-36.5	177.1	-81.9	-167	-150.2	0	0	112.5	E90 A91 R98	E90-E94 PolarHBondContact O-N 2.94Å; A91-E94 PolarHBondContact O-N 2.96Å; E94-R98 WeakPolarHBondContact O-CB 3.1Å; E94-R98 WeakPolarHBondContact O-CD 3.44Å; E94-R98 WeakPolarHBondContact O-CG 3.45Å; E94-R98 PolarHBondContact O-N 3.27Å; E94-R98 IonicContact OE2-CZ 2.89Å; E94-R98 IonicContact OE2-NE 3.74Å; E94-R98 IonicContact OE2-NH2 3.46Å; E94-R98 PolarHBondContact OE2-NH2 2.79Å
95	M	92.3	Very high	87.2	Confident	103 Å²	103	94.6 Å²	94.6	51%	0.507	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-40	175.6	-75.3	-64.4	-63.9	0	0	112	A91 D92 C93 Q99	A91-M95 WeakPolarHBondContact O-CG 3.27Å; A91-M95 PolarHBondContact O-N 3.2Å; D92-M95 PolarHBondContact O-N 3.35Å; C93-M95 VanDerWaalsContact C-N 3.25Å; C93-M95 PolarHBondContact O-N 3.35Å; M95-Q99 WeakPolarHBondContact O-CG 3.37Å; M95-Q99 PolarHBondContact O-N 3.11Å; M95-Q99 VanDerWaalsContact O-N 3.12Å
96	L	90.6	Very high	86.1	Confident	97 Å²	97	93.1 Å²	93.1	51%	0.508	47%	0.466	S	S	.	.	H	α-helix	trans	-69.1	-43.2	175.4	-69	169.6	0	0	0	112	D92 C93 R98 Q99 I100	D92-L96 WeakPolarHBondContact O-CG 3.48Å; D92-L96 PolarHBondContact O-N 2.9Å; C93-L96 PolarHBondContact O-N 3.36Å; C93-L96 VanDerWaalsContact O-N 3.12Å; L96-R98 VanDerWaalsContact C-N 3.3Å; L96-R98 PolarHBondContact O-N 2.91Å; L96-Q99 WeakPolarHBondContact O-CB 3.28Å; L96-Q99 PolarHBondContact O-N 3.4Å; L96-Q99 VanDerWaalsContact O-N 3.14Å; L96-I100 VanDerWaalsContact O-CG1 3.32Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.21Å
97	D	84.4	Confident	85	Confident	99 Å²	99	90.7 Å²	90.7	53%	0.529	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-38.7	176.3	-90	-32.5	0	0	0	112	C93 I100 Q101	C93-D97 PolarHBondContact O-N 2.94Å; D97-I100 PolarHBondContact O-N 2.85Å; D97-Q101 WeakPolarHBondContact O-CB 3.45Å; D97-Q101 PolarHBondContact O-N 2.67Å
98	R	86.7	Confident	83.7	Confident	143 Å²	143	89.4 Å²	89.4	54%	0.54	46%	0.461	S	S	.	.	H	α-helix	trans	-64.9	-40.5	173.4	-68.8	166.3	-160.8	-166.4	7.5	112.1	E94 L96 Q101 L102	E94-R98 WeakPolarHBondContact O-CB 3.1Å; E94-R98 WeakPolarHBondContact O-CD 3.44Å; E94-R98 WeakPolarHBondContact O-CG 3.45Å; E94-R98 PolarHBondContact O-N 3.27Å; E94-R98 IonicContact OE2-CZ 2.89Å; E94-R98 IonicContact OE2-NE 3.74Å; E94-R98 IonicContact OE2-NH2 3.46Å; E94-R98 PolarHBondContact OE2-NH2 2.79Å; L96-R98 VanDerWaalsContact C-N 3.3Å; L96-R98 PolarHBondContact O-N 2.91Å; R98-Q101 PolarHBondContact O-N 3.18Å; R98-L102 WeakPolarHBondContact O-CG 3.37Å; R98-L102 PolarHBondContact O-N 3.29Å
99	Q	86.7	Confident	82.1	Confident	106 Å²	106	85.2 Å²	85.2	50%	0.495	45%	0.449	S	S	.	.	H	α-helix	trans	-63.5	-44.8	174	-74.4	177	-3.6	0	0	111.6	M95 L96 Q101 L102 I103	M95-Q99 WeakPolarHBondContact O-CG 3.37Å; M95-Q99 PolarHBondContact O-N 3.11Å; M95-Q99 VanDerWaalsContact O-N 3.12Å; L96-Q99 WeakPolarHBondContact O-CB 3.28Å; L96-Q99 PolarHBondContact O-N 3.4Å; L96-Q99 VanDerWaalsContact O-N 3.14Å; Q99-Q101 VanDerWaalsContact C-N 3.31Å; Q99-Q101 PolarHBondContact O-N 2.96Å; Q99-L102 PolarHBondContact O-N 3.36Å; Q99-I103 VanDerWaalsContact O-CG1 3.3Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.06Å
100	I	83.9	Confident	80.4	Confident	63 Å²	63	89.7 Å²	89.7	32%	0.323	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-39.5	176.6	-65.5	165.1	0	0	0	110.5	L96 D97 I103 R104	L96-I100 VanDerWaalsContact O-CG1 3.32Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.21Å; D97-I100 PolarHBondContact O-N 2.85Å; I100-I103 PolarHBondContact O-N 3.45Å; I100-R104 WeakPolarHBondContact O-CG 3.33Å; I100-R104 PolarHBondContact O-N 3.49Å
101	Q	80.6	Confident	78.7	Confident	80 Å²	80	89.8 Å²	89.8	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-66.7	-44.5	176.9	-168.4	58.1	39.7	0	0	112.3	D97 R98 Q99 I103 R104 D105	D97-Q101 WeakPolarHBondContact O-CB 3.45Å; D97-Q101 PolarHBondContact O-N 2.67Å; R98-Q101 PolarHBondContact O-N 3.18Å; Q99-Q101 VanDerWaalsContact C-N 3.31Å; Q99-Q101 PolarHBondContact O-N 2.96Å; Q101-I103 PolarHBondContact O-N 3.06Å; Q101-R104 WeakPolarHBondContact O-CA 3.48Å; Q101-R104 WeakPolarHBondContact O-CB 3.45Å; Q101-R104 PolarHBondContact O-N 3.32Å; Q101-D105 PolarHBondContact NE2-OD1 3.24Å; Q101-D105 PolarHBondContact O-N 2.71Å
102	L	81.5	Confident	76.7	Confident	110 Å²	110	90.4 Å²	90.4	58%	0.576	48%	0.483	S	S	*	.	H	α-helix	trans	-58.3	-37	173.7	-71.7	169.1	0	0	0	112.1	R98 Q99 D105 L106	R98-L102 WeakPolarHBondContact O-CG 3.37Å; R98-L102 PolarHBondContact O-N 3.29Å; Q99-L102 PolarHBondContact O-N 3.36Å; L102-D105 PolarHBondContact O-N 3.23Å; L102-L106 WeakPolarHBondContact O-CB 3.12Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.47Å; L102-L106 PolarHBondContact O-N 2.98Å
103	I	80.3	Confident	74.9	Confident	90 Å²	90	93.5 Å²	93.5	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-45.2	172.9	-68.2	164.9	0	0	0	110.8	Q99 I100 Q101 D105 L106 L107	Q99-I103 VanDerWaalsContact O-CG1 3.3Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.06Å; I100-I103 PolarHBondContact O-N 3.45Å; Q101-I103 PolarHBondContact O-N 3.06Å; I103-D105 VanDerWaalsContact C-N 3.34Å; I103-D105 PolarHBondContact O-N 2.97Å; I103-L106 PolarHBondContact O-N 3.3Å; I103-L107 HydrophobicContact CG2-CD1 3.74Å; I103-L107 HydrophobicContact CG2-CG 4.32Å; I103-L107 WeakPolarHBondContact O-CB 3.38Å; I103-L107 WeakPolarHBondContact O-CG 3.46Å; I103-L107 PolarHBondContact O-N 3.22Å
104	R	73.2	Confident	73.2	Confident	64 Å²	64	97 Å²	97	24%	0.242	52%	0.519	C	S	.	.	H	α-helix	trans	-59.2	-43.9	174.6	-69.7	-179.7	-169.8	117.9	5.9	111.9	I100 Q101 L107 T108	I100-R104 WeakPolarHBondContact O-CG 3.33Å; I100-R104 PolarHBondContact O-N 3.49Å; Q101-R104 WeakPolarHBondContact O-CA 3.48Å; Q101-R104 WeakPolarHBondContact O-CB 3.45Å; Q101-R104 PolarHBondContact O-N 3.32Å; R104-L107 PolarHBondContact O-N 2.97Å; R104-T108 WeakPolarHBondContact O-CB 3.09Å; R104-T108 WeakPolarHBondContact O-CG2 3.35Å; R104-T108 PolarHBondContact O-N 2.86Å; R104-T108 PolarHBondContact O-OG1 3.11Å
105	D	74.8	Confident	71.5	Confident	74 Å²	74	94.6 Å²	94.6	40%	0.396	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-44.8	-177.2	-60.8	-16.6	0	0	0	110.2	Q101 L102 I103 L107 T108 S109	Q101-D105 PolarHBondContact NE2-OD1 3.24Å; Q101-D105 PolarHBondContact O-N 2.71Å; L102-D105 PolarHBondContact O-N 3.23Å; I103-D105 VanDerWaalsContact C-N 3.34Å; I103-D105 PolarHBondContact O-N 2.97Å; D105-L107 VanDerWaalsContact C-N 3.32Å; D105-L107 PolarHBondContact O-N 2.88Å; D105-T108 PolarHBondContact O-N 3.21Å; D105-T108 PolarHBondContact O-OG1 2.91Å; D105-S109 WeakPolarHBondContact O-CB 3.44Å; D105-S109 PolarHBondContact O-N 2.75Å
106	L	72.8	Confident	69.9	Low	128 Å²	128	96.2 Å²	96.2	67%	0.67	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-30.4	174.3	-71	169.3	0	0	0	113.7	L102 I103	L102-L106 WeakPolarHBondContact O-CB 3.12Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.47Å; L102-L106 PolarHBondContact O-N 2.98Å; I103-L106 PolarHBondContact O-N 3.3Å
107	L	67.5	Low	68.3	Low	66 Å²	66	100.5 Å²	100.5	35%	0.346	54%	0.54	S	S	.	.	H	α-helix	trans	-79.9	-18.4	175.7	-71.5	174.4	0	0	0	113.8	I103 R104 D105 L118 L126 L129	I103-L107 HydrophobicContact CG2-CD1 3.74Å; I103-L107 HydrophobicContact CG2-CG 4.32Å; I103-L107 WeakPolarHBondContact O-CB 3.38Å; I103-L107 WeakPolarHBondContact O-CG 3.46Å; I103-L107 PolarHBondContact O-N 3.22Å; R104-L107 PolarHBondContact O-N 2.97Å; D105-L107 VanDerWaalsContact C-N 3.32Å; D105-L107 PolarHBondContact O-N 2.88Å; L107-L118 HydrophobicContact CD2-CD1 3.29Å; L107-L126 HydrophobicContact CD1-CD1 4.22Å; L107-L126 HydrophobicContact CD2-CD1 3.76Å; L107-L129 HydrophobicContact CD1-CD1 3.77Å
108	T	64.6	Low	67.2	Low	88 Å²	88	97.8 Å²	97.8	54%	0.54	53%	0.525	S	S	.	.	H	α-helix	trans	-110.6	-8	-176.7	53.2	0	0	0	0	113.8	R104 D105 E110	R104-T108 WeakPolarHBondContact O-CB 3.09Å; R104-T108 WeakPolarHBondContact O-CG2 3.35Å; R104-T108 PolarHBondContact O-N 2.86Å; R104-T108 PolarHBondContact O-OG1 3.11Å; D105-T108 PolarHBondContact O-N 3.21Å; D105-T108 PolarHBondContact O-OG1 2.91Å; T108-E110 VanDerWaalsContact C-N 3.26Å; T108-E110 PolarHBondContact O-N 2.95Å
109	S	61	Low	66.1	Low	48 Å²	48	93.3 Å²	93.3	34%	0.336	52%	0.516	S	S	.	.			trans	-75	67.3	177.4	68.3	0	0	0	0	113.6	D105 G111	D105-S109 WeakPolarHBondContact O-CB 3.44Å; D105-S109 PolarHBondContact O-N 2.75Å; S109-G111 PolarHBondContact O-N 3.17Å
110	E	55.5	Low	65	Low	145 Å²	145	92.2 Å²	92.2	68%	0.678	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	109.3	168.6	-60.7	-157.2	112.4	0	0	110.4	T108 R123	T108-E110 VanDerWaalsContact C-N 3.26Å; T108-E110 PolarHBondContact O-N 2.95Å; E110-R123 IonicContact OE1-CZ 2.76Å; E110-R123 IonicContact OE1-NH1 3.77Å; E110-R123 PolarHBondContact OE1-NH1 3.1Å; E110-R123 IonicContact OE1-NH2 3.65Å; E110-R123 PolarHBondContact OE1-NH2 3.16Å
111	G	55.4	Low	64	Low	74 Å²	74	96.9 Å²	96.9	76%	0.763	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.2	-3.2	170.8	0	0	0	0	0	117.1	S109	S109-G111 PolarHBondContact O-N 3.17Å
112	S	48.7	Very low	63.1	Low	64 Å²	64	97.7 Å²	97.7	45%	0.448	55%	0.549	S	S	.	.	S	Bend	trans	-85.6	147.7	169.9	76.8	0	0	0	0	111.5	N114 S115	S112-N114 PolarHBondContact O-N 3.38Å; S112-S115 WeakPolarHBondContact O-CB 3.47Å; S112-S115 PolarHBondContact O-N 2.92Å; S112-S115 PolarHBondContact O-OG 2.93Å; S112-S115 VanDerWaalsContact O-OG 3.12Å
113	T	54	Low	62.3	Low	147 Å²	147	98.4 Å²	98.4	90%	0.902	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-7.6	-172.1	44.8	0	0	0	0	115.5
114	N	54.3	Low	61.6	Low	149 Å²	149	98.3 Å²	98.3	80%	0.797	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	17.7	174.3	-69.1	-20.7	0	0	0	112.6	S112 I116	S112-N114 PolarHBondContact O-N 3.38Å; N114-I116 PolarHBondContact O-N 3.42Å
115	S	52.9	Low	61.2	Low	48 Å²	48	98.6 Å²	98.6	34%	0.336	57%	0.567	S	S	.	*			trans	-65.5	128.7	-180	62.3	0	0	0	0	112	S112 Q117	S112-S115 WeakPolarHBondContact O-CB 3.47Å; S112-S115 PolarHBondContact O-N 2.92Å; S112-S115 PolarHBondContact O-OG 2.93Å; S112-S115 VanDerWaalsContact O-OG 3.12Å; S115-Q117 PolarHBondContact O-N 2.94Å
116	I	57.8	Low	60.7	Low	138 Å²	138	97.9 Å²	97.9	71%	0.708	56%	0.563	S	S	*	*			trans	-68.2	114.3	176.3	-57.2	174.6	0	0	0	108.7	N114 L118	N114-I116 PolarHBondContact O-N 3.42Å; I116-L118 VanDerWaalsContact C-N 3.27Å; I116-L118 HydrophobicContact CG2-CD2 3.92Å; I116-L118 HydrophobicContact CG2-CG 4.04Å; I116-L118 PolarHBondContact O-N 3.27Å
117	Q	58	Low	60.1	Low	187 Å²	187	93.9 Å²	93.9	87%	0.874	55%	0.548	S	S	*	.			trans	-72.8	79.6	176	-74.5	-170	-19.6	0	0	111.4	S115	S115-Q117 PolarHBondContact O-N 2.94Å
118	L	60.3	Low	59.9	Low	41 Å²	41	97.1 Å²	97.1	22%	0.215	56%	0.56	C	S	.	*			trans	-71.7	133.1	170.9	-64.6	174.5	0	0	0	110.7	L107 I116 Q122 R123 L126	L107-L118 HydrophobicContact CD2-CD1 3.29Å; I116-L118 VanDerWaalsContact C-N 3.27Å; I116-L118 HydrophobicContact CG2-CD2 3.92Å; I116-L118 HydrophobicContact CG2-CG 4.04Å; I116-L118 PolarHBondContact O-N 3.27Å; L118-Q122 HydrophobicContact CB-CB 4.16Å; L118-Q122 HydrophobicContact CD2-CB 4.33Å; L118-R123 HydrophobicContact CB-CG 4.11Å; L118-R123 PolarHBondContact O-NE 3.12Å; L118-L126 HydrophobicContact CD1-CD1 3.92Å
119	S	64.4	Low	59.7	Low	50 Å²	50	95.1 Å²	95.1	35%	0.35	55%	0.545	S	S	.	.			trans	-65.7	163.9	178.9	80.3	0	0	0	0	112.2	E121 Q122 R123	S119-E121 PolarHBondContact O-N 3.45Å; S119-E121 PolarHBondContact OG-N 3.16Å; S119-Q122 PolarHBondContact O-N 3.38Å; S119-Q122 VanDerWaalsContact O-N 3.13Å; S119-Q122 WeakPolarHBondContact OG-CG 3.31Å; S119-Q122 PolarHBondContact OG-N 3.46Å; S119-R123 WeakPolarHBondContact O-CB 3.15Å; S119-R123 VanDerWaalsContact O-CG 3.27Å; S119-R123 WeakPolarHBondContact O-CG 3.48Å; S119-R123 PolarHBondContact O-N 3.01Å
120	A	63.4	Low	59.3	Low	83 Å²	83	97.6 Å²	97.6	69%	0.686	56%	0.555	S	S	*	*	H	α-helix	trans	-56.2	-37.9	176.3	0	0	0	0	0	112.6	S124	A120-S124 WeakPolarHBondContact O-CB 3.38Å; A120-S124 PolarHBondContact O-N 3.08Å
121	E	63.1	Low	59.1	Low	161 Å²	161	95.2 Å²	95.2	75%	0.752	55%	0.55	S	S	*	*	H	α-helix	trans	-69.2	-41.8	176.1	-63.3	178.3	130.7	0	0	112.1	S119 S124 A125	S119-E121 PolarHBondContact O-N 3.45Å; S119-E121 PolarHBondContact OG-N 3.16Å; E121-S124 WeakPolarHBondContact O-CB 3.42Å; E121-S124 PolarHBondContact O-N 2.97Å; E121-A125 WeakPolarHBondContact O-CB 3.49Å; E121-A125 PolarHBondContact O-N 3.24Å
122	Q	62	Low	58.7	Low	96 Å²	96	96.6 Å²	96.6	45%	0.449	54%	0.54	S	S	.	.	H	α-helix	trans	-64.9	-40	176	-71	170.6	-27.4	0	0	111.8	L118 S119 A125 L126	L118-Q122 HydrophobicContact CB-CB 4.16Å; L118-Q122 HydrophobicContact CD2-CB 4.33Å; S119-Q122 PolarHBondContact O-N 3.38Å; S119-Q122 VanDerWaalsContact O-N 3.13Å; S119-Q122 WeakPolarHBondContact OG-CG 3.31Å; S119-Q122 PolarHBondContact OG-N 3.46Å; Q122-A125 PolarHBondContact O-N 3.19Å; Q122-L126 WeakPolarHBondContact O-CG 3.46Å; Q122-L126 PolarHBondContact O-N 2.83Å
123	R	63.9	Low	58.6	Low	125 Å²	125	97 Å²	97	47%	0.472	54%	0.542	S	S	.	.	H	α-helix	trans	-62.5	-41.4	172.8	-69	165.4	175.4	-125.8	-6.1	111.5	E110 L118 S119 L126 A127	E110-R123 IonicContact OE1-CZ 2.76Å; E110-R123 IonicContact OE1-NH1 3.77Å; E110-R123 PolarHBondContact OE1-NH1 3.1Å; E110-R123 IonicContact OE1-NH2 3.65Å; E110-R123 PolarHBondContact OE1-NH2 3.16Å; L118-R123 HydrophobicContact CB-CG 4.11Å; L118-R123 PolarHBondContact O-NE 3.12Å; S119-R123 WeakPolarHBondContact O-CB 3.15Å; S119-R123 VanDerWaalsContact O-CG 3.27Å; S119-R123 WeakPolarHBondContact O-CG 3.48Å; S119-R123 PolarHBondContact O-N 3.01Å; R123-L126 PolarHBondContact O-N 3.14Å; R123-A127 PolarHBondContact O-N 2.94Å
124	S	65.2	Low	58	Low	89 Å²	89	98.9 Å²	98.9	62%	0.622	54%	0.541	S	S	*	.	H	α-helix	trans	-65.5	-42	174.3	-168	0	0	0	0	112	A120 E121 L126 A127	A120-S124 WeakPolarHBondContact O-CB 3.38Å; A120-S124 PolarHBondContact O-N 3.08Å; E121-S124 WeakPolarHBondContact O-CB 3.42Å; E121-S124 PolarHBondContact O-N 2.97Å; S124-L126 VanDerWaalsContact C-N 3.27Å; S124-L126 PolarHBondContact O-N 3.31Å; S124-A127 WeakPolarHBondContact O-CB 3.38Å; S124-A127 PolarHBondContact O-N 3.44Å
125	A	65.3	Low	57.3	Low	69 Å²	69	95.3 Å²	95.3	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-65.5	-28.8	177.8	0	0	0	0	0	112.9	E121 Q122 F128	E121-A125 WeakPolarHBondContact O-CB 3.49Å; E121-A125 PolarHBondContact O-N 3.24Å; Q122-A125 PolarHBondContact O-N 3.19Å; A125-F128 WeakPolarHBondContact O-CD1 3.41Å; A125-F128 VanDerWaalsContact O-CE1 3.28Å; A125-F128 WeakPolarHBondContact O-CE1 3.42Å
126	L	63.7	Low	56.6	Low	60 Å²	60	98.2 Å²	98.2	31%	0.314	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.7	176	-67.3	170.4	0	0	0	113.8	L107 L118 Q122 R123 S124 F128 L129	L107-L126 HydrophobicContact CD1-CD1 4.22Å; L107-L126 HydrophobicContact CD2-CD1 3.76Å; L118-L126 HydrophobicContact CD1-CD1 3.92Å; Q122-L126 WeakPolarHBondContact O-CG 3.46Å; Q122-L126 PolarHBondContact O-N 2.83Å; R123-L126 PolarHBondContact O-N 3.14Å; S124-L126 VanDerWaalsContact C-N 3.27Å; S124-L126 PolarHBondContact O-N 3.31Å; L126-F128 HydrophobicContact CD2-CE1 4.45Å; L126-F128 PolarHBondContact O-N 3.12Å; L126-L129 HydrophobicContact CD2-CD1 4.05Å; L126-L129 WeakPolarHBondContact O-CB 3.45Å; L126-L129 PolarHBondContact O-N 3.35Å
127	A	61.3	Low	55.7	Low	43 Å²	43	99.5 Å²	99.5	36%	0.355	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.6	-174.9	0	0	0	0	0	114	R123 S124 L129 N130 T131	R123-A127 PolarHBondContact O-N 2.94Å; S124-A127 WeakPolarHBondContact O-CB 3.38Å; S124-A127 PolarHBondContact O-N 3.44Å; A127-L129 PolarHBondContact O-N 2.89Å; A127-N130 CarbonylContact O-C 3.59Å; A127-N130 WeakPolarHBondContact O-CA 3.49Å; A127-N130 WeakPolarHBondContact O-CB 3.36Å; A127-N130 PolarHBondContact O-N 3.2Å; A127-T131 PolarHBondContact O-N 3.01Å; A127-T131 PolarHBondContact O-OG1 2.9Å
128	F	63.6	Low	54.8	Low	134 Å²	134	98.7 Å²	98.7	59%	0.588	54%	0.541	S	S	*	.	H	α-helix	trans	-60.1	-28.8	175.5	72.4	-89.7	0	0	0	113.4	A125 L126 N130 T131	A125-F128 WeakPolarHBondContact O-CD1 3.41Å; A125-F128 VanDerWaalsContact O-CE1 3.28Å; A125-F128 WeakPolarHBondContact O-CE1 3.42Å; L126-F128 HydrophobicContact CD2-CE1 4.45Å; L126-F128 PolarHBondContact O-N 3.12Å; F128-N130 PolarHBondContact O-N 3.41Å; F128-T131 WeakPolarHBondContact CA-OG1 3.42Å
129	L	59	Low	53.7	Low	46 Å²	46	99.9 Å²	99.9	24%	0.241	55%	0.548	C	S	.	.	H	α-helix	trans	-67.5	-21.6	174.2	-63.9	174.5	0	0	0	112.5	L107 L126 A127	L107-L129 HydrophobicContact CD1-CD1 3.77Å; L126-L129 HydrophobicContact CD2-CD1 4.05Å; L126-L129 WeakPolarHBondContact O-CB 3.45Å; L126-L129 PolarHBondContact O-N 3.35Å; A127-L129 PolarHBondContact O-N 2.89Å
130	N	54.1	Low	52.6	Low	101 Å²	101	103 Å²	103	54%	0.54	57%	0.565	S	S	.	*	H	α-helix	trans	-102	-24	-177.5	-155.8	6.9	0	0	0	112.4	A127 F128 N132 C133	A127-N130 CarbonylContact O-C 3.59Å; A127-N130 WeakPolarHBondContact O-CA 3.49Å; A127-N130 WeakPolarHBondContact O-CB 3.36Å; A127-N130 PolarHBondContact O-N 3.2Å; F128-N130 PolarHBondContact O-N 3.41Å; N130-N132 PolarHBondContact O-N 3.12Å; N130-C133 VanDerWaalsContact O-CB 3.25Å; N130-C133 WeakPolarHBondContact O-CB 3.49Å; N130-C133 PolarHBondContact O-N 3.16Å; N130-C133 PolarHBondContact O-SG 3.42Å; N130-C133 PolarHBondContact OD1-SG 2.84Å; N130-C133 VanDerWaalsContact OD1-SG 3.4Å
131	T	50.7	Low	51.3	Low	94 Å²	94	105.4 Å²	105.4	58%	0.577	57%	0.566	S	S	*	*	H	α-helix	trans	-58.7	-31.5	179	-43	0	0	0	0	112.9	A127 F128 C133	A127-T131 PolarHBondContact O-N 3.01Å; A127-T131 PolarHBondContact O-OG1 2.9Å; F128-T131 WeakPolarHBondContact CA-OG1 3.42Å; T131-C133 PolarHBondContact O-N 2.84Å
132	N	47.2	Very low	50	Low	103 Å²	103	107.9 Å²	107.9	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-70.8	-12.2	176.7	-75.8	1.8	0	0	0	114.1	N130 Q134 T135	N130-N132 PolarHBondContact O-N 3.12Å; N132-Q134 PolarHBondContact O-N 3.41Å; N132-T135 PolarHBondContact O-OG1 2.68Å
133	C	46.8	Very low	48.9	Very low	73 Å²	73	112.3 Å²	112.3	49%	0.493	58%	0.581	S	S	.	*	H	α-helix	trans	-69.3	-29	-178.3	-65	0	0	0	0	113.4	N130 T131	N130-C133 VanDerWaalsContact O-CB 3.25Å; N130-C133 WeakPolarHBondContact O-CB 3.49Å; N130-C133 PolarHBondContact O-N 3.16Å; N130-C133 PolarHBondContact O-SG 3.42Å; N130-C133 PolarHBondContact OD1-SG 2.84Å; N130-C133 VanDerWaalsContact OD1-SG 3.4Å; T131-C133 PolarHBondContact O-N 2.84Å
134	Q	40	Very low	47.6	Very low	187 Å²	187	113.8 Å²	113.8	87%	0.874	60%	0.597	S	S	*	*	H	α-helix	trans	-91.2	-17.8	-179.1	-69.4	-165	-5	0	0	114.5	N132	N132-Q134 PolarHBondContact O-N 3.41Å
135	T	39.5	Very low	46.4	Very low	73 Å²	73	117.8 Å²	117.8	45%	0.448	61%	0.611	S	S	.	*	H	α-helix	trans	-89.9	-14.4	178.8	52.8	0	0	0	0	113.8	N132 N137 Q138	N132-T135 PolarHBondContact O-OG1 2.68Å; T135-N137 PolarHBondContact O-N 3.49Å; T135-Q138 PolarHBondContact O-N 2.84Å
136	N	39	Very low	45	Very low	109 Å²	109	117.3 Å²	117.3	58%	0.583	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-6.5	-168.9	-126.6	18	0	0	0	115.9	Q138	N136-Q138 PolarHBondContact O-N 2.7Å
137	N	39.1	Very low	44.1	Very low	165 Å²	165	122 Å²	122	88%	0.882	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	1.9	170	-111.8	0.9	0	0	0	113.7	T135	T135-N137 PolarHBondContact O-N 3.49Å
138	Q	40	Very low	43	Very low	171 Å²	171	125.1 Å²	125.1	80%	0.799	64%	0.635	S	S	*	*	S	Bend	trans	-133.4	0.6	171	-69	-163.6	-6.7	0	0	114.9	T135 N136	T135-Q138 PolarHBondContact O-N 2.84Å; N136-Q138 PolarHBondContact O-N 2.7Å
139	N	37.1	Very low	42	Very low	66 Å²	66	128 Å²	128	35%	0.353	65%	0.651	S	S	.	*			trans	-110.6	28.4	-176.1	-93.2	-49.2	0	0	0	115.2	N141 R142	N139-N141 PolarHBondContact O-N 2.86Å; N139-N141 VanDerWaalsContact O-N 3.11Å; N139-R142 PolarHBondContact O-N 2.73Å; N139-R142 VanDerWaalsContact O-N 3.1Å
140	T	40.8	Very low	41.2	Very low	116 Å²	116	128.3 Å²	128.3	71%	0.712	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-53.4	-27.2	163.5	46.7	0	0	0	0	112.5	R142 R143	T140-R142 PolarHBondContact O-N 3.37Å; T140-R142 VanDerWaalsContact O-N 3.08Å; T140-R143 PolarHBondContact O-N 3.29Å
141	N	35.7	Very low	40.5	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-71.4	12.6	175	-65.6	-43.3	0	0	0	115.5	N139	N139-N141 PolarHBondContact O-N 2.86Å; N139-N141 VanDerWaalsContact O-N 3.11Å
142	R	36.7	Very low	40	Very low	213 Å²	213	128.5 Å²	128.5	80%	0.804	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-123.8	15.5	173.2	-73	-165.3	178.4	-161.8	1.4	115.7	N139 T140	N139-R142 PolarHBondContact O-N 2.73Å; N139-R142 VanDerWaalsContact O-N 3.1Å; T140-R142 PolarHBondContact O-N 3.37Å; T140-R142 VanDerWaalsContact O-N 3.08Å
143	R	38.9	Very low	39.8	Very low	190 Å²	190	130.3 Å²	130.3	72%	0.717	68%	0.683	S	S	*	*	S	Bend	trans	-58.3	141.5	139.6	-93.5	-176.1	167.2	-175.4	-5.6	107.3	T140 L145	T140-R143 PolarHBondContact O-N 3.29Å; R143-L145 PolarHBondContact O-N 2.82Å
144	L	36.5	Very low	39.3	Very low	156 Å²	156	132.7 Å²	132.7	82%	0.817	69%	0.69	S	S	*	*			trans	-52.2	132.6	170.4	-75.6	168.8	0	0	0	108.6	T146	L144-T146 VanDerWaalsContact C-N 3.32Å; L144-T146 PolarHBondContact O-N 2.71Å; L144-T146 PolarHBondContact O-OG1 3.47Å
145	L	38.7	Very low	39.3	Very low	173 Å²	173	128.4 Å²	128.4	91%	0.906	68%	0.68	S	S	*	*			trans	-57.1	94.3	-174.4	-78.6	169.9	0	0	0	110.4	R143	R143-L145 PolarHBondContact O-N 2.82Å
146	T	37	Very low	39.4	Very low	58 Å²	58	132 Å²	132	36%	0.356	70%	0.697	S	S	.	*			trans	-121.7	126.4	179.9	41.6	0	0	0	0	105.4	R86 L144 D148	R86-T146 VanDerWaalsContact NH1-CG2 3.3Å; L144-T146 VanDerWaalsContact C-N 3.32Å; L144-T146 PolarHBondContact O-N 2.71Å; L144-T146 PolarHBondContact O-OG1 3.47Å; T146-D148 PolarHBondContact O-N 2.89Å
147	I	43.6	Very low	39.7	Very low	158 Å²	158	132.7 Å²	132.7	81%	0.81	70%	0.7	S	S	*	*			trans	-76.5	89.7	-161.3	-58.9	170.2	0	0	0	109.1	E149	I147-E149 PolarHBondContact O-N 2.76Å
148	D	39.6	Very low	39.9	Very low	110 Å²	110	129 Å²	129	59%	0.588	69%	0.687	S	S	*	*			trans	-100.5	51.9	-176.2	-160.5	12.7	0	0	0	112.6	T146 A151	T146-D148 PolarHBondContact O-N 2.89Å; D148-A151 WeakPolarHBondContact OD1-CB 3.16Å
149	E	41.9	Very low	39.9	Very low	194 Å²	194	129.5 Å²	129.5	91%	0.907	68%	0.682	S	S	*	*	S	Bend	trans	-114.9	16.9	159.3	-70	-162.5	136.4	0	0	111.5	I147	I147-E149 PolarHBondContact O-N 2.76Å
150	S	42.8	Very low	39.9	Very low	53 Å²	53	132.9 Å²	132.9	37%	0.371	70%	0.701	S	S	.	*			trans	-128.9	-1.8	-175.3	-63	0	0	0	0	115.2	S152 I153 L154	S150-S152 PolarHBondContact O-N 3.45Å; S150-I153 PolarHBondContact O-N 3.47Å; S150-L154 PolarHBondContact O-N 3.41Å
151	A	39.1	Very low	40.2	Very low	80 Å²	80	134.8 Å²	134.8	66%	0.661	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-3.8	-176.4	0	0	0	0	0	115.3	D148	D148-A151 WeakPolarHBondContact OD1-CB 3.16Å
152	S	41	Very low	40.9	Very low	118 Å²	118	134 Å²	134	83%	0.825	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	3.1	172.6	-169.7	0	0	0	0	114.2	S150	S150-S152 PolarHBondContact O-N 3.45Å
153	I	41.8	Very low	41.1	Very low	142 Å²	142	130.9 Å²	130.9	73%	0.728	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	-18.8	-178.9	-53.4	-178.4	0	0	0	112	S150 S155	S150-I153 PolarHBondContact O-N 3.47Å; I153-S155 VanDerWaalsContact C-N 3.28Å; I153-S155 PolarHBondContact O-N 2.85Å
154	L	37.5	Very low	41.4	Very low	122 Å²	122	128.9 Å²	128.9	64%	0.639	70%	0.702	S	S	*	*			trans	-89.1	50.6	175.1	-63.8	179.6	0	0	0	113.5	S150 I157	S150-L154 PolarHBondContact O-N 3.41Å; L154-I157 HydrophobicContact CD2-CD1 3.99Å
155	S	39.9	Very low	41.9	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	70%	0.697	S	S	*	*			trans	-82.1	148.3	151.2	-62.9	0	0	0	0	109.2	I153	I153-S155 VanDerWaalsContact C-N 3.28Å; I153-S155 PolarHBondContact O-N 2.85Å
156	D	40.7	Very low	41.9	Very low	149 Å²	149	125 Å²	125	80%	0.797	69%	0.689	S	S	*	*			trans	62.6	40.5	171.5	-54.7	-15.8	0	0	0	117.9	S158	D156-S158 PolarHBondContact O-N 3.03Å
157	I	46	Very low	42.1	Very low	124 Å²	124	129.7 Å²	129.7	64%	0.636	71%	0.712	S	S	*	*	S	Bend	trans	-89.5	59	140.8	-50.3	-175.8	0	0	0	108.5	L154	L154-I157 HydrophobicContact CD2-CD1 3.99Å
158	S	42.5	Very low	41.8	Very low	88 Å²	88	132.3 Å²	132.3	62%	0.615	71%	0.712	S	S	*	*	S	Bend	trans	-165.8	112.3	175.6	174.6	0	0	0	0	109.9	D156	D156-S158 PolarHBondContact O-N 3.03Å
159	Y	41.2	Very low	41.5	Very low	180 Å²	180	134.6 Å²	134.6	71%	0.706	73%	0.725	S	S	*	*			trans	61.5	87	170.1	-99.8	-126	0	0	0	116.5	K161	Y159-K161 HydrophobicContact CD1-CB 4.31Å; Y159-K161 HydrophobicContact CD1-CD 4.26Å; Y159-K161 HydrophobicContact CE1-CB 4.48Å; Y159-K161 HydrophobicContact CE1-CD 3.61Å; Y159-K161 HydrophobicContact CE1-CG 4.43Å; Y159-K161 PolarHBondContact OH-NZ 3.01Å
160	D	37.2	Very low	41.1	Very low	138 Å²	138	129.6 Å²	129.6	74%	0.738	71%	0.711	S	S	*	*				-96.5	149.3	123.7	-160.1	-10	0	0	0	108.3	T162	D160-T162 PolarHBondContact OD1-N 3.12Å; D160-T162 PolarHBondContact OD1-OG1 2.9Å
161	K	45.1	Very low	40.7	Very low	155 Å²	155	131.8 Å²	131.8	67%	0.674	73%	0.726	S	S	*	*			trans	-141.9	43.8	-175.1	-149	-175.4	-164.7	169.7	0	112	Y159	Y159-K161 HydrophobicContact CD1-CB 4.31Å; Y159-K161 HydrophobicContact CD1-CD 4.26Å; Y159-K161 HydrophobicContact CE1-CB 4.48Å; Y159-K161 HydrophobicContact CE1-CD 3.61Å; Y159-K161 HydrophobicContact CE1-CG 4.43Å; Y159-K161 PolarHBondContact OH-NZ 3.01Å
162	T	51.5	Low	40.3	Very low	115 Å²	115	134.7 Å²	134.7	71%	0.706	73%	0.731	S	S	*	*			trans	-128	27.2	-177.9	61.5	0	0	0	0	114.8	D160	D160-T162 PolarHBondContact OD1-N 3.12Å; D160-T162 PolarHBondContact OD1-OG1 2.9Å
163	D	40.8	Very low	39.8	Very low	149 Å²	149	136.4 Å²	136.4	80%	0.797	73%	0.729	S	S	*	*			trans	-141.3	62.7	175.7	-163.2	27.6	0	0	0	113.7
164	D	45.8	Very low	39.2	Very low	148 Å²	148	141 Å²	141	79%	0.791	74%	0.737	S	S	*	*	S	Bend	trans	-147.3	63.2	160.2	-85.2	-48	0	0	0	107.2	K73	K73-D164 IonicContact NZ-OD1 3.84Å
165	S	46.3	Very low	39.1	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	74%	0.744	S	S	*	*			trans	160.7	97.2	158.1	179.1	0	0	0	0	112.8
166	I	38.8	Very low	38.6	Very low	144 Å²	144	143.1 Å²	143.1	74%	0.738	75%	0.751	S	S	*	*			trans	-147.9	94.6	134.7	-77.4	113.7	0	0	0	106.1	W168	I166-W168 HydrophobicContact CG2-CG 4.43Å
167	D	40.4	Very low	38.3	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	76%	0.757	S	S	*	*			trans	-79.1	126.7	154.6	-77.6	-54.8	0	0	0	107.3	D169	D167-D169 VanDerWaalsContact C-N 3.3Å; D167-D169 PolarHBondContact O-N 2.74Å
168	W	37.8	Very low	37.6	Very low	213 Å²	213	149.2 Å²	149.2	81%	0.807	77%	0.766	S	S	*	*			trans	-88.2	62.5	-166.2	-138.4	119.3	0	0	0	112.2	I166 S170	I166-W168 HydrophobicContact CG2-CG 4.43Å; W168-S170 WeakPolarHBondContact CZ3-OG 3.35Å
169	D	32.6	Very low	36.9	Very low	159 Å²	159	154.1 Å²	154.1	85%	0.85	78%	0.776	S	S	*	*			trans	-85	125.5	-176.4	-133.1	-14.2	0	0	0	112.3	D167	D167-D169 VanDerWaalsContact C-N 3.3Å; D167-D169 PolarHBondContact O-N 2.74Å
170	S	34.3	Very low	36.6	Very low	89 Å²	89	155.6 Å²	155.6	62%	0.622	79%	0.786	S	S	*	*			trans	-102.9	85.4	-162.5	-68.7	0	0	0	0	114	W168	W168-S170 WeakPolarHBondContact CZ3-OG 3.35Å
171	S	33.9	Very low	36.1	Very low	99 Å²	99	159.2 Å²	159.2	69%	0.692	79%	0.789	S	S	*	*			trans	-162	154.4	158.3	64.9	0	0	0	0	116.5
172	N	31.3	Very low	35.3	Very low	140 Å²	140	158.7 Å²	158.7	75%	0.749	79%	0.789	S	S	*	*			trans	67.3	82.9	151.3	-59.6	-31.7	0	0	0	121.8
173	I	30.7	Very low	34.3	Very low	154 Å²	154	163.1 Å²	163.1	79%	0.79	80%	0.799	S	S	*	*				27.5	101.9	123.7	-54.6	165.7	0	0	0	118
174	R	29.5	Very low	33.6	Very low	239 Å²	239	167.7 Å²	167.7	90%	0.902	81%	0.805	S	S	*	*				179.7	168.2	116.4	-109.5	150.8	-170.9	-167	2.9	115.6
175	T	34.1	Very low	32.9	Very low	129 Å²	129	172.9 Å²	172.9	79%	0.791	81%	0.813	S	S	*	*			trans	-90.3	136.2	-173.4	52.2	0	0	0	0	115
176	V	29.3	Very low	32	Very low	135 Å²	135	173.5 Å²	173.5	82%	0.818	82%	0.818	S	S	*	*			trans	-146.7	142.6	149.4	171.5	0	0	0	0	110.2	L178	V176-L178 HydrophobicContact CG1-CG 4.49Å
177	R	35.5	Very low	31.6	Very low	242 Å²	242	172 Å²	172	91%	0.913	82%	0.82	S	S	*	*			trans	-97.2	133.6	167.1	-71.9	172.9	168.1	155.5	-5.5	110.2
178	L	30.5	Very low	31.2	Very low	158 Å²	158	173.7 Å²	173.7	83%	0.827	82%	0.815	S	S	*	*			trans	-134.6	129	163.9	-94.3	174.8	0	0	0	115.9	V176	V176-L178 HydrophobicContact CG1-CG 4.49Å
179	K	28.9	Very low	30.8	Very low	192 Å²	192	171.6 Å²	171.6	84%	0.835	82%	0.819	S	S	*	*			trans	-28.5	130.7	178.2	-66.7	164.1	178.5	172.5	0	119.3
180	K	33.8	Very low	30.7	Very low	211 Å²	211	169.7 Å²	169.7	92%	0.917	81%	0.809	S	S	*	*			trans	-60.9	141.3	150.1	176.6	177.8	-176.5	173.1	0	111.4
181	R	26.8	Very low	30.5	Very low	213 Å²	213	173.6 Å²	173.6	80%	0.804	82%	0.821	S	S	*	*			trans	-138.9	161.7	163.4	-167.2	158.2	-168.3	-172.7	2.8	112.9
182	E	29.5	Very low	30.2	Very low	144 Å²	144	176.9 Å²	176.9	67%	0.673	83%	0.83	S	S	*	*			trans	-78.9	161.4	-159.8	-50.4	127.4	115.2	0	0	116.5
183	K	29.2	Very low	30.2	Very low	208 Å²	208	173.3 Å²	173.3	90%	0.904	83%	0.826	S	S	*	*			trans	-56.6	148.4	160.9	-60.3	176.6	176.9	-177.8	0	111.1
184	R	26.7	Very low	30.5	Very low	246 Å²	246	172.3 Å²	172.3	93%	0.928	83%	0.83	S	S	*	*			trans	-114.4	138.6	158.8	-82.4	-176	165.2	-174.9	-5.4	110.4
185	R	30.2	Very low	31.3	Very low	256 Å²	256	166.2 Å²	166.2	97%	0.966	82%	0.821	S	S	*	*			trans	-109	137.5	162.3	-92.9	-177.2	167.7	178	-4.7	108.7
186	S	27.7	Very low	31	Very low	116 Å²	116	166.8 Å²	166.8	81%	0.811	83%	0.825	S	S	*	*			trans	-171.6	140.8	159.7	-168.2	0	0	0	0	104.1
187	S	31.5	Very low	31	Very low	111 Å²	111	164.5 Å²	164.5	78%	0.776	82%	0.82	S	S	*	*			cis	-154.4	177.7	34.7	46.7	0	0	0	0	109.9
188	R	31.9	Very low	30.8	Very low	194 Å²	194	157.5 Å²	157.5	73%	0.732	81%	0.808	S	S	*	*			cis	-170.1	147.3	-32.9	175.5	175.6	85.7	159.1	9.1	106.8	L190	R188-L190 HydrophobicContact CG-CD1 3.88Å; R188-L190 VanDerWaalsContact CZ-CD1 3.49Å
189	N	29.3	Very low	30.7	Very low	169 Å²	169	159.1 Å²	159.1	90%	0.904	81%	0.809	S	S	*	*			trans	-140.1	162.5	153.3	-98.2	-24.2	0	0	0	109.3
190	L	31	Very low	30.7	Very low	119 Å²	119	161.5 Å²	161.5	62%	0.623	81%	0.812	S	S	*	*			trans	-118.6	158.2	-168.3	-107	70	0	0	0	112.6	R188	R188-L190 HydrophobicContact CG-CD1 3.88Å; R188-L190 VanDerWaalsContact CZ-CD1 3.49Å
191	I	28.9	Very low	30.2	Very low	171 Å²	171	156.7 Å²	156.7	88%	0.877	81%	0.806	S	S	*	*			trans	-167.8	162.8	135.8	-101	156.2	0	0	0	109.4
192	D	28.4	Very low	30.3	Very low	167 Å²	167	158.1 Å²	158.1	89%	0.893	81%	0.811	S	S	*	*			trans	-80.4	164.1	-160.2	-92.4	-64	0	0	0	118.5
193	G	30.2	Very low	30.1	Very low	65 Å²	65	155.4 Å²	155.4	67%	0.67	81%	0.808	S	S	*	*			trans	168.2	123.5	169.1	0	0	0	0	0	114.9
194	P	37.9	Very low	30	Very low	133 Å²	133	152.1 Å²	152.1	86%	0.864	81%	0.805	S	S	*	*			trans	-92.7	175.2	-171.9	36.7	-35.5	0	0	0	115.5
195	P	46.6	Very low	30	Very low	111 Å²	111	144.3 Å²	144.3	72%	0.721	80%	0.801	S	S	*	*			trans	-122.5	177.5	-141.9	43.2	-34.2	0	0	0	117.4
196	T	27.8	Very low	29.9	Very low	142 Å²	142	143.8 Å²	143.8	87%	0.871	80%	0.799	S	S	*	*			trans	172.9	172.2	131.8	32.3	0	0	0	0	115.2
197	A	29.4	Very low	29.9	Very low	87 Å²	87	144.5 Å²	144.5	72%	0.719	80%	0.799	S	S	*	*			trans	80.7	55.4	148.3	0	0	0	0	0	123.7
198	S	30.1	Very low	29.8	Very low	94 Å²	94	144.1 Å²	144.1	66%	0.657	80%	0.796	S	S	*	*				30.4	136.2	128.6	70	0	0	0	0	125.3
199	K	28.1	Very low	29.7	Very low	192 Å²	192	144.2 Å²	144.2	84%	0.835	81%	0.805	S	S	*	*			trans	73.6	154.6	150	-63.3	157.8	-175.4	168.4	0	116.1
200	R	28.8	Very low	29.8	Very low	242 Å²	242	148 Å²	148	91%	0.913	81%	0.807	S	S	*	*			cis	-151.5	170.2	10	-139	169.7	-172.6	172	0.3	111.1
201	S	25.2	Very low	29.8	Very low	111 Å²	111	146 Å²	146	78%	0.776	81%	0.814	S	S	*	*			trans	-99.9	151.8	-168.4	-25.1	0	0	0	0	116.6
202	R	27.4	Very low	30.1	Very low	243 Å²	243	143.8 Å²	143.8	92%	0.917	81%	0.814	S	S	*	*			trans	164.6	155.8	143.7	-93.5	164.8	-178.9	-176.3	-0.1	109.8
203	S	26.7	Very low	30.5	Very low	87 Å²	87	143.2 Å²	143.2	61%	0.608	81%	0.806	S	S	*	*			cis	-169.1	167.4	-23.9	51.1	0	0	0	0	111
204	T	25.6	Very low	31.1	Very low	139 Å²	139	146.3 Å²	146.3	85%	0.853	81%	0.812	S	S	*	*			trans	56.6	117.4	152	44.7	0	0	0	0	120.9
205	G	26.3	Very low	31.5	Very low	81 Å²	81	145.6 Å²	145.6	84%	0.835	80%	0.8	S	S	*	*			trans	178	124.2	161.5	0	0	0	0	0	114.1
206	R	28.2	Very low	31.8	Very low	245 Å²	245	144.2 Å²	144.2	93%	0.925	79%	0.79	S	S	*	*			trans	-102.2	162.2	155.5	-71.9	172.6	149.9	-171.4	-7.1	106
207	T	27.9	Very low	32.8	Very low	131 Å²	131	141.9 Å²	141.9	80%	0.804	78%	0.775	S	S	*	*			cis	-153.3	175.3	41.4	38.5	0	0	0	0	113.4
208	S	29.7	Very low	33.8	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	76%	0.763	S	S	*	*			trans	-26.7	139.4	157.5	176	0	0	0	0	116.7
209	E	29.5	Very low	35.5	Very low	196 Å²	196	142.4 Å²	142.4	92%	0.916	76%	0.757	S	S	*	*				-162.9	-179.1	111.1	-116.6	-176.4	159.4	0	0	115.7
210	R	32.2	Very low	37.3	Very low	249 Å²	249	137.5 Å²	137.5	94%	0.94	74%	0.743	S	S	*	*			trans	-135.8	95.4	-170.4	-177.3	-160.3	-153.1	-141.5	8.7	110.2
211	G	30.7	Very low	39.1	Very low	75 Å²	75	130 Å²	130	77%	0.773	72%	0.724	S	S	*	*			trans	-160.9	142.1	175.9	0	0	0	0	0	111.1
212	S	35.8	Very low	41.2	Very low	125 Å²	125	128.5 Å²	128.5	87%	0.874	71%	0.71	S	S	*	*			trans	-107	104.8	178.7	54.4	0	0	0	0	110
213	E	37.2	Very low	43.6	Very low	156 Å²	156	122 Å²	122	73%	0.729	70%	0.697	S	S	*	*			trans	-105.7	140	175.9	-61.9	-172.9	166.1	0	0	110.8
214	T	42.1	Very low	45.6	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	69%	0.687	S	S	*	*			trans	-93.8	106.2	175.3	49.7	0	0	0	0	110.2
215	L	46.6	Very low	47.3	Very low	118 Å²	118	119.1 Å²	119.1	62%	0.618	69%	0.687	S	S	*	*			trans	-73.8	136.9	177.7	-70.7	151.8	0	0	0	111.4	I236 T238	L215-I236 HydrophobicContact CD2-CG2 3.68Å; L215-T238 HydrophobicContact CD2-CG2 3.97Å
216	V	51.9	Low	49.1	Very low	83 Å²	83	123 Å²	123	50%	0.503	69%	0.689	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.8	126.1	167.1	-179.5	0	0	0	0	109.1	E237	V216-E237 PolarHBondContact O-N 2.87Å; V216-E237 VanDerWaalsContact O-N 3.11Å
217	T	49.5	Very low	50.7	Low	92 Å²	92	115 Å²	115	56%	0.564	68%	0.682	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.8	133.9	179.5	57.4	0	0	0	0	110.5	T235 I236	T217-T235 WeakPolarHBondContact CA-O 3.35Å; T217-I236 HydrophobicContact CG2-CD1 4.2Å; T217-I236 HydrophobicContact CG2-CG1 3.99Å; T217-I236 HydrophobicContact CG2-CG2 4.22Å
218	K	51.2	Low	52.7	Low	107 Å²	107	110.1 Å²	110.1	47%	0.465	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	121.2	174.4	-66.4	168	-174.6	156.7	0	109	S234 T235 E237	K218-S234 CarbonylContact O-C 3.56Å; K218-S234 WeakPolarHBondContact O-CA 3.44Å; K218-T235 PolarHBondContact N-O 2.88Å; K218-T235 PolarHBondContact O-N 3.4Å; K218-E237 IonicContact NZ-OE2 2.69Å; K218-E237 PolarHBondContact NZ-OE2 3.45Å
219	T	64.4	Low	54.2	Low	85 Å²	85	110.6 Å²	110.6	52%	0.521	66%	0.659	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	121.6	174.6	-56.4	0	0	0	0	109.6	V221 S234	T219-V221 HydrophobicContact CG2-CG2 4.21Å; T219-S234 WeakPolarHBondContact CG2-OG 3.17Å; T219-S234 PolarHBondContact OG1-OG 3.38Å
220	T	65.6	Low	55.9	Low	89 Å²	89	105.3 Å²	105.3	55%	0.546	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.3	129.3	178.4	-42.9	0	0	0	0	108.1	A232 V233	T220-A232 CarbonylContact O-C 3.56Å; T220-A232 WeakPolarHBondContact O-CA 3.41Å; T220-V233 PolarHBondContact N-O 2.89Å; T220-V233 PolarHBondContact O-N 3.03Å
221	V	66.8	Low	57.1	Low	85 Å²	85	99.7 Å²	99.7	52%	0.515	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119	122.7	-175.4	-173.7	0	0	0	0	109.6	T219 V230 A232	T219-V221 HydrophobicContact CG2-CG2 4.21Å; V221-V230 HydrophobicContact CG1-CG1 3.38Å; V221-A232 HydrophobicContact CG1-CB 4.38Å; V221-A232 HydrophobicContact CG2-CB 3.95Å
222	T	70.3	Confident	58.5	Low	80 Å²	80	99.2 Å²	99.2	49%	0.491	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112	116.4	-179.1	35.7	0	0	0	0	110.4	E231	T222-E231 PolarHBondContact N-O 2.93Å; T222-E231 PolarHBondContact O-N 3.28Å; T222-E231 VanDerWaalsContact O-N 3.15Å; T222-E231 PolarHBondContact OG1-O 3.44Å
223	V	77.2	Confident	59.8	Low	106 Å²	106	97.3 Å²	97.3	64%	0.642	60%	0.596	S	S	*	*			trans	-103.3	112.9	178.2	-179.6	0	0	0	0	108.8	V230	V223-V230 HydrophobicContact CB-CG2 4.39Å; V223-V230 HydrophobicContact CG1-CG2 4.15Å; V223-V230 HydrophobicContact CG2-CG1 3.79Å; V223-V230 HydrophobicContact CG2-CG2 3.94Å
224	P	68.3	Low	60.6	Low	62 Å²	62	93.4 Å²	93.4	40%	0.403	59%	0.586	S	S	.	*			trans	-70.3	131.2	175.2	-17.9	32.1	0	0	0	111.2	N226 G227	P224-N226 PolarHBondContact O-N 3.32Å; P224-G227 PolarHBondContact O-N 3.01Å
225	A	62	Low	61.3	Low	103 Å²	103	90.4 Å²	90.4	85%	0.851	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-19.1	-177.7	0	0	0	0	0	114.5	G227	A225-G227 VanDerWaalsContact C-N 3.33Å; A225-G227 PolarHBondContact O-N 3.35Å
226	N	63.3	Low	61.7	Low	164 Å²	164	90.1 Å²	90.1	88%	0.877	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	20.5	-176.5	-62.1	1.8	0	0	0	113.5	P224 G228	P224-N226 PolarHBondContact O-N 3.32Å; N226-G228 VanDerWaalsContact C-N 3.31Å; N226-G228 PolarHBondContact O-N 2.98Å
227	G	62.5	Low	61.4	Low	75 Å²	75	90.5 Å²	90.5	77%	0.773	56%	0.562	S	S	*	*	S	Bend	trans	72.8	17	175	0	0	0	0	0	115.5	P224 A225	P224-G227 PolarHBondContact O-N 3.01Å; A225-G227 VanDerWaalsContact C-N 3.33Å; A225-G227 PolarHBondContact O-N 3.35Å
228	G	70	Confident	61.7	Low	30 Å²	30	90.3 Å²	90.3	31%	0.309	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-70	168	172.2	0	0	0	0	0	112.8	N226	N226-G228 VanDerWaalsContact C-N 3.31Å; N226-G228 PolarHBondContact O-N 2.98Å
229	P	60.6	Low	61.2	Low	114 Å²	114	91 Å²	91	74%	0.74	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-58.8	142.9	176.6	26.3	-34.4	0	0	0	111.4
230	V	65.1	Low	59.8	Low	84 Å²	84	92.1 Å²	92.1	51%	0.509	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-81.9	123.2	179.8	178.6	0	0	0	0	109.5	V221 V223	V221-V230 HydrophobicContact CG1-CG1 3.38Å; V223-V230 HydrophobicContact CB-CG2 4.39Å; V223-V230 HydrophobicContact CG1-CG2 4.15Å; V223-V230 HydrophobicContact CG2-CG1 3.79Å; V223-V230 HydrophobicContact CG2-CG2 3.94Å
231	E	58	Low	58.1	Low	131 Å²	131	97.4 Å²	97.4	61%	0.612	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97	135.3	176.1	-64.9	-166.4	152.3	0	0	110.8	T222	T222-E231 PolarHBondContact N-O 2.93Å; T222-E231 PolarHBondContact O-N 3.28Å; T222-E231 VanDerWaalsContact O-N 3.15Å; T222-E231 PolarHBondContact OG1-O 3.44Å
232	A	59.8	Low	56.3	Low	65 Å²	65	103.9 Å²	103.9	54%	0.537	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	113.1	179.9	0	0	0	0	0	109.7	T220 V221	T220-A232 CarbonylContact O-C 3.56Å; T220-A232 WeakPolarHBondContact O-CA 3.41Å; V221-A232 HydrophobicContact CG1-CB 4.38Å; V221-A232 HydrophobicContact CG2-CB 3.95Å
233	V	62.9	Low	54.4	Low	85 Å²	85	105.5 Å²	105.5	52%	0.515	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	123.1	-177.4	-177.3	0	0	0	0	109.3	T220	T220-V233 PolarHBondContact N-O 2.89Å; T220-V233 PolarHBondContact O-N 3.03Å
234	S	55.3	Low	51.9	Low	74 Å²	74	112 Å²	112	52%	0.517	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.3	118.6	177	-64.4	0	0	0	0	110.5	K218 T219	K218-S234 CarbonylContact O-C 3.56Å; K218-S234 WeakPolarHBondContact O-CA 3.44Å; T219-S234 WeakPolarHBondContact CG2-OG 3.17Å; T219-S234 PolarHBondContact OG1-OG 3.38Å
235	T	55.3	Low	50	Low	67 Å²	67	113.2 Å²	113.2	41%	0.411	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.2	150.2	170.7	56.4	0	0	0	0	110.8	T217 K218	T217-T235 WeakPolarHBondContact CA-O 3.35Å; K218-T235 PolarHBondContact N-O 2.88Å; K218-T235 PolarHBondContact O-N 3.4Å
236	I	56.8	Low	48.3	Very low	112 Å²	112	118.1 Å²	118.1	57%	0.574	64%	0.638	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-130.1	121.9	-178.6	-49.1	-171.2	0	0	0	107.3	L215 T217	L215-I236 HydrophobicContact CD2-CG2 3.68Å; T217-I236 HydrophobicContact CG2-CD1 4.2Å; T217-I236 HydrophobicContact CG2-CG1 3.99Å; T217-I236 HydrophobicContact CG2-CG2 4.22Å
237	E	44.9	Very low	46.6	Very low	91 Å²	91	120.1 Å²	120.1	43%	0.425	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124	131.4	-176.4	-65.6	175.7	140.4	0	0	109.7	V216 K218	V216-E237 PolarHBondContact O-N 2.87Å; V216-E237 VanDerWaalsContact O-N 3.11Å; K218-E237 IonicContact NZ-OE2 2.69Å; K218-E237 PolarHBondContact NZ-OE2 3.45Å
238	T	54.9	Low	44.9	Very low	88 Å²	88	125.6 Å²	125.6	54%	0.54	64%	0.636	S	S	.	*			trans	-101.9	125.6	169.7	46.8	0	0	0	0	109.2	L215	L215-T238 HydrophobicContact CD2-CG2 3.97Å
239	V	40.5	Very low	42.8	Very low	122 Å²	122	131.3 Å²	131.3	74%	0.739	67%	0.665	S	S	*	*			trans	-122.9	115.4	-173.9	-174.1	0	0	0	0	109.6
240	P	35	Very low	41.1	Very low	107 Å²	107	130.8 Å²	130.8	70%	0.695	67%	0.67	S	S	*	*			trans	-80.3	123.5	-178.1	30.5	-33.3	0	0	0	111.9
241	Y	30.9	Very low	39.2	Very low	200 Å²	200	131.4 Å²	131.4	78%	0.784	68%	0.684	S	S	*	*			trans	-86	131.3	170.4	160.9	-104.1	0	0	0	111.5	T243	Y241-T243 WeakPolarHBondContact CE2-OG1 3.22Å; Y241-T243 PolarHBondContact OH-OG1 3.04Å
242	W	29.5	Very low	37.6	Very low	222 Å²	222	133.1 Å²	133.1	84%	0.841	69%	0.694	S	S	*	*			trans	-130.7	141.7	172.8	-82.7	68.2	0	0	0	109.8
243	T	29.3	Very low	35.8	Very low	113 Å²	113	136.3 Å²	136.3	69%	0.693	70%	0.698	S	S	*	*			trans	-169.6	123	143.2	8.3	0	0	0	0	115.7	Y241	Y241-T243 WeakPolarHBondContact CE2-OG1 3.22Å; Y241-T243 PolarHBondContact OH-OG1 3.04Å
244	R	26	Very low	34	Very low	243 Å²	243	142.7 Å²	142.7	92%	0.917	71%	0.713	S	S	*	*			trans	-167.3	148.2	152.4	-111.7	-171.6	173.9	-171	-0.4	105.2
245	S	28.1	Very low	32.5	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	72%	0.724	S	S	*	*			cis	-166.2	153.5	2.3	-172	0	0	0	0	110.1
246	R	26.8	Very low	31.1	Very low	206 Å²	206	147 Å²	147	78%	0.777	73%	0.734	S	S	*	*			trans	67.2	163	165.5	-73.3	173.4	170.2	-178.2	-1.3	115.6
247	R	26.7	Very low	29.5	Very low	206 Å²	206	150.4 Å²	150.4	78%	0.777	75%	0.748	S	S	*	*			cis	-154.2	172.6	3.2	-132.8	168.5	-171	-179.1	0.4	111.8
248	K	26.8	Very low	28.7	Very low	190 Å²	190	151 Å²	151	83%	0.826	76%	0.762	S	S	*	*			trans	-31.9	147.4	171.8	-62.7	179.1	168.6	-170.2	0	118.5
249	T	25.3	Very low	27.4	Very low	151 Å²	151	152.5 Å²	152.5	93%	0.926	77%	0.771	S	S	*	*				-164.2	-176.8	115.3	20.8	0	0	0	0	110.8
250	A	25.3	Very low	26.7	Very low	102 Å²	102	155.5 Å²	155.5	84%	0.843	77%	0.774	S	S	*	*			trans	-153.4	177.3	-168.2	0	0	0	0	0	114.8
251	A	25.6	Very low	26.3	Very low	97 Å²	97	155 Å²	155	80%	0.802	77%	0.773	S	S	*	*			trans	95.1	160.1	160.5	0	0	0	0	0	120.2
252	M	23.9	Very low	26.1	Very low	167 Å²	167	152.9 Å²	152.9	82%	0.823	77%	0.771	S	S	*	*			trans	75.2	141.7	177.9	-63.7	179	106	0	0	118.7
253	E	23.1	Very low	26	Very low	132 Å²	132	149 Å²	149	62%	0.617	77%	0.766	S	S	*	*			cis	-164.9	127.3	-26.3	-159.7	150.2	-140.7	0	0	113.1
254	W	24.8	Very low	26	Very low	220 Å²	220	148.6 Å²	148.6	83%	0.833	76%	0.764	S	S	*	*			trans	60.2	167.6	156.4	-66.6	30.4	0	0	0	117
255	D	22.6	Very low	26.1	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	76%	0.758	S	S	*	*			cis	-142.1	-158.2	19.8	-155	-11.7	0	0	0	113.8
256	S	26.4	Very low	26.1	Very low	91 Å²	91	150.3 Å²	150.3	64%	0.636	77%	0.767	S	S	*	*			trans	-121.8	-170.5	-143.1	-50.9	0	0	0	0	117.7
257	E	23.4	Very low	26.2	Very low	185 Å²	185	144.5 Å²	144.5	86%	0.864	76%	0.763	S	S	*	*			trans	83.4	117.7	174.7	-52.3	-154.2	123.2	0	0	116.8
258	S	28	Very low	26.9	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	76%	0.759	S	S	*	*				77.8	127.4	72.6	-151.9	0	0	0	0	111.8
259	V	27.4	Very low	26.8	Very low	120 Å²	120	139 Å²	139	73%	0.727	76%	0.758	S	S	*	*				-152.4	153.8	50.4	167.2	0	0	0	0	113.1
260	K	25.4	Very low	27	Very low	184 Å²	184	139 Å²	139	80%	0.8	75%	0.747	S	S	*	*			trans	-11.5	159.5	153.3	-46.7	174	-174.3	175.9	0	118.7
261	S	27	Very low	27.7	Very low	97 Å²	97	140 Å²	140	68%	0.678	75%	0.746	S	S	*	*			cis	-161.3	142.7	42.8	-65.1	0	0	0	0	116.6
262	E	26.9	Very low	27.9	Very low	156 Å²	156	141.9 Å²	141.9	73%	0.729	74%	0.742	S	S	*	*				52.7	123.6	129.2	-54.3	-149.4	88.6	0	0	122.3
263	N	28.1	Very low	28	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	74%	0.736	S	S	*	*				74.7	155.6	77.4	-52.6	-39.3	0	0	0	113.6
264	V	29	Very low	28.3	Very low	106 Å²	106	137.7 Å²	137.7	64%	0.642	74%	0.743	S	S	*	*			cis	-150.3	140.9	17.7	-162.9	0	0	0	0	107.9
265	F	28.4	Very low	28.5	Very low	181 Å²	181	134.2 Å²	134.2	79%	0.794	74%	0.741	S	S	*	*				157.3	153.8	100.2	-89.1	-86	0	0	0	107.8
266	K	26.7	Very low	28.7	Very low	184 Å²	184	136 Å²	136	80%	0.8	74%	0.742	S	S	*	*			cis	-167.2	148.4	-33.5	-164.1	173.5	-177.9	-179.4	0	108.3
267	A	29.5	Very low	28.9	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	75%	0.753	S	S	*	*			trans	-94.2	-156.7	173.6	0	0	0	0	0	110.2
268	P	40.8	Very low	29.1	Very low	106 Å²	106	136 Å²	136	69%	0.688	75%	0.75	S	S	*	*			cis	-127.2	-156	17.5	37.5	-13.1	0	0	0	112.1
269	E	25.6	Very low	29.3	Very low	174 Å²	174	136.8 Å²	136.8	81%	0.813	75%	0.753	S	S	*	*			cis	-154	-163.1	12	-150.9	150.8	-86.8	0	0	114.1
270	H	28.3	Very low	29.3	Very low	150 Å²	150	136.5 Å²	136.5	69%	0.694	76%	0.756	S	S	*	*			trans	-94.8	-172.5	-165.1	-89	-79.5	0	0	0	114.7	D272	H270-D272 IonicContact CE1-OD2 2.69Å; H270-D272 PolarHBondContact CE1-OD2 3.17Å; H270-D272 VanDerWaalsContact CE1-OD2 3.3Å; H270-D272 IonicContact ND1-OD2 2.66Å; H270-D272 PolarHBondContact ND1-OD2 3.43Å
271	P	41.8	Very low	29.9	Very low	124 Å²	124	133.8 Å²	133.8	81%	0.805	76%	0.755	S	S	*	*			cis	-127.7	167.5	9.6	42	-26.6	0	0	0	118.4
272	D	29.2	Very low	30.5	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	76%	0.756	S	S	*	*			trans	-80.3	160.9	-179.1	-56	-99.5	0	0	0	113.8	H270	H270-D272 IonicContact CE1-OD2 2.69Å; H270-D272 PolarHBondContact CE1-OD2 3.17Å; H270-D272 VanDerWaalsContact CE1-OD2 3.3Å; H270-D272 IonicContact ND1-OD2 2.66Å; H270-D272 PolarHBondContact ND1-OD2 3.43Å
273	G	25.8	Very low	31	Very low	68 Å²	68	135.8 Å²	135.8	70%	0.701	76%	0.763	S	S	*	*			trans	-139.6	94.5	170.4	0	0	0	0	0	110.5
274	D	29.8	Very low	31.3	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	75%	0.75	S	S	*	*			trans	-61.9	131.3	-174.9	-163.6	3	0	0	0	111.8
275	N	28.1	Very low	31.4	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	76%	0.763	S	S	*	*			trans	-147.2	98.4	175.8	-96.6	-67.4	0	0	0	110.2	A277	N275-A277 PolarHBondContact O-N 3.49Å
276	K	27.8	Very low	32	Very low	178 Å²	178	132.7 Å²	132.7	77%	0.774	77%	0.766	S	S	*	*			trans	-64.3	120.6	170.6	-67.2	173.8	-177.4	170.3	0	109.3	E278	K276-E278 PolarHBondContact O-N 3.42Å
277	A	29.6	Very low	33.2	Very low	105 Å²	105	126 Å²	126	87%	0.868	75%	0.749	S	S	*	*			trans	-73.7	92.6	173.7	0	0	0	0	0	110.4	N275	N275-A277 PolarHBondContact O-N 3.49Å
278	E	27.4	Very low	35	Very low	170 Å²	170	127.1 Å²	127.1	79%	0.794	74%	0.742	S	S	*	*			trans	-65.7	139	164.2	-67	-164.7	147.8	0	0	110.3	K276 S280	K276-E278 PolarHBondContact O-N 3.42Å; E278-S280 PolarHBondContact O-N 3.19Å
279	P	31.9	Very low	36.9	Very low	120 Å²	120	127.8 Å²	127.8	78%	0.779	73%	0.731	S	S	*	*			trans	-72.9	96.3	173.2	30.1	-32.8	0	0	0	109.4	T281	P279-T281 PolarHBondContact O-N 3.3Å
280	S	29.1	Very low	39.8	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	72%	0.723	S	S	*	*			trans	-57	105.9	-175.3	59.5	0	0	0	0	113.1	E278 P282	E278-S280 PolarHBondContact O-N 3.19Å; S280-P282 WeakPolarHBondContact O-CD 3.27Å
281	T	36.1	Very low	42.7	Very low	127 Å²	127	119.1 Å²	119.1	78%	0.779	69%	0.694	S	S	*	*			trans	-73.4	120.5	-179.8	-33.3	0	0	0	0	111.4	P279 Q283	P279-T281 PolarHBondContact O-N 3.3Å; T281-Q283 PolarHBondContact O-N 2.82Å; T281-Q283 VanDerWaalsContact O-N 3.16Å
282	P	41.6	Very low	45.1	Very low	108 Å²	108	117.4 Å²	117.4	70%	0.701	68%	0.675	S	S	*	*			trans	-83.9	91.5	179.4	32.8	-33.3	0	0	0	111.5	S280 S284	S280-P282 WeakPolarHBondContact O-CD 3.27Å; P282-S284 PolarHBondContact O-N 3.35Å
283	Q	36.8	Very low	48.1	Very low	187 Å²	187	112.5 Å²	112.5	87%	0.874	65%	0.647	S	S	*	*			trans	-61.9	122	165.4	-73.5	-175.1	-17.8	0	0	110	T281	T281-Q283 PolarHBondContact O-N 2.82Å; T281-Q283 VanDerWaalsContact O-N 3.16Å
284	S	33.3	Very low	51.3	Low	66 Å²	66	112 Å²	112	46%	0.462	63%	0.63	S	S	.	*			trans	-150.8	73.1	-176.8	178.2	0	0	0	0	113.1	P282 G286 G287	P282-S284 PolarHBondContact O-N 3.35Å; S284-G286 PolarHBondContact O-N 3.24Å; S284-G287 PolarHBondContact O-N 3.01Å
285	K	32.5	Very low	54.3	Low	214 Å²	214	109 Å²	109	93%	0.93	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-38.5	106.3	175	-62.6	179.1	-179.3	-178.5	0	113.1	G287	K285-G287 PolarHBondContact O-N 2.93Å
286	G	41.2	Very low	57.3	Low	82 Å²	82	107.9 Å²	107.9	85%	0.845	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	57	13.6	170.3	0	0	0	0	0	116.6	S284	S284-G286 PolarHBondContact O-N 3.24Å
287	G	50.3	Low	60.3	Low	43 Å²	43	103.8 Å²	103.8	44%	0.443	60%	0.599	S	S	.	*			trans	-88.4	137.6	-169.6	0	0	0	0	0	113.4	S284 K285 R289	S284-G287 PolarHBondContact O-N 3.01Å; K285-G287 PolarHBondContact O-N 2.93Å; G287-R289 PolarHBondContact O-N 3.49Å; G287-R289 VanDerWaalsContact O-N 3.1Å
288	I	68.3	Low	63.1	Low	109 Å²	109	99 Å²	99	56%	0.559	56%	0.559	S	S	*	*			trans	-61.2	112.9	169.9	-58.3	176.3	0	0	0	108.5	L290 L337 P338	I288-L290 PolarHBondContact O-N 2.72Å; I288-L290 VanDerWaalsContact O-N 3.13Å; I288-L337 HydrophobicContact CG2-CB 3.75Å; I288-L337 HydrophobicContact CG2-CD1 4.31Å; I288-L337 HydrophobicContact CG2-CG 4.43Å; I288-P338 HydrophobicContact CG2-CB 3.91Å
289	R	80.7	Confident	65.9	Low	120 Å²	120	97.4 Å²	97.4	45%	0.453	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-54.3	119.1	-175.4	-179.3	172	173.8	161.6	0.7	111.2	G287 D322 L337 P338 C339	G287-R289 PolarHBondContact O-N 3.49Å; G287-R289 VanDerWaalsContact O-N 3.1Å; R289-D322 IonicContact CZ-OD2 3.23Å; R289-D322 IonicContact NE-OD2 2.82Å; R289-D322 IonicContact NH2-OD2 3.3Å; R289-D322 PolarHBondContact NH2-OD2 3.32Å; R289-L337 WeakPolarHBondContact O-CD2 3.12Å; R289-P338 HydrophobicContact CB-CB 4.25Å; R289-P338 CarbonylContact O-C 3.59Å; R289-P338 WeakPolarHBondContact O-CA 3.47Å; R289-C339 VanDerWaalsContact CD-O 3.24Å; R289-C339 WeakPolarHBondContact CD-O 3.26Å; R289-C339 HydrophobicContact CG-CB 4.33Å; R289-C339 PolarHBondContact NE-O 2.88Å; R289-C339 PolarHBondContact O-N 2.85Å
290	L	87.4	Confident	68.3	Low	123 Å²	123	99.9 Å²	99.9	64%	0.644	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-84.1	165	-179.7	-59.1	-179.3	0	0	0	112.3	I288 L337 C339	I288-L290 PolarHBondContact O-N 2.72Å; I288-L290 VanDerWaalsContact O-N 3.13Å; L290-L337 HydrophobicContact CD2-CD1 4.02Å; L290-L337 HydrophobicContact CD2-CD2 3.97Å; L290-C339 VanDerWaalsContact O-CB 3.29Å; L290-C339 WeakPolarHBondContact O-CB 3.45Å
291	H	88.1	Confident	70.8	Confident	19 Å²	19	97.4 Å²	97.4	9%	0.088	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-87.1	125.2	179.3	-67	-88.2	0	0	0	111.9	F293 C320 C323 P336 C339	H291-F293 HydrophobicContact CB-CD2 3.84Å; H291-F293 HydrophobicContact CB-CE1 4.2Å; H291-F293 HydrophobicContact CB-CE2 3.29Å; H291-F293 HydrophobicContact CB-CG 4.5Å; H291-F293 HydrophobicContact CB-CZ 3.48Å; H291-F293 VanDerWaalsContact CB-CZ 3.48Å; H291-F293 AromaticContact CG-CZ 3.81Å; H291-F293 PolarHBondContact O-N 2.68Å; H291-C320 HydrophobicContact CB-CB 4.25Å; H291-C323 PolarHBondContact CE1-SG 2.88Å; H291-C323 PolarHBondContact ND1-SG 3.26Å; H291-P336 PolarHBondContact CE1-O 3.47Å; H291-P336 PolarHBondContact NE2-O 3.13Å; H291-C339 HydrophobicContact CB-CB 4.32Å; H291-C339 WeakPolarHBondContact ND1-CB 3.3Å; H291-C339 PolarHBondContact ND1-SG 3.14Å; H291-C339 VanDerWaalsContact ND1-SG 3.42Å
292	E	91.5	Very high	73.1	Confident	88 Å²	88	94.7 Å²	94.7	41%	0.411	51%	0.512	S	S	.	.			trans	-84.8	104.4	168.1	-164.3	-162	114.9	0	0	110.4	C320 R321	E292-C320 CarbonylContact O-C 3.6Å; E292-C320 VanDerWaalsContact O-CA 3.25Å; E292-C320 WeakPolarHBondContact O-CA 3.15Å; E292-R321 PolarHBondContact O-N 3.11Å; E292-R321 IonicContact OE1-CZ 3.72Å; E292-R321 IonicContact OE1-NE 2.72Å; E292-R321 IonicContact OE1-NH1 2.72Å; E292-R321 PolarHBondContact OE1-NH1 2.95Å; E292-R321 IonicContact OE1-NH2 3.91Å; E292-R321 IonicContact OE2-CZ 3.68Å; E292-R321 IonicContact OE2-NE 2.65Å; E292-R321 IonicContact OE2-NH1 3.51Å; E292-R321 PolarHBondContact OE2-NH1 2.74Å; E292-R321 IonicContact OE2-NH2 3.97Å; E292-R321 PolarHBondContact OE2-NH2 3.45Å
293	F	93.1	Very high	75.3	Confident	34 Å²	34	92.5 Å²	92.5	15%	0.149	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.1	-174.4	-74.9	-70.1	0	0	0	114.3	H291 L318 C320 V325 R332 C335	H291-F293 HydrophobicContact CB-CD2 3.84Å; H291-F293 HydrophobicContact CB-CE1 4.2Å; H291-F293 HydrophobicContact CB-CE2 3.29Å; H291-F293 HydrophobicContact CB-CG 4.5Å; H291-F293 HydrophobicContact CB-CZ 3.48Å; H291-F293 VanDerWaalsContact CB-CZ 3.48Å; H291-F293 AromaticContact CG-CZ 3.81Å; H291-F293 PolarHBondContact O-N 2.68Å; F293-L318 HydrophobicContact CB-CB 4.13Å; F293-L318 HydrophobicContact CB-CD1 4.34Å; F293-L318 HydrophobicContact CD1-CB 3.64Å; F293-L318 HydrophobicContact CE1-CB 4.3Å; F293-L318 HydrophobicContact CG-CB 4.01Å; F293-L318 HydrophobicContact CG-CD1 4.27Å; F293-C320 HydrophobicContact CD1-CB 4.08Å; F293-C320 HydrophobicContact CE1-CB 3.95Å; F293-V325 HydrophobicContact CE1-CG1 3.86Å; F293-V325 HydrophobicContact CZ-CG1 4.11Å; F293-R332 HydrophobicContact CD2-CG 3.65Å; F293-R332 HydrophobicContact CE2-CG 3.59Å; F293-C335 HydrophobicContact CZ-CB 4.06Å; F293-C335 VanDerWaalsContact CZ-SG 3.56Å
294	V	92.8	Very high	77.8	Confident	56 Å²	56	83.6 Å²	83.6	34%	0.339	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.4	167.1	-177	0	0	0	0	109.5	K296 K319	V294-K296 HydrophobicContact CG1-CG 4.34Å; V294-K319 PolarHBondContact N-O 3.18Å; V294-K319 PolarHBondContact O-N 2.96Å
295	S	93.3	Very high	80.3	Confident	81 Å²	81	81.2 Å²	81.2	57%	0.566	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	131.3	173.8	53.8	0	0	0	0	111.7	S317	S295-S317 CarbonylContact C-O 3.51Å; S295-S317 WeakPolarHBondContact CA-O 3.44Å
296	K	91.4	Very high	82.8	Confident	122 Å²	122	71.6 Å²	71.6	53%	0.53	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	149.6	176.5	-62.8	-169.2	177	-171.6	0	111.2	V294 I316 S317	V294-K296 HydrophobicContact CG1-CG 4.34Å; K296-I316 WeakPolarHBondContact O-CA 3.43Å; K296-S317 PolarHBondContact N-O 2.92Å; K296-S317 PolarHBondContact O-N 2.85Å
297	T	91	Very high	84.9	Confident	93 Å²	93	69 Å²	69	57%	0.571	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.2	171.4	43.4	0	0	0	0	110.5	I299	T297-I299 PolarHBondContact O-N 3.34Å; T297-I299 VanDerWaalsContact O-N 3.13Å
298	V	86.9	Confident	86.4	Confident	5 Å²	5	69 Å²	69	3%	0.03	37%	0.368	C	S	.	.			trans	-81.9	96.1	-174.6	176.4	0	0	0	0	110.2	K300 I311 F313 G314 K315 S317	V298-K300 VanDerWaalsContact CG1-O 3.24Å; V298-K300 WeakPolarHBondContact CG1-O 3.44Å; V298-I311 HydrophobicContact CB-CG2 4.44Å; V298-I311 HydrophobicContact CG1-CB 4.49Å; V298-I311 HydrophobicContact CG2-CB 4.09Å; V298-I311 HydrophobicContact CG2-CG2 3.72Å; V298-F313 WeakPolarHBondContact O-CA 3.07Å; V298-G314 PolarHBondContact O-N 3.43Å; V298-K315 WeakPolarHBondContact CB-O 3.48Å; V298-K315 WeakPolarHBondContact CG2-O 3.23Å; V298-K315 PolarHBondContact N-O 3.38Å; V298-S317 WeakPolarHBondContact CG2-OG 3.32Å
299	I	86.4	Confident	87.3	Confident	135 Å²	135	70.8 Å²	70.8	69%	0.692	37%	0.372	S	S	*	.	S	Bend	trans	-82	-37.1	175.8	-56.2	173.8	0	0	0	111.2	T297 F313	T297-I299 PolarHBondContact O-N 3.34Å; T297-I299 VanDerWaalsContact O-N 3.13Å; I299-F313 HydrophobicContact CG2-CE2 4.44Å; I299-F313 VanDerWaalsContact O-CD2 3.28Å; I299-F313 WeakPolarHBondContact O-CD2 3.25Å; I299-F313 WeakPolarHBondContact O-CE2 3.43Å
300	K	82.9	Confident	87.7	Confident	172 Å²	172	73.3 Å²	73.3	75%	0.748	38%	0.382	S	S	*	.	S	Bend	trans	-115.2	130.2	172.3	-176.2	173	-178.4	173.2	0	108.6	V298 E302	V298-K300 VanDerWaalsContact CG1-O 3.24Å; V298-K300 WeakPolarHBondContact CG1-O 3.44Å; K300-E302 PolarHBondContact O-N 3.37Å
301	P	81.1	Confident	87.8	Confident	61 Å²	61	67.5 Å²	67.5	40%	0.396	35%	0.351	S	S	.	.			trans	-60.8	106.5	-175.5	-26.2	35.4	0	0	0	113.4
302	E	84.4	Confident	87.9	Confident	70 Å²	70	74.5 Å²	74.5	33%	0.327	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-94.6	160.4	170.2	-56.4	-162.4	127.9	0	0	110.2	K300 I311 K319 V326	K300-E302 PolarHBondContact O-N 3.37Å; E302-I311 PolarHBondContact O-N 2.92Å; E302-K319 IonicContact OE1-NZ 3.95Å; E302-K319 PolarHBondContact OE1-NZ 3.05Å; E302-K319 IonicContact OE2-NZ 3.83Å; E302-K319 PolarHBondContact OE2-NZ 3.39Å; E302-V326 HydrophobicContact CB-CG1 4.2Å; E302-V326 WeakPolarHBondContact OE2-CG2 3.32Å
303	S	87.5	Confident	87.8	Confident	63 Å²	63	77.6 Å²	77.6	44%	0.441	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-98.5	132.1	172.7	-68	0	0	0	0	110.3	V305	S303-V305 PolarHBondContact O-N 3.42Å
304	C	89.3	Confident	87.5	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-64.7	122.7	166.9	167.4	0	0	0	0	108.3	C307 G308 K309 I311 V326 S327 H328	C304-C307 PolarHBondContact SG-SG 3.42Å; C304-G308 WeakPolarHBondContact O-CA 3.42Å; C304-G308 PolarHBondContact O-N 3.18Å; C304-K309 PolarHBondContact N-O 3.36Å; C304-I311 HydrophobicContact CB-CD1 4.03Å; C304-I311 HydrophobicContact CB-CG1 4.01Å; C304-V326 CarbonylContact C-O 3.6Å; C304-V326 WeakPolarHBondContact CA-O 3.43Å; C304-S327 VanDerWaalsContact SG-CA 3.59Å; C304-H328 VanDerWaalsContact CB-CE1 3.43Å; C304-H328 WeakPolarHBondContact CB-CE1 3.49Å; C304-H328 WeakPolarHBondContact CB-ND1 3.48Å; C304-H328 PolarHBondContact SG-N 2.71Å; C304-H328 VanDerWaalsContact SG-N 3.4Å; C304-H328 PolarHBondContact SG-ND1 2.82Å; C304-H328 VanDerWaalsContact SG-ND1 3.41Å
305	V	85.4	Confident	87.5	Confident	16 Å²	16	82.1 Å²	82.1	10%	0.097	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-63.8	179.4	170.4	0	0	0	0	110.5	S303 C307 G308 V325 V326 P336 V412	S303-V305 PolarHBondContact O-N 3.42Å; V305-C307 PolarHBondContact O-N 3.22Å; V305-C307 VanDerWaalsContact O-N 3.16Å; V305-G308 PolarHBondContact O-N 3.26Å; V305-V325 HydrophobicContact CB-CG2 3.76Å; V305-V325 HydrophobicContact CG1-CG2 3.95Å; V305-V325 HydrophobicContact CG2-CG2 3.74Å; V305-V326 PolarHBondContact N-O 3.23Å; V305-P336 HydrophobicContact CG1-CG 4.3Å; V305-V412 HydrophobicContact CG1-CG2 3.8Å; V305-V412 WeakPolarHBondContact O-CG2 3.32Å
306	P	85.6	Confident	87.4	Confident	12 Å²	12	82.6 Å²	82.6	8%	0.078	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.1	-55.1	-176.9	-29.1	28	0	0	0	115.9	C331 R334 C335 K415	P306-C331 HydrophobicContact CB-CB 4.02Å; P306-C331 HydrophobicContact CG-CB 4.05Å; P306-C331 WeakPolarHBondContact CG-O 3.48Å; P306-R334 HydrophobicContact CB-CB 3.91Å; P306-R334 WeakPolarHBondContact CB-O 3.27Å; P306-R334 HydrophobicContact CG-CB 4.42Å; P306-R334 WeakPolarHBondContact CG-O 3.38Å; P306-C335 HydrophobicContact CG-CB 4.44Å; P306-C335 VanDerWaalsContact CG-SG 3.52Å; P306-K415 WeakPolarHBondContact O-CE 3.4Å
307	C	85.1	Confident	87.5	Confident	27 Å²	27	77 Å²	77	18%	0.182	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-11.4	-177.2	74.6	0	0	0	0	113.9	C304 V305 K309 H328 K415	C304-C307 PolarHBondContact SG-SG 3.42Å; V305-C307 PolarHBondContact O-N 3.22Å; V305-C307 VanDerWaalsContact O-N 3.16Å; C307-K309 HydrophobicContact CB-CG 4.48Å; C307-K309 PolarHBondContact O-N 2.54Å; C307-H328 PolarHBondContact SG-ND1 3.39Å; C307-K415 PolarHBondContact O-NZ 3.42Å
308	G	82.5	Confident	87.6	Confident	42 Å²	42	73.5 Å²	73.5	43%	0.433	37%	0.372	S	S	.	.			trans	67.5	2.1	-175.9	0	0	0	0	0	115.6	C304 V305	C304-G308 WeakPolarHBondContact O-CA 3.42Å; C304-G308 PolarHBondContact O-N 3.18Å; V305-G308 PolarHBondContact O-N 3.26Å
309	K	87.4	Confident	87.8	Confident	148 Å²	148	75.8 Å²	75.8	64%	0.643	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-83.4	140.9	-178.8	-58.7	-179.1	-179.3	-179.4	0	110.2	C304 C307 I311	C304-K309 PolarHBondContact N-O 3.36Å; C307-K309 HydrophobicContact CB-CG 4.48Å; C307-K309 PolarHBondContact O-N 2.54Å; K309-I311 PolarHBondContact O-N 2.85Å
310	R	88.4	Confident	87.9	Confident	173 Å²	173	69.5 Å²	69.5	65%	0.653	35%	0.35	S	S	*	.	B	Isolated β-bridge	trans	-65.6	128.7	173.6	-72.5	176.2	68.8	-163.6	3.2	110.5
311	I	90.5	Very high	88.1	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-77.6	127.8	173.1	-42.1	-174.4	0	0	0	107.2	V298 E302 C304 K309 K315 S317 V326	V298-I311 HydrophobicContact CB-CG2 4.44Å; V298-I311 HydrophobicContact CG1-CB 4.49Å; V298-I311 HydrophobicContact CG2-CB 4.09Å; V298-I311 HydrophobicContact CG2-CG2 3.72Å; E302-I311 PolarHBondContact O-N 2.92Å; C304-I311 HydrophobicContact CB-CD1 4.03Å; C304-I311 HydrophobicContact CB-CG1 4.01Å; K309-I311 PolarHBondContact O-N 2.85Å; I311-K315 HydrophobicContact CG2-CB 4.17Å; I311-S317 VanDerWaalsContact CD1-CB 3.43Å; I311-V326 HydrophobicContact CD1-CG1 3.75Å
312	K	88.8	Confident	88.2	Confident	165 Å²	165	67.1 Å²	67.1	72%	0.717	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-72.3	152.5	-176.2	-67	-172.6	178.8	-175.7	0	111.4	G314 K315	K312-G314 PolarHBondContact O-N 2.84Å; K312-K315 HydrophobicContact CB-CG 4.19Å; K312-K315 WeakPolarHBondContact O-CB 3.43Å; K312-K315 PolarHBondContact O-N 2.83Å; K312-K315 VanDerWaalsContact O-N 3.17Å
313	F	90.6	Very high	88	Confident	153 Å²	153	64.6 Å²	64.6	67%	0.671	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	138.8	171.9	179.4	-96	0	0	0	111.2	V298 I299 K315	V298-F313 WeakPolarHBondContact O-CA 3.07Å; I299-F313 HydrophobicContact CG2-CE2 4.44Å; I299-F313 VanDerWaalsContact O-CD2 3.28Å; I299-F313 WeakPolarHBondContact O-CD2 3.25Å; I299-F313 WeakPolarHBondContact O-CE2 3.43Å; F313-K315 PolarHBondContact O-N 2.86Å
314	G	86.9	Confident	87.9	Confident	49 Å²	49	67.3 Å²	67.3	51%	0.505	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	0.4	179.2	0	0	0	0	0	115.7	V298 K312	V298-G314 PolarHBondContact O-N 3.43Å; K312-G314 PolarHBondContact O-N 2.84Å
315	K	92	Very high	87.7	Confident	136 Å²	136	67.8 Å²	67.8	59%	0.591	32%	0.323	S	S	*	.	S	Bend	trans	-86.7	159.4	168.9	-66.3	-60.5	-174.6	-177.5	0	111.2	V298 I311 K312 F313	V298-K315 WeakPolarHBondContact CB-O 3.48Å; V298-K315 WeakPolarHBondContact CG2-O 3.23Å; V298-K315 PolarHBondContact N-O 3.38Å; I311-K315 HydrophobicContact CG2-CB 4.17Å; K312-K315 HydrophobicContact CB-CG 4.19Å; K312-K315 WeakPolarHBondContact O-CB 3.43Å; K312-K315 PolarHBondContact O-N 2.83Å; K312-K315 VanDerWaalsContact O-N 3.17Å; F313-K315 PolarHBondContact O-N 2.86Å
316	I	91.2	Very high	87.9	Confident	92 Å²	92	67.3 Å²	67.3	47%	0.472	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.2	176	-59.4	172.8	0	0	0	108.8	K296 P329	K296-I316 WeakPolarHBondContact O-CA 3.43Å; I316-P329 HydrophobicContact CG2-CG 4.33Å
317	S	93.4	Very high	88.2	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	153.3	160.1	64.6	0	0	0	0	110.1	S295 K296 V298 I311 S327	S295-S317 CarbonylContact C-O 3.51Å; S295-S317 WeakPolarHBondContact CA-O 3.44Å; K296-S317 PolarHBondContact N-O 2.92Å; K296-S317 PolarHBondContact O-N 2.85Å; V298-S317 WeakPolarHBondContact CG2-OG 3.32Å; I311-S317 VanDerWaalsContact CD1-CB 3.43Å; S317-S327 CarbonylContact C-O 3.6Å; S317-S327 WeakPolarHBondContact CA-O 3.27Å
318	L	93.5	Very high	88.6	Confident	21 Å²	21	66.8 Å²	66.8	11%	0.11	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.3	161.1	-61.8	-175.4	0	0	0	108	F293 V326 S327 P329 R332	F293-L318 HydrophobicContact CB-CB 4.13Å; F293-L318 HydrophobicContact CB-CD1 4.34Å; F293-L318 HydrophobicContact CD1-CB 3.64Å; F293-L318 HydrophobicContact CE1-CB 4.3Å; F293-L318 HydrophobicContact CG-CB 4.01Å; F293-L318 HydrophobicContact CG-CD1 4.27Å; L318-V326 CarbonylContact O-C 3.59Å; L318-V326 WeakPolarHBondContact O-CA 3.42Å; L318-S327 PolarHBondContact N-O 2.94Å; L318-S327 PolarHBondContact O-N 3.34Å; L318-P329 HydrophobicContact CG-CG 4.48Å; L318-R332 HydrophobicContact CD1-CB 3.86Å; L318-R332 HydrophobicContact CD1-CG 3.88Å
319	K	90.8	Very high	89.1	Confident	53 Å²	53	67.8 Å²	67.8	23%	0.23	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.9	175.4	-165.6	159.1	-159.2	153.9	0	109.6	V294 E302 R321 V325 V326	V294-K319 PolarHBondContact N-O 3.18Å; V294-K319 PolarHBondContact O-N 2.96Å; E302-K319 IonicContact OE1-NZ 3.95Å; E302-K319 PolarHBondContact OE1-NZ 3.05Å; E302-K319 IonicContact OE2-NZ 3.83Å; E302-K319 PolarHBondContact OE2-NZ 3.39Å; K319-R321 PolarHBondContact O-N 2.89Å; K319-V325 WeakPolarHBondContact CA-O 3.26Å; K319-V326 HydrophobicContact CD-CG2 3.9Å; K319-V326 VanDerWaalsContact CE-CG2 3.5Å; K319-V326 HydrophobicContact CG-CG2 3.99Å
320	C	89.6	Confident	89.4	Confident	3 Å²	3	66.9 Å²	66.9	2%	0.02	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	135.5	178.8	-179.1	0	0	0	0	109.8	H291 E292 F293 D322 C323 R324 V325 C339	H291-C320 HydrophobicContact CB-CB 4.25Å; E292-C320 CarbonylContact O-C 3.6Å; E292-C320 VanDerWaalsContact O-CA 3.25Å; E292-C320 WeakPolarHBondContact O-CA 3.15Å; F293-C320 HydrophobicContact CD1-CB 4.08Å; F293-C320 HydrophobicContact CE1-CB 3.95Å; C320-D322 VanDerWaalsContact C-N 3.32Å; C320-C323 WeakPolarHBondContact CB-SG 3.47Å; C320-R324 VanDerWaalsContact O-CA 3.24Å; C320-R324 WeakPolarHBondContact O-CA 3.45Å; C320-R324 PolarHBondContact O-N 2.99Å; C320-V325 HydrophobicContact CB-CG1 3.85Å; C320-V325 PolarHBondContact N-O 3.4Å; C320-C339 PolarHBondContact SG-SG 2.74Å
321	R	86.1	Confident	89.5	Confident	149 Å²	149	58.8 Å²	58.8	56%	0.562	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-40.4	179.7	-167.2	-178.2	68.1	-161.6	-0.8	111.5	E292 K319	E292-R321 PolarHBondContact O-N 3.11Å; E292-R321 IonicContact OE1-CZ 3.72Å; E292-R321 IonicContact OE1-NE 2.72Å; E292-R321 IonicContact OE1-NH1 2.72Å; E292-R321 PolarHBondContact OE1-NH1 2.95Å; E292-R321 IonicContact OE1-NH2 3.91Å; E292-R321 IonicContact OE2-CZ 3.68Å; E292-R321 IonicContact OE2-NE 2.65Å; E292-R321 IonicContact OE2-NH1 3.51Å; E292-R321 PolarHBondContact OE2-NH1 2.74Å; E292-R321 IonicContact OE2-NH2 3.97Å; E292-R321 PolarHBondContact OE2-NH2 3.45Å; K319-R321 PolarHBondContact O-N 2.89Å
322	D	82.4	Confident	89.4	Confident	34 Å²	34	64.3 Å²	64.3	18%	0.182	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-61.1	-169.2	-58.2	-3.1	0	0	0	112.2	R289 C320 R324 P341 N342	R289-D322 IonicContact CZ-OD2 3.23Å; R289-D322 IonicContact NE-OD2 2.82Å; R289-D322 IonicContact NH2-OD2 3.3Å; R289-D322 PolarHBondContact NH2-OD2 3.32Å; C320-D322 VanDerWaalsContact C-N 3.32Å; D322-R324 VanDerWaalsContact C-N 3.35Å; D322-P341 HydrophobicContact CB-CB 4.49Å; D322-P341 HydrophobicContact CB-CG 4.38Å; D322-N342 PolarHBondContact O-N 2.8Å
323	C	80.9	Confident	89.3	Confident	16 Å²	16	63.9 Å²	63.9	11%	0.108	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.4	-176.5	75	0	0	0	0	113.7	H291 C320 V325 I340 N342	H291-C323 PolarHBondContact CE1-SG 2.88Å; H291-C323 PolarHBondContact ND1-SG 3.26Å; C320-C323 WeakPolarHBondContact CB-SG 3.47Å; C323-V325 PolarHBondContact O-N 3.07Å; C323-V325 VanDerWaalsContact O-N 3.12Å; C323-V325 VanDerWaalsContact SG-CB 3.52Å; C323-V325 VanDerWaalsContact SG-CG1 3.5Å; C323-V325 PolarHBondContact SG-N 3.01Å; C323-V325 VanDerWaalsContact SG-N 3.4Å; C323-I340 WeakPolarHBondContact CA-O 3.39Å; C323-I340 WeakPolarHBondContact CB-O 3.35Å; C323-N342 VanDerWaalsContact O-CB 3.25Å; C323-N342 WeakPolarHBondContact O-CB 3.3Å; C323-N342 PolarHBondContact O-ND2 3.09Å
324	R	84.8	Confident	89	Confident	121 Å²	121	63.9 Å²	63.9	46%	0.457	30%	0.298	S	S	.	.			trans	61.4	10.4	-176.9	-53.9	173.1	176	153.1	-3.5	115.4	C320 D322 N342	C320-R324 VanDerWaalsContact O-CA 3.24Å; C320-R324 WeakPolarHBondContact O-CA 3.45Å; C320-R324 PolarHBondContact O-N 2.99Å; D322-R324 VanDerWaalsContact C-N 3.35Å; R324-N342 HydrophobicContact CB-CB 4.49Å; R324-N342 HydrophobicContact CG-CB 4.23Å; R324-N342 PolarHBondContact NH1-O 3.23Å
325	V	86.1	Confident	88.9	Confident	9 Å²	9	62 Å²	62	6%	0.055	28%	0.277	C	S	.	.			trans	-57.7	142	175.2	84.1	0	0	0	0	110.4	F293 V305 K319 C320 C323 C335	F293-V325 HydrophobicContact CE1-CG1 3.86Å; F293-V325 HydrophobicContact CZ-CG1 4.11Å; V305-V325 HydrophobicContact CB-CG2 3.76Å; V305-V325 HydrophobicContact CG1-CG2 3.95Å; V305-V325 HydrophobicContact CG2-CG2 3.74Å; K319-V325 WeakPolarHBondContact CA-O 3.26Å; C320-V325 HydrophobicContact CB-CG1 3.85Å; C320-V325 PolarHBondContact N-O 3.4Å; C323-V325 PolarHBondContact O-N 3.07Å; C323-V325 VanDerWaalsContact O-N 3.12Å; C323-V325 VanDerWaalsContact SG-CB 3.52Å; C323-V325 VanDerWaalsContact SG-CG1 3.5Å; C323-V325 PolarHBondContact SG-N 3.01Å; C323-V325 VanDerWaalsContact SG-N 3.4Å; V325-C335 HydrophobicContact CG1-CB 4.47Å
326	V	89.7	Confident	88.3	Confident	6 Å²	6	56.9 Å²	56.9	4%	0.036	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.9	-177.8	-176.9	0	0	0	0	109.4	E302 C304 V305 I311 L318 K319	E302-V326 HydrophobicContact CB-CG1 4.2Å; E302-V326 WeakPolarHBondContact OE2-CG2 3.32Å; C304-V326 CarbonylContact C-O 3.6Å; C304-V326 WeakPolarHBondContact CA-O 3.43Å; V305-V326 PolarHBondContact N-O 3.23Å; I311-V326 HydrophobicContact CD1-CG1 3.75Å; L318-V326 CarbonylContact O-C 3.59Å; L318-V326 WeakPolarHBondContact O-CA 3.42Å; K319-V326 HydrophobicContact CD-CG2 3.9Å; K319-V326 VanDerWaalsContact CE-CG2 3.5Å; K319-V326 HydrophobicContact CG-CG2 3.99Å
327	S	92.3	Very high	87.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162	176.6	56.1	0	0	0	0	112.1	C304 S317 L318 C335	C304-S327 VanDerWaalsContact SG-CA 3.59Å; S317-S327 CarbonylContact C-O 3.6Å; S317-S327 WeakPolarHBondContact CA-O 3.27Å; L318-S327 PolarHBondContact N-O 2.94Å; L318-S327 PolarHBondContact O-N 3.34Å; S327-C335 VanDerWaalsContact CB-SG 3.57Å
328	H	93.6	Very high	87.2	Confident	29 Å²	29	56.5 Å²	56.5	13%	0.134	26%	0.258	C	S	.	.			trans	-74.3	157.4	159.9	-57.5	101.4	0	0	0	109.6	C304 C307 E330 C331 R332	C304-H328 VanDerWaalsContact CB-CE1 3.43Å; C304-H328 WeakPolarHBondContact CB-CE1 3.49Å; C304-H328 WeakPolarHBondContact CB-ND1 3.48Å; C304-H328 PolarHBondContact SG-N 2.71Å; C304-H328 VanDerWaalsContact SG-N 3.4Å; C304-H328 PolarHBondContact SG-ND1 2.82Å; C304-H328 VanDerWaalsContact SG-ND1 3.41Å; C307-H328 PolarHBondContact SG-ND1 3.39Å; H328-E330 VanDerWaalsContact C-N 3.32Å; H328-E330 VanDerWaalsContact CB-CD 3.42Å; H328-E330 WeakPolarHBondContact CB-OE1 3.32Å; H328-E330 WeakPolarHBondContact CB-OE2 3.4Å; H328-E330 IonicContact CD2-OE1 2.82Å; H328-E330 IonicContact CG-OE1 2.81Å; H328-E330 IonicContact ND1-OE1 2.71Å; H328-E330 PolarHBondContact O-N 3.03Å; H328-C331 HydrophobicContact CB-CB 4.18Å; H328-C331 WeakPolarHBondContact O-CA 3.5Å; H328-C331 WeakPolarHBondContact O-CB 3.24Å; H328-C331 PolarHBondContact O-N 3.49Å; H328-R332 PolarHBondContact O-N 3.12Å
329	P	92.8	Very high	86.7	Confident	62 Å²	62	55.6 Å²	55.6	40%	0.403	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-51.5	-46.5	174.7	-27.7	36.6	0	0	0	113.7	I316 L318 C331 R332	I316-P329 HydrophobicContact CG2-CG 4.33Å; L318-P329 HydrophobicContact CG-CG 4.48Å; P329-C331 PolarHBondContact O-N 2.9Å; P329-C331 VanDerWaalsContact O-N 3.11Å; P329-R332 WeakPolarHBondContact O-CB 3.39Å; P329-R332 PolarHBondContact O-N 3.31Å
330	E	92.7	Very high	86.1	Confident	130 Å²	130	54.3 Å²	54.3	61%	0.607	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-74	4.8	176.7	77.3	-68.5	164.8	0	0	114.4	H328	H328-E330 VanDerWaalsContact C-N 3.32Å; H328-E330 VanDerWaalsContact CB-CD 3.42Å; H328-E330 WeakPolarHBondContact CB-OE1 3.32Å; H328-E330 WeakPolarHBondContact CB-OE2 3.4Å; H328-E330 IonicContact CD2-OE1 2.82Å; H328-E330 IonicContact CG-OE1 2.81Å; H328-E330 IonicContact ND1-OE1 2.71Å; H328-E330 PolarHBondContact O-N 3.03Å
331	C	90.3	Very high	85.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.014	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-112.7	0	175.9	-65.5	0	0	0	0	113.3	P306 H328 P329 E333 R334	P306-C331 HydrophobicContact CB-CB 4.02Å; P306-C331 HydrophobicContact CG-CB 4.05Å; P306-C331 WeakPolarHBondContact CG-O 3.48Å; H328-C331 HydrophobicContact CB-CB 4.18Å; H328-C331 WeakPolarHBondContact O-CA 3.5Å; H328-C331 WeakPolarHBondContact O-CB 3.24Å; H328-C331 PolarHBondContact O-N 3.49Å; P329-C331 PolarHBondContact O-N 2.9Å; P329-C331 VanDerWaalsContact O-N 3.11Å; C331-E333 PolarHBondContact O-N 3.38Å; C331-R334 PolarHBondContact O-N 3.36Å; C331-R334 VanDerWaalsContact O-N 3.11Å; C331-R334 PolarHBondContact SG-NH2 3.37Å
332	R	89.5	Confident	84.3	Confident	118 Å²	118	51.4 Å²	51.4	45%	0.445	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-49.2	-57.2	-175	-171.8	-176.2	152.5	141.5	6.3	113.5	F293 L318 H328 P329 R334 C335	F293-R332 HydrophobicContact CD2-CG 3.65Å; F293-R332 HydrophobicContact CE2-CG 3.59Å; L318-R332 HydrophobicContact CD1-CB 3.86Å; L318-R332 HydrophobicContact CD1-CG 3.88Å; H328-R332 PolarHBondContact O-N 3.12Å; P329-R332 WeakPolarHBondContact O-CB 3.39Å; P329-R332 PolarHBondContact O-N 3.31Å; R332-R334 PolarHBondContact O-N 3.12Å; R332-C335 WeakPolarHBondContact O-CB 3.22Å; R332-C335 PolarHBondContact O-N 3.14Å; R332-C335 PolarHBondContact O-SG 3.04Å
333	E	86.3	Confident	83.3	Confident	156 Å²	156	53.5 Å²	53.5	73%	0.729	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-75	5.4	-175.6	-46.8	-44.4	129.4	0	0	114.1	C331	C331-E333 PolarHBondContact O-N 3.38Å
334	R	84.8	Confident	81.8	Confident	152 Å²	152	56.2 Å²	56.2	57%	0.574	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-113.3	13.2	175.4	-61.5	-173.4	-64.9	173.4	-5	112.7	P306 C331 R332	P306-R334 HydrophobicContact CB-CB 3.91Å; P306-R334 WeakPolarHBondContact CB-O 3.27Å; P306-R334 HydrophobicContact CG-CB 4.42Å; P306-R334 WeakPolarHBondContact CG-O 3.38Å; C331-R334 PolarHBondContact O-N 3.36Å; C331-R334 VanDerWaalsContact O-N 3.11Å; C331-R334 PolarHBondContact SG-NH2 3.37Å; R332-R334 PolarHBondContact O-N 3.12Å
335	C	84.3	Confident	80.4	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.061	30%	0.295	C	S	.	.	S	Bend	trans	-72.7	138	173.8	-74.5	0	0	0	0	110.7	F293 P306 V325 S327 R332 L337	F293-C335 HydrophobicContact CZ-CB 4.06Å; F293-C335 VanDerWaalsContact CZ-SG 3.56Å; P306-C335 HydrophobicContact CG-CB 4.44Å; P306-C335 VanDerWaalsContact CG-SG 3.52Å; V325-C335 HydrophobicContact CG1-CB 4.47Å; S327-C335 VanDerWaalsContact CB-SG 3.57Å; R332-C335 WeakPolarHBondContact O-CB 3.22Å; R332-C335 PolarHBondContact O-N 3.14Å; R332-C335 PolarHBondContact O-SG 3.04Å; C335-L337 PolarHBondContact O-N 3.39Å
336	P	80.4	Confident	78.8	Confident	29 Å²	29	58.9 Å²	58.9	19%	0.188	33%	0.329	C	S	.	.			trans	-54.3	127.9	178.5	-26	34.3	0	0	0	111.2	H291 V305	H291-P336 PolarHBondContact CE1-O 3.47Å; H291-P336 PolarHBondContact NE2-O 3.13Å; V305-P336 HydrophobicContact CG1-CG 4.3Å
337	L	79.8	Confident	77.3	Confident	61 Å²	61	63.5 Å²	63.5	32%	0.319	36%	0.359	S	S	.	.	S	Bend	trans	-106.7	159	176.6	-73.1	174.1	0	0	0	110.1	I288 R289 L290 C335 H372	I288-L337 HydrophobicContact CG2-CB 3.75Å; I288-L337 HydrophobicContact CG2-CD1 4.31Å; I288-L337 HydrophobicContact CG2-CG 4.43Å; R289-L337 WeakPolarHBondContact O-CD2 3.12Å; L290-L337 HydrophobicContact CD2-CD1 4.02Å; L290-L337 HydrophobicContact CD2-CD2 3.97Å; C335-L337 PolarHBondContact O-N 3.39Å; L337-H372 PolarHBondContact O-ND1 3.18Å
338	P	81.7	Confident	75.9	Confident	27 Å²	27	66.2 Å²	66.2	18%	0.175	37%	0.373	C	S	.	.	S	Bend	cis	-66.4	164.7	-12.4	29.6	-35.2	0	0	0	113	I288 R289 I340 V371 H372	I288-P338 HydrophobicContact CG2-CB 3.91Å; R289-P338 HydrophobicContact CB-CB 4.25Å; R289-P338 CarbonylContact O-C 3.59Å; R289-P338 WeakPolarHBondContact O-CA 3.47Å; P338-I340 HydrophobicContact CG-CD1 4.33Å; P338-I340 HydrophobicContact CG-CG1 4.13Å; P338-I340 PolarHBondContact O-N 3.44Å; P338-V371 HydrophobicContact CG-CG1 3.58Å; P338-H372 PolarHBondContact O-CE1 2.81Å
339	C	82.9	Confident	74.4	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	39%	0.394	C	S	.	.			trans	-77.7	105	171.3	174	0	0	0	0	110.8	R289 L290 H291 C320	R289-C339 VanDerWaalsContact CD-O 3.24Å; R289-C339 WeakPolarHBondContact CD-O 3.26Å; R289-C339 HydrophobicContact CG-CB 4.33Å; R289-C339 PolarHBondContact NE-O 2.88Å; R289-C339 PolarHBondContact O-N 2.85Å; L290-C339 VanDerWaalsContact O-CB 3.29Å; L290-C339 WeakPolarHBondContact O-CB 3.45Å; H291-C339 HydrophobicContact CB-CB 4.32Å; H291-C339 WeakPolarHBondContact ND1-CB 3.3Å; H291-C339 PolarHBondContact ND1-SG 3.14Å; H291-C339 VanDerWaalsContact ND1-SG 3.42Å; C320-C339 PolarHBondContact SG-SG 2.74Å
340	I	77.1	Confident	73.1	Confident	27 Å²	27	72 Å²	72	14%	0.138	40%	0.395	C	S	.	.			trans	-102.1	124	-179.1	-48.8	174.3	0	0	0	109.8	C323 P338 P368 V371	C323-I340 WeakPolarHBondContact CA-O 3.39Å; C323-I340 WeakPolarHBondContact CB-O 3.35Å; P338-I340 HydrophobicContact CG-CD1 4.33Å; P338-I340 HydrophobicContact CG-CG1 4.13Å; P338-I340 PolarHBondContact O-N 3.44Å; I340-P368 HydrophobicContact CB-CB 4.47Å; I340-P368 HydrophobicContact CD1-CB 4Å; I340-P368 HydrophobicContact CG2-CB 4.22Å; I340-P368 HydrophobicContact CG2-CG 3.92Å; I340-V371 HydrophobicContact CD1-CB 3.63Å; I340-V371 HydrophobicContact CD1-CG1 3.75Å; I340-V371 HydrophobicContact CD1-CG2 4.14Å
341	P	72.1	Confident	71.6	Confident	49 Å²	49	67.7 Å²	67.7	32%	0.318	39%	0.385	S	S	.	.			trans	-55.1	137.6	-179.3	-27.5	35.6	0	0	0	114	D322 M343	D322-P341 HydrophobicContact CB-CB 4.49Å; D322-P341 HydrophobicContact CB-CG 4.38Å; P341-M343 PolarHBondContact O-N 2.91Å
342	N	66.1	Low	70.5	Confident	42 Å²	42	73 Å²	73	23%	0.225	41%	0.409	C	S	.	.			trans	-94.8	89.8	-172	-176.6	-28	0	0	0	110.6	D322 C323 R324 K408	D322-N342 PolarHBondContact O-N 2.8Å; C323-N342 VanDerWaalsContact O-CB 3.25Å; C323-N342 WeakPolarHBondContact O-CB 3.3Å; C323-N342 PolarHBondContact O-ND2 3.09Å; R324-N342 HydrophobicContact CB-CB 4.49Å; R324-N342 HydrophobicContact CG-CB 4.23Å; R324-N342 PolarHBondContact NH1-O 3.23Å; N342-K408 PolarHBondContact ND2-O 3.49Å
343	M	61.7	Low	69.7	Low	77 Å²	77	67.4 Å²	67.4	38%	0.379	39%	0.389	S	S	.	.			trans	-61.9	138.9	-174.9	-54.4	-124.2	-55.8	0	0	111.5	P341 G345 V359 P360 D361	P341-M343 PolarHBondContact O-N 2.91Å; M343-G345 PolarHBondContact O-N 3.04Å; M343-V359 WeakPolarHBondContact CE-O 3.5Å; M343-P360 HydrophobicContact SD-CB 4.37Å; M343-D361 HydrophobicContact CE-CB 4.27Å; M343-D361 VanDerWaalsContact CE-CG 3.42Å; M343-D361 WeakPolarHBondContact CE-OD1 3.19Å; M343-D361 WeakPolarHBondContact CE-OD2 3.39Å; M343-D361 HydrophobicContact SD-CB 4.16Å; M343-D361 PolarHBondContact SD-N 3.27Å; M343-D361 VanDerWaalsContact SD-N 3.38Å; M343-D361 VanDerWaalsContact SD-OD2 3.4Å
344	G	49.9	Very low	69.7	Low	73 Å²	73	61.9 Å²	61.9	75%	0.753	37%	0.365	S	S	*	.			trans	-76.5	23.7	-164.8	0	0	0	0	0	117
345	G	53.8	Low	70	Confident	62 Å²	62	54.8 Å²	54.8	64%	0.639	34%	0.339	S	S	*	.			trans	-64.3	155.6	-171.8	0	0	0	0	0	115.3	M343	M343-G345 PolarHBondContact O-N 3.04Å
346	T	53.2	Low	70.3	Confident	125 Å²	125	57.2 Å²	57.2	77%	0.767	36%	0.356	S	S	*	.			trans	-64.9	145.9	161.7	40.8	0	0	0	0	110.5	I348	T346-I348 PolarHBondContact O-N 3.2Å; T346-I348 VanDerWaalsContact O-N 3.08Å
347	P	58	Low	70.6	Confident	102 Å²	102	59.6 Å²	59.6	66%	0.662	37%	0.367	S	S	*	.			trans	-60.4	114.6	179	-22.4	33.7	0	0	0	111.8
348	I	62.9	Low	71	Confident	57 Å²	57	58.1 Å²	58.1	29%	0.292	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-74.7	134.2	175.4	-56.9	153.8	0	0	0	107.8	T346 D357 Y358	T346-I348 PolarHBondContact O-N 3.2Å; T346-I348 VanDerWaalsContact O-N 3.08Å; I348-D357 HydrophobicContact CD1-CB 3.63Å; I348-D357 WeakPolarHBondContact CD1-O 3.29Å; I348-Y358 HydrophobicContact CB-CE1 4.12Å; I348-Y358 HydrophobicContact CD1-CD1 3.99Å; I348-Y358 HydrophobicContact CD1-CE1 3.79Å; I348-Y358 HydrophobicContact CG2-CE1 4.08Å; I348-Y358 WeakPolarHBondContact CG2-OH 3.13Å
349	K	62.9	Low	71.3	Confident	132 Å²	132	57.2 Å²	57.2	57%	0.574	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-65.5	142.8	174.6	-67.8	166.4	173.8	176.9	0	110.4	G351 E352	K349-G351 PolarHBondContact O-N 2.86Å; K349-E352 HydrophobicContact CB-CB 4.27Å; K349-E352 HydrophobicContact CB-CG 4.29Å; K349-E352 HydrophobicContact CD-CG 4.26Å; K349-E352 WeakPolarHBondContact CD-OE1 3.33Å; K349-E352 WeakPolarHBondContact CD-OE2 3.07Å; K349-E352 IonicContact NZ-OE1 3.82Å; K349-E352 PolarHBondContact NZ-OE1 3.23Å; K349-E352 IonicContact NZ-OE2 2.66Å; K349-E352 PolarHBondContact NZ-OE2 2.96Å; K349-E352 PolarHBondContact O-N 2.96Å
350	I	65.1	Low	71.4	Confident	82 Å²	82	58 Å²	58	42%	0.421	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	117.4	179.3	-52.6	-175.8	0	0	0	109	K401 E402 L405	I350-K401 HydrophobicContact CG2-CD 4.16Å; I350-E402 HydrophobicContact CD1-CB 4.44Å; I350-L405 HydrophobicContact CB-CD1 4.21Å; I350-L405 HydrophobicContact CD1-CB 4.44Å; I350-L405 HydrophobicContact CD1-CD1 4.31Å; I350-L405 HydrophobicContact CG1-CB 4.11Å; I350-L405 HydrophobicContact CG1-CD1 3.81Å; I350-L405 HydrophobicContact CG2-CD1 3.85Å
351	G	61.6	Low	71.6	Confident	39 Å²	39	63.3 Å²	63.3	40%	0.402	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-1.2	178.2	0	0	0	0	0	116.6	K349	K349-G351 PolarHBondContact O-N 2.86Å
352	E	66.9	Low	72.1	Confident	113 Å²	113	65.7 Å²	65.7	53%	0.528	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.9	177.4	-70	-173.7	-156.4	0	0	114.2	K349 K434	K349-E352 HydrophobicContact CB-CB 4.27Å; K349-E352 HydrophobicContact CB-CG 4.29Å; K349-E352 HydrophobicContact CD-CG 4.26Å; K349-E352 WeakPolarHBondContact CD-OE1 3.33Å; K349-E352 WeakPolarHBondContact CD-OE2 3.07Å; K349-E352 IonicContact NZ-OE1 3.82Å; K349-E352 PolarHBondContact NZ-OE1 3.23Å; K349-E352 IonicContact NZ-OE2 2.66Å; K349-E352 PolarHBondContact NZ-OE2 2.96Å; K349-E352 PolarHBondContact O-N 2.96Å; E352-K434 WeakPolarHBondContact O-CD 3.33Å
353	G	73.1	Confident	72.9	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.01	41%	0.412	C	S	.	.			trans	-91.2	150.6	-175.1	0	0	0	0	0	115.5	D357 K434	G353-D357 WeakPolarHBondContact CA-OD2 3.31Å; G353-K434 WeakPolarHBondContact O-CB 3.5Å; G353-K434 PolarHBondContact O-N 3.18Å; G353-K434 VanDerWaalsContact O-N 3.11Å
354	V	86.3	Confident	74.1	Confident	39 Å²	39	65.2 Å²	65.2	24%	0.236	41%	0.409	C	S	.	.			trans	-84.6	159.1	166.7	-176.7	0	0	0	0	108.8	S356 D357 Y358 K434	V354-S356 WeakPolarHBondContact CB-OG 3.33Å; V354-S356 WeakPolarHBondContact CG1-OG 3.33Å; V354-S356 PolarHBondContact O-N 3.22Å; V354-D357 PolarHBondContact N-OD2 2.95Å; V354-D357 WeakPolarHBondContact O-CB 3.4Å; V354-D357 PolarHBondContact O-N 3.39Å; V354-Y358 WeakPolarHBondContact O-CD2 3.15Å; V354-K434 HydrophobicContact CG2-CB 4.38Å; V354-K434 HydrophobicContact CG2-CD 3.92Å
355	L	91.1	Very high	76.1	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.9	179.5	-176.1	60.4	0	0	0	113.4	D357 Y358 V359 P367 L433 L437 P472 N473 T476	L355-D357 PolarHBondContact O-N 3.38Å; L355-D357 VanDerWaalsContact O-N 3.11Å; L355-Y358 PolarHBondContact O-N 2.85Å; L355-Y358 VanDerWaalsContact O-N 3.13Å; L355-V359 HydrophobicContact CG-CG1 4.48Å; L355-P367 HydrophobicContact CD1-CG 3.5Å; L355-L433 HydrophobicContact CB-CD1 4.36Å; L355-L433 HydrophobicContact CB-CD2 4.44Å; L355-L433 HydrophobicContact CD1-CD1 4.09Å; L355-L433 HydrophobicContact CD1-CD2 4.22Å; L355-L437 HydrophobicContact CD2-CD1 3.52Å; L355-P472 HydrophobicContact CD2-CB 4.36Å; L355-P472 WeakPolarHBondContact CD2-O 3.35Å; L355-P472 HydrophobicContact CG-CB 4.23Å; L355-N473 HydrophobicContact CD2-CB 4.21Å; L355-T476 HydrophobicContact CD2-CG2 4.48Å
356	S	89.1	Confident	77.9	Confident	59 Å²	59	61 Å²	61	41%	0.413	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-51	-29.1	171.9	47.9	0	0	0	0	114.2	V354 Y358 V359	V354-S356 WeakPolarHBondContact CB-OG 3.33Å; V354-S356 WeakPolarHBondContact CG1-OG 3.33Å; V354-S356 PolarHBondContact O-N 3.22Å; S356-Y358 VanDerWaalsContact C-N 3.28Å; S356-Y358 PolarHBondContact O-N 2.82Å; S356-V359 WeakPolarHBondContact O-CG2 3.25Å
357	D	87.4	Confident	79.8	Confident	79 Å²	79	55 Å²	55	42%	0.422	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-84.8	-11	-171.2	-44.3	-16.9	0	0	0	110.9	I348 G353 V354 L355	I348-D357 HydrophobicContact CD1-CB 3.63Å; I348-D357 WeakPolarHBondContact CD1-O 3.29Å; G353-D357 WeakPolarHBondContact CA-OD2 3.31Å; V354-D357 PolarHBondContact N-OD2 2.95Å; V354-D357 WeakPolarHBondContact O-CB 3.4Å; V354-D357 PolarHBondContact O-N 3.39Å; L355-D357 PolarHBondContact O-N 3.38Å; L355-D357 VanDerWaalsContact O-N 3.11Å
358	Y	88.1	Confident	81.2	Confident	30 Å²	30	52.2 Å²	52.2	12%	0.118	30%	0.299	C	S	.	.	S	Bend	trans	-113.4	-2.6	-175.1	-57.9	-66.7	0	0	0	114.2	I348 V354 L355 S356 P367 P368 L405 F429 L433	I348-Y358 HydrophobicContact CB-CE1 4.12Å; I348-Y358 HydrophobicContact CD1-CD1 3.99Å; I348-Y358 HydrophobicContact CD1-CE1 3.79Å; I348-Y358 HydrophobicContact CG2-CE1 4.08Å; I348-Y358 WeakPolarHBondContact CG2-OH 3.13Å; V354-Y358 WeakPolarHBondContact O-CD2 3.15Å; L355-Y358 PolarHBondContact O-N 2.85Å; L355-Y358 VanDerWaalsContact O-N 3.13Å; S356-Y358 VanDerWaalsContact C-N 3.28Å; S356-Y358 PolarHBondContact O-N 2.82Å; Y358-P367 VanDerWaalsContact O-CA 3.3Å; Y358-P367 WeakPolarHBondContact O-CA 3.38Å; Y358-P367 WeakPolarHBondContact O-CB 3.43Å; Y358-P368 WeakPolarHBondContact O-CD 3.47Å; Y358-L405 HydrophobicContact CD1-CD2 4.18Å; Y358-L405 HydrophobicContact CE1-CD2 3.9Å; Y358-F429 HydrophobicContact CD1-CE2 4.4Å; Y358-F429 HydrophobicContact CD2-CE2 4.04Å; Y358-F429 HydrophobicContact CD2-CZ 4.03Å; Y358-F429 HydrophobicContact CE2-CE2 4.38Å; Y358-F429 HydrophobicContact CG-CE2 4.05Å; Y358-F429 HydrophobicContact CG-CZ 4.06Å; Y358-L433 HydrophobicContact CD2-CD2 3.99Å; Y358-L433 HydrophobicContact CE2-CD2 4.04Å
359	V	88.7	Confident	82.6	Confident	8 Å²	8	49.9 Å²	49.9	5%	0.048	29%	0.287	C	S	.	.	S	Bend	trans	-99.9	159.6	-176.7	-67.6	0	0	0	0	112.7	M343 L355 S356 M365 P367 P472	M343-V359 WeakPolarHBondContact CE-O 3.5Å; L355-V359 HydrophobicContact CG-CG1 4.48Å; S356-V359 WeakPolarHBondContact O-CG2 3.25Å; V359-M365 HydrophobicContact CB-CB 4.18Å; V359-M365 HydrophobicContact CG1-CB 4.45Å; V359-M365 WeakPolarHBondContact CG1-O 3.2Å; V359-M365 HydrophobicContact CG2-CB 4.34Å; V359-M365 HydrophobicContact CG2-CE 4.06Å; V359-P367 HydrophobicContact CG1-CG 3.8Å; V359-P472 HydrophobicContact CG1-CB 4.14Å; V359-P472 HydrophobicContact CG2-CB 4.1Å; V359-P472 HydrophobicContact CG2-CG 4.12Å
360	P	84.3	Confident	84.2	Confident	19 Å²	19	43.7 Å²	43.7	12%	0.123	26%	0.26	C	S	.	.			trans	-68.4	152.9	167.4	29.3	-35.8	0	0	0	112.4	M343 T362 M365 I366	M343-P360 HydrophobicContact SD-CB 4.37Å; P360-T362 PolarHBondContact O-N 3.11Å; P360-T362 VanDerWaalsContact O-N 3.17Å; P360-M365 WeakPolarHBondContact O-CE 3.49Å; P360-I366 WeakPolarHBondContact CD-O 3.13Å
361	D	81.5	Confident	85.5	Confident	137 Å²	137	40.7 Å²	40.7	73%	0.733	25%	0.245	S	C	*	.	S	Bend	trans	-65.9	-12.6	175.4	-65.6	-39.6	0	0	0	113.3	M343	M343-D361 HydrophobicContact CE-CB 4.27Å; M343-D361 VanDerWaalsContact CE-CG 3.42Å; M343-D361 WeakPolarHBondContact CE-OD1 3.19Å; M343-D361 WeakPolarHBondContact CE-OD2 3.39Å; M343-D361 HydrophobicContact SD-CB 4.16Å; M343-D361 PolarHBondContact SD-N 3.27Å; M343-D361 VanDerWaalsContact SD-N 3.38Å; M343-D361 VanDerWaalsContact SD-OD2 3.4Å
362	T	81.9	Confident	86.9	Confident	99 Å²	99	39.4 Å²	39.4	61%	0.607	23%	0.229	S	C	*	.	S	Bend	trans	-116.4	138.9	-177.4	56.9	0	0	0	0	111	P360	P360-T362 PolarHBondContact O-N 3.11Å; P360-T362 VanDerWaalsContact O-N 3.17Å
363	A	83.3	Confident	88.4	Confident	60 Å²	60	34 Å²	34	50%	0.496	20%	0.204	S	C	.	.	S	Bend	trans	-60.4	150.7	173.4	0	0	0	0	0	112.7
364	P	86.1	Confident	89.5	Confident	50 Å²	50	34 Å²	34	33%	0.325	20%	0.204	S	C	.	.	S	Bend	cis	-72	131.6	-7.1	31.4	-36	0	0	0	111.6	I366 D475	P364-I366 VanDerWaalsContact C-N 3.34Å; P364-I366 HydrophobicContact CB-CD1 3.82Å; P364-I366 HydrophobicContact CB-CG1 4.21Å; P364-I366 HydrophobicContact CG-CD1 4.01Å; P364-I366 PolarHBondContact O-N 2.92Å; P364-D475 HydrophobicContact CB-CB 4.46Å
365	M	91.9	Very high	89.9	Confident	35 Å²	35	33.9 Å²	33.9	17%	0.172	20%	0.204	C	C	.	.			trans	-82.3	74.9	-170.5	-61.4	-170.1	90.4	0	0	111.5	V359 P360 Q471 P472 D475 T476	V359-M365 HydrophobicContact CB-CB 4.18Å; V359-M365 HydrophobicContact CG1-CB 4.45Å; V359-M365 WeakPolarHBondContact CG1-O 3.2Å; V359-M365 HydrophobicContact CG2-CB 4.34Å; V359-M365 HydrophobicContact CG2-CE 4.06Å; P360-M365 WeakPolarHBondContact O-CE 3.49Å; M365-Q471 HydrophobicContact CG-CG 4.22Å; M365-Q471 HydrophobicContact SD-CB 4.33Å; M365-Q471 HydrophobicContact SD-CG 3.92Å; M365-P472 HydrophobicContact CB-CB 4.42Å; M365-P472 HydrophobicContact CB-CG 4.34Å; M365-P472 HydrophobicContact CE-CG 4.31Å; M365-P472 HydrophobicContact SD-CG 4.02Å; M365-D475 HydrophobicContact CB-CB 4.47Å; M365-D475 PolarHBondContact N-OD2 3.45Å; M365-T476 PolarHBondContact O-OG1 2.89Å
366	I	93	Very high	90.1	Very high	10 Å²	10	34.6 Å²	34.6	5%	0.051	21%	0.208	C	C	.	.			trans	-119.2	133.9	-174.5	-51.2	159.4	0	0	0	110.6	P360 P364 V370 V371 D475 F479 V547	P360-I366 WeakPolarHBondContact CD-O 3.13Å; P364-I366 VanDerWaalsContact C-N 3.34Å; P364-I366 HydrophobicContact CB-CD1 3.82Å; P364-I366 HydrophobicContact CB-CG1 4.21Å; P364-I366 HydrophobicContact CG-CD1 4.01Å; P364-I366 PolarHBondContact O-N 2.92Å; I366-V370 HydrophobicContact CG2-CB 4.21Å; I366-V370 HydrophobicContact CG2-CG1 4.09Å; I366-V371 HydrophobicContact CB-CG2 4.03Å; I366-V371 HydrophobicContact CG2-CG2 3.59Å; I366-D475 HydrophobicContact CG1-CB 4.31Å; I366-F479 HydrophobicContact CD1-CB 3.64Å; I366-F479 HydrophobicContact CD1-CD2 3.98Å; I366-F479 HydrophobicContact CD1-CG 3.82Å; I366-F479 HydrophobicContact CG1-CB 4.24Å; I366-F479 HydrophobicContact CG2-CB 4.4Å; I366-F479 HydrophobicContact CG2-CD1 3.92Å; I366-F479 HydrophobicContact CG2-CE1 4.49Å; I366-F479 HydrophobicContact CG2-CG 4.25Å; I366-V547 HydrophobicContact CD1-CG1 4.21Å
367	P	92.1	Very high	90.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.188	C	C	.	.			trans	-64.8	139.3	-178	-24.2	34.2	0	0	0	113.5	L355 Y358 V359 L369 V370 V371 F429 T476	L355-P367 HydrophobicContact CD1-CG 3.5Å; Y358-P367 VanDerWaalsContact O-CA 3.3Å; Y358-P367 WeakPolarHBondContact O-CA 3.38Å; Y358-P367 WeakPolarHBondContact O-CB 3.43Å; V359-P367 HydrophobicContact CG1-CG 3.8Å; P367-L369 PolarHBondContact O-N 3.48Å; P367-L369 VanDerWaalsContact O-N 3.12Å; P367-V370 HydrophobicContact CB-CB 4.43Å; P367-V370 HydrophobicContact CB-CG2 4.03Å; P367-V370 HydrophobicContact CG-CG2 4.09Å; P367-V370 WeakPolarHBondContact O-CB 3.36Å; P367-V370 PolarHBondContact O-N 2.93Å; P367-V371 PolarHBondContact O-N 3.37Å; P367-V371 VanDerWaalsContact O-N 3.14Å; P367-F429 HydrophobicContact CB-CE1 4.08Å; P367-F429 HydrophobicContact CB-CZ 3.98Å; P367-F429 HydrophobicContact CG-CE1 3.94Å; P367-F429 HydrophobicContact CG-CZ 3.99Å; P367-T476 VanDerWaalsContact CD-OG1 3.26Å; P367-T476 WeakPolarHBondContact CD-OG1 3.24Å
368	P	88.4	Confident	90.9	Very high	42 Å²	42	30.5 Å²	30.5	27%	0.273	18%	0.18	S	C	.	.	H	α-helix	trans	-56.7	-32.7	178.9	-24.4	31.7	0	0	0	114	I340 Y358 H372	I340-P368 HydrophobicContact CB-CB 4.47Å; I340-P368 HydrophobicContact CD1-CB 4Å; I340-P368 HydrophobicContact CG2-CB 4.22Å; I340-P368 HydrophobicContact CG2-CG 3.92Å; Y358-P368 WeakPolarHBondContact O-CD 3.47Å; P368-H372 WeakPolarHBondContact O-CB 3.21Å; P368-H372 PolarHBondContact O-CD2 3.16Å; P368-H372 PolarHBondContact O-N 3.22Å
369	L	92.3	Very high	91.2	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.047	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-47.4	173.9	-176	162	0	0	0	111.1	P367 C373 F404 L425 F429	P367-L369 PolarHBondContact O-N 3.48Å; P367-L369 VanDerWaalsContact O-N 3.12Å; L369-C373 WeakPolarHBondContact O-CB 3.41Å; L369-C373 PolarHBondContact O-N 2.69Å; L369-C373 PolarHBondContact O-SG 2.92Å; L369-F404 HydrophobicContact CB-CD1 3.95Å; L369-F404 HydrophobicContact CB-CE1 4.18Å; L369-F404 HydrophobicContact CB-CG 4.33Å; L369-F404 HydrophobicContact CD1-CB 3.84Å; L369-F404 HydrophobicContact CD1-CD1 4.41Å; L369-F404 HydrophobicContact CD1-CD2 4.27Å; L369-F404 HydrophobicContact CD1-CG 3.95Å; L369-F404 HydrophobicContact CG-CB 4.42Å; L369-F404 HydrophobicContact CG-CD1 4.1Å; L369-F404 HydrophobicContact CG-CD2 4.17Å; L369-F404 HydrophobicContact CG-CE1 4.37Å; L369-F404 HydrophobicContact CG-CE2 4.43Å; L369-F404 HydrophobicContact CG-CG 3.99Å; L369-L425 HydrophobicContact CD1-CD1 4.47Å; L369-L425 HydrophobicContact CD2-CG 4.47Å; L369-F429 HydrophobicContact CD1-CB 4.09Å; L369-F429 HydrophobicContact CD1-CD2 3.77Å; L369-F429 HydrophobicContact CD1-CE2 4.46Å; L369-F429 HydrophobicContact CD1-CG 3.96Å; L369-F429 HydrophobicContact CD2-CB 3.66Å; L369-F429 HydrophobicContact CD2-CD1 4.01Å; L369-F429 HydrophobicContact CD2-CD2 4.37Å; L369-F429 HydrophobicContact CD2-CG 3.74Å; L369-F429 HydrophobicContact CG-CG 4.43Å
370	V	95.4	Very high	91.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-48.8	-179.3	175.3	0	0	0	0	110.2	I366 P367 H372 C373 V374 L426 F429 L430 F479	I366-V370 HydrophobicContact CG2-CB 4.21Å; I366-V370 HydrophobicContact CG2-CG1 4.09Å; P367-V370 HydrophobicContact CB-CB 4.43Å; P367-V370 HydrophobicContact CB-CG2 4.03Å; P367-V370 HydrophobicContact CG-CG2 4.09Å; P367-V370 WeakPolarHBondContact O-CB 3.36Å; P367-V370 PolarHBondContact O-N 2.93Å; V370-H372 PolarHBondContact O-N 3.04Å; V370-C373 PolarHBondContact O-N 3.03Å; V370-V374 HydrophobicContact CG1-CG2 4.49Å; V370-V374 WeakPolarHBondContact O-CB 3.39Å; V370-V374 WeakPolarHBondContact O-CG2 3.15Å; V370-V374 PolarHBondContact O-N 3.31Å; V370-L426 HydrophobicContact CB-CD1 4.17Å; V370-L426 HydrophobicContact CG1-CD1 4.08Å; V370-L426 HydrophobicContact CG2-CD1 3.86Å; V370-F429 HydrophobicContact CG2-CD1 3.75Å; V370-F429 HydrophobicContact CG2-CE1 3.62Å; V370-L430 HydrophobicContact CG2-CD2 4.4Å; V370-F479 HydrophobicContact CG1-CD1 3.86Å; V370-F479 HydrophobicContact CG1-CE1 4.03Å
371	V	93.1	Very high	92	Very high	19 Å²	19	37.9 Å²	37.9	12%	0.115	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-46.2	-179.8	-176.9	0	0	0	0	111.9	P338 I340 I366 P367 S375 F479	P338-V371 HydrophobicContact CG-CG1 3.58Å; I340-V371 HydrophobicContact CD1-CB 3.63Å; I340-V371 HydrophobicContact CD1-CG1 3.75Å; I340-V371 HydrophobicContact CD1-CG2 4.14Å; I366-V371 HydrophobicContact CB-CG2 4.03Å; I366-V371 HydrophobicContact CG2-CG2 3.59Å; P367-V371 PolarHBondContact O-N 3.37Å; P367-V371 VanDerWaalsContact O-N 3.14Å; V371-S375 VanDerWaalsContact O-CB 3.3Å; V371-S375 WeakPolarHBondContact O-CB 3.47Å; V371-S375 PolarHBondContact O-N 3.42Å; V371-F479 HydrophobicContact CB-CE1 4.42Å; V371-F479 HydrophobicContact CB-CZ 4.32Å; V371-F479 HydrophobicContact CG1-CZ 4.17Å; V371-F479 HydrophobicContact CG2-CE1 4.2Å; V371-F479 HydrophobicContact CG2-CZ 4.26Å
372	H	92	Very high	92.8	Very high	12 Å²	12	33.3 Å²	33.3	6%	0.056	19%	0.185	C	C	.	.	H	α-helix	trans	-69.3	-37	179	-73.9	-55.7	0	0	0	113.2	L337 P338 P368 V370 E376 F404 L413	L337-H372 PolarHBondContact O-ND1 3.18Å; P338-H372 PolarHBondContact O-CE1 2.81Å; P368-H372 WeakPolarHBondContact O-CB 3.21Å; P368-H372 PolarHBondContact O-CD2 3.16Å; P368-H372 PolarHBondContact O-N 3.22Å; V370-H372 PolarHBondContact O-N 3.04Å; H372-E376 PolarHBondContact O-N 3.05Å; H372-E376 VanDerWaalsContact O-N 3.17Å; H372-F404 HydrophobicContact CB-CE1 4.4Å; H372-F404 HydrophobicContact CB-CZ 4.15Å; H372-L413 HydrophobicContact CB-CD1 4.11Å; H372-L413 WeakPolarHBondContact O-CD1 3.46Å
373	C	96.4	Very high	93.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-48.3	175.2	-67.8	0	0	0	0	111.4	L369 V370 E376 I377 I422 L426	L369-C373 WeakPolarHBondContact O-CB 3.41Å; L369-C373 PolarHBondContact O-N 2.69Å; L369-C373 PolarHBondContact O-SG 2.92Å; V370-C373 PolarHBondContact O-N 3.03Å; C373-E376 PolarHBondContact O-N 3.24Å; C373-I377 WeakPolarHBondContact O-CB 3.41Å; C373-I377 WeakPolarHBondContact O-CD1 3.48Å; C373-I377 WeakPolarHBondContact O-CG1 3.36Å; C373-I377 PolarHBondContact O-N 2.66Å; C373-I422 HydrophobicContact CB-CG2 3.95Å; C373-L426 HydrophobicContact CB-CB 4.15Å; C373-L426 HydrophobicContact CB-CD1 4.46Å; C373-L426 HydrophobicContact CB-CD2 4.47Å
374	V	97.1	Very high	94	Very high	1 Å²	1	35 Å²	35	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-47.1	176.8	165.5	0	0	0	0	111	V370 E376 I377 E378 L426 F479 H483	V370-V374 HydrophobicContact CG1-CG2 4.49Å; V370-V374 WeakPolarHBondContact O-CB 3.39Å; V370-V374 WeakPolarHBondContact O-CG2 3.15Å; V370-V374 PolarHBondContact O-N 3.31Å; V374-E376 VanDerWaalsContact C-N 3.31Å; V374-E376 PolarHBondContact O-N 3.14Å; V374-I377 PolarHBondContact O-N 2.88Å; V374-I377 VanDerWaalsContact O-N 3.16Å; V374-E378 HydrophobicContact CG1-CG 4.28Å; V374-E378 WeakPolarHBondContact O-CG 3.48Å; V374-E378 PolarHBondContact O-N 3.26Å; V374-L426 HydrophobicContact CG2-CD2 3.98Å; V374-F479 HydrophobicContact CB-CE1 3.59Å; V374-F479 HydrophobicContact CB-CZ 3.85Å; V374-F479 HydrophobicContact CG1-CE1 3.73Å; V374-F479 HydrophobicContact CG1-CZ 3.62Å; V374-F479 HydrophobicContact CG2-CD1 4.34Å; V374-F479 HydrophobicContact CG2-CE1 3.67Å; V374-F479 HydrophobicContact CG2-CZ 4.4Å; V374-H483 HydrophobicContact CG1-CB 3.84Å; V374-H483 HydrophobicContact CG2-CB 4.21Å
375	S	94.2	Very high	94.5	Very high	36 Å²	36	34.7 Å²	34.7	25%	0.252	18%	0.177	S	C	.	.	H	α-helix	trans	-57.6	-41.1	-180	-171.4	0	0	0	0	112.8	V371 Q379	V371-S375 VanDerWaalsContact O-CB 3.3Å; V371-S375 WeakPolarHBondContact O-CB 3.47Å; V371-S375 PolarHBondContact O-N 3.42Å; S375-Q379 VanDerWaalsContact O-CB 3.23Å; S375-Q379 WeakPolarHBondContact O-CB 3.49Å; S375-Q379 PolarHBondContact O-N 3.05Å
376	E	94.8	Very high	94.7	Very high	20 Å²	20	33.6 Å²	33.6	9%	0.093	18%	0.175	C	C	.	.	H	α-helix	trans	-72.8	-38.6	177.7	-175.4	88.5	-153.8	0	0	112	H372 C373 V374 Q379 R380 L413 S414 I419 I422	H372-E376 PolarHBondContact O-N 3.05Å; H372-E376 VanDerWaalsContact O-N 3.17Å; C373-E376 PolarHBondContact O-N 3.24Å; V374-E376 VanDerWaalsContact C-N 3.31Å; V374-E376 PolarHBondContact O-N 3.14Å; E376-Q379 PolarHBondContact O-N 3.21Å; E376-R380 WeakPolarHBondContact O-CG 3.13Å; E376-R380 PolarHBondContact O-N 3.34Å; E376-R380 VanDerWaalsContact O-N 3.12Å; E376-R380 IonicContact OE1-CZ 2.86Å; E376-R380 IonicContact OE1-NE 3.4Å; E376-R380 PolarHBondContact OE1-NE 3.25Å; E376-R380 IonicContact OE1-NH2 3.69Å; E376-R380 PolarHBondContact OE1-NH2 3.04Å; E376-L413 HydrophobicContact CB-CB 4.17Å; E376-L413 HydrophobicContact CB-CD1 4.17Å; E376-L413 HydrophobicContact CG-CB 3.87Å; E376-L413 VanDerWaalsContact OE2-C 3.27Å; E376-L413 VanDerWaalsContact OE2-CB 3.23Å; E376-L413 WeakPolarHBondContact OE2-CB 3.37Å; E376-S414 WeakPolarHBondContact OE1-CA 3.41Å; E376-S414 PolarHBondContact OE1-N 3.17Å; E376-S414 PolarHBondContact OE2-N 3.16Å; E376-I419 HydrophobicContact CG-CD1 4.49Å; E376-I422 HydrophobicContact CB-CD1 4.46Å; E376-I422 HydrophobicContact CG-CD1 3.64Å
377	I	97.5	Very high	94.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-35.2	177.5	-64.3	162.6	0	0	0	111.3	C373 V374 G381 L382 L387 Y388 I419 I422 T423	C373-I377 WeakPolarHBondContact O-CB 3.41Å; C373-I377 WeakPolarHBondContact O-CD1 3.48Å; C373-I377 WeakPolarHBondContact O-CG1 3.36Å; C373-I377 PolarHBondContact O-N 2.66Å; V374-I377 PolarHBondContact O-N 2.88Å; V374-I377 VanDerWaalsContact O-N 3.16Å; I377-G381 CarbonylContact O-C 3.52Å; I377-G381 WeakPolarHBondContact O-CA 3.43Å; I377-G381 PolarHBondContact O-N 3.43Å; I377-L382 PolarHBondContact O-N 3.14Å; I377-L387 HydrophobicContact CG2-CD1 3.96Å; I377-L387 HydrophobicContact CG2-CD2 4.3Å; I377-Y388 HydrophobicContact CD1-CE1 4.38Å; I377-Y388 WeakPolarHBondContact CD1-OH 3.35Å; I377-Y388 HydrophobicContact CG2-CE2 4.48Å; I377-I419 HydrophobicContact CG1-CD1 3.91Å; I377-I419 HydrophobicContact CG1-CG1 4.35Å; I377-I422 HydrophobicContact CD1-CG2 4Å; I377-I422 HydrophobicContact CG1-CB 4.41Å; I377-I422 HydrophobicContact CG1-CG2 4.04Å; I377-T423 HydrophobicContact CD1-CG2 3.95Å; I377-T423 HydrophobicContact CG1-CG2 4.33Å
378	E	96.4	Very high	95.2	Very high	52 Å²	52	33.1 Å²	33.1	24%	0.243	17%	0.172	C	C	.	.	H	α-helix	trans	-72.3	-39.2	172	-67.5	-172.1	163.7	0	0	112.2	V374 R380 L382 H483 R486	V374-E378 HydrophobicContact CG1-CG 4.28Å; V374-E378 WeakPolarHBondContact O-CG 3.48Å; V374-E378 PolarHBondContact O-N 3.26Å; E378-R380 PolarHBondContact O-N 2.87Å; E378-L382 HydrophobicContact CB-CD1 4.41Å; E378-H483 WeakPolarHBondContact CG-ND1 3.23Å; E378-H483 IonicContact OE1-CE1 3.44Å; E378-H483 IonicContact OE1-CG 3.51Å; E378-H483 IonicContact OE1-ND1 3.6Å; E378-H483 PolarHBondContact OE1-ND1 2.88Å; E378-R486 WeakPolarHBondContact OE1-CD 3.35Å; E378-R486 IonicContact OE1-CZ 3.83Å; E378-R486 IonicContact OE1-NE 3.72Å; E378-R486 IonicContact OE1-NH1 2.68Å; E378-R486 PolarHBondContact OE1-NH1 2.95Å; E378-R486 IonicContact OE2-CZ 3.09Å; E378-R486 IonicContact OE2-NH1 3.78Å; E378-R486 PolarHBondContact OE2-NH1 3.37Å
379	Q	94.4	Very high	95.6	Very high	150 Å²	150	38.8 Å²	38.8	70%	0.701	19%	0.189	S	C	*	.	H	α-helix	trans	-64.6	-35.5	-178.8	-177	173	12.4	0	0	113.5	S375 E376	S375-Q379 VanDerWaalsContact O-CB 3.23Å; S375-Q379 WeakPolarHBondContact O-CB 3.49Å; S375-Q379 PolarHBondContact O-N 3.05Å; E376-Q379 PolarHBondContact O-N 3.21Å
380	R	95.3	Very high	95.8	Very high	61 Å²	61	42.2 Å²	42.2	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-147.2	4.9	-175	65.5	160	177.5	114.9	-0.9	116.8	E376 E378 H383 L413 V416 D417 I419	E376-R380 WeakPolarHBondContact O-CG 3.13Å; E376-R380 PolarHBondContact O-N 3.34Å; E376-R380 VanDerWaalsContact O-N 3.12Å; E376-R380 IonicContact OE1-CZ 2.86Å; E376-R380 IonicContact OE1-NE 3.4Å; E376-R380 PolarHBondContact OE1-NE 3.25Å; E376-R380 IonicContact OE1-NH2 3.69Å; E376-R380 PolarHBondContact OE1-NH2 3.04Å; E378-R380 PolarHBondContact O-N 2.87Å; R380-H383 PolarHBondContact O-CE1 3.46Å; R380-H383 PolarHBondContact O-NE2 2.85Å; R380-L413 PolarHBondContact NH2-O 3.36Å; R380-V416 PolarHBondContact NH1-O 3.18Å; R380-V416 PolarHBondContact NH2-O 3.14Å; R380-D417 PolarHBondContact NH1-O 2.72Å; R380-I419 HydrophobicContact CG-CD1 4.43Å
381	G	95.5	Very high	95.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-23.4	179.5	0	0	0	0	0	114.3	I377 H383 E384 L387	I377-G381 CarbonylContact O-C 3.52Å; I377-G381 WeakPolarHBondContact O-CA 3.43Å; I377-G381 PolarHBondContact O-N 3.43Å; G381-H383 PolarHBondContact O-N 3.04Å; G381-E384 WeakPolarHBondContact O-CB 3.36Å; G381-E384 PolarHBondContact O-N 3.32Å; G381-L387 WeakPolarHBondContact O-CD1 3.46Å; G381-L387 WeakPolarHBondContact O-CG 3.46Å
382	L	96.9	Very high	95.8	Very high	41 Å²	41	46.2 Å²	46.2	22%	0.215	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.5	-170.7	-61.8	177.5	0	0	0	115.2	I377 E378 L387 V487 S490 T493	I377-L382 PolarHBondContact O-N 3.14Å; E378-L382 HydrophobicContact CB-CD1 4.41Å; L382-L387 HydrophobicContact CD2-CD1 4.3Å; L382-V487 HydrophobicContact CD2-CG2 3.81Å; L382-S490 PolarHBondContact O-OG 3.27Å; L382-T493 VanDerWaalsContact O-CG2 3.28Å; L382-T493 WeakPolarHBondContact O-CG2 3.43Å
383	H	94.6	Very high	96	Very high	112 Å²	112	48.2 Å²	48.2	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	1.3	172.2	55.4	-95.6	0	0	0	113.7	R380 G381	R380-H383 PolarHBondContact O-CE1 3.46Å; R380-H383 PolarHBondContact O-NE2 2.85Å; G381-H383 PolarHBondContact O-N 3.04Å
384	E	96.3	Very high	95.8	Very high	84 Å²	84	53.4 Å²	53.4	39%	0.393	28%	0.283	S	S	.	.	S	Bend	trans	-96.7	126.3	-177.9	-70.7	-69.5	-179.3	0	0	111.9	G381 L387 I419	G381-E384 WeakPolarHBondContact O-CB 3.36Å; G381-E384 PolarHBondContact O-N 3.32Å; E384-L387 HydrophobicContact CB-CD2 4.44Å; E384-I419 HydrophobicContact CB-CG2 4.07Å; E384-I419 HydrophobicContact CG-CG2 3.99Å
385	A	96.4	Very high	95.7	Very high	42 Å²	42	62.8 Å²	62.8	35%	0.347	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	135.4	-175.9	0	0	0	0	0	111.9	L390 K494	A385-L390 WeakPolarHBondContact O-CD1 3.42Å; A385-K494 HydrophobicContact CB-CD 4.43Å
386	G	95.9	Very high	95.7	Very high	12 Å²	12	63.5 Å²	63.5	12%	0.124	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	28.1	177.2	0	0	0	0	0	114.7	Y388 R389 L390 T493	G386-Y388 PolarHBondContact O-N 2.95Å; G386-R389 PolarHBondContact O-N 3.42Å; G386-R389 VanDerWaalsContact O-N 3.11Å; G386-L390 PolarHBondContact O-N 3.02Å; G386-T493 PolarHBondContact N-O 3.37Å
387	L	97.4	Very high	95.8	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.2	136.9	167	-80.4	-170.2	0	0	0	111.2	I377 G381 L382 E384 R389 I419 T423 V487 T493 M495	I377-L387 HydrophobicContact CG2-CD1 3.96Å; I377-L387 HydrophobicContact CG2-CD2 4.3Å; G381-L387 WeakPolarHBondContact O-CD1 3.46Å; G381-L387 WeakPolarHBondContact O-CG 3.46Å; L382-L387 HydrophobicContact CD2-CD1 4.3Å; E384-L387 HydrophobicContact CB-CD2 4.44Å; L387-R389 PolarHBondContact O-N 3.11Å; L387-I419 HydrophobicContact CD2-CG1 4.31Å; L387-I419 HydrophobicContact CD2-CG2 4.18Å; L387-T423 HydrophobicContact CD2-CG2 3.88Å; L387-V487 HydrophobicContact CB-CG1 4.16Å; L387-V487 HydrophobicContact CD1-CG1 4.02Å; L387-V487 HydrophobicContact CD1-CG2 4.07Å; L387-T493 HydrophobicContact CD1-CG2 3.96Å; L387-T493 HydrophobicContact CG-CG2 4.36Å; L387-M495 WeakPolarHBondContact O-CE 3.46Å; L387-M495 WeakPolarHBondContact O-CG 3.35Å
388	Y	98.2	Very high	95.5	Very high	1 Å²	1	69.8 Å²	69.8	0%	0.004	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	-26.9	-174.7	-59.9	-76.4	0	0	0	117	I377 G386 T423 L426 K427 H483 L484 V487 L500 V503 F504	I377-Y388 HydrophobicContact CD1-CE1 4.38Å; I377-Y388 WeakPolarHBondContact CD1-OH 3.35Å; I377-Y388 HydrophobicContact CG2-CE2 4.48Å; G386-Y388 PolarHBondContact O-N 2.95Å; Y388-T423 HydrophobicContact CD1-CG2 4.14Å; Y388-T423 HydrophobicContact CE1-CG2 4.09Å; Y388-T423 HydrophobicContact CG-CG2 4.37Å; Y388-L426 HydrophobicContact CE1-CD2 4.08Å; Y388-L426 WeakPolarHBondContact OH-CD2 3.46Å; Y388-K427 HydrophobicContact CD1-CD 4.2Å; Y388-K427 HydrophobicContact CD1-CG 4.06Å; Y388-K427 WeakPolarHBondContact O-CE 3.18Å; Y388-K427 PolarHBondContact O-NZ 3.25Å; Y388-H483 AromaticContact CE2-NE2 3.55Å; Y388-H483 AromaticContact CZ-NE2 3.6Å; Y388-H483 PolarHBondContact OH-CD2 3.42Å; Y388-H483 PolarHBondContact OH-NE2 3.3Å; Y388-L484 HydrophobicContact CD2-CD2 4.04Å; Y388-L484 HydrophobicContact CE2-CD2 3.8Å; Y388-V487 HydrophobicContact CE2-CG2 4.21Å; Y388-L500 HydrophobicContact CD2-CD2 4.19Å; Y388-V503 WeakPolarHBondContact O-CG1 3.17Å; Y388-F504 AromaticContact CD1-CE2 3.69Å; Y388-F504 HydrophobicContact CD1-CE2 3.69Å; Y388-F504 AromaticContact CD1-CZ 3.47Å; Y388-F504 HydrophobicContact CD1-CZ 3.47Å; Y388-F504 VanDerWaalsContact CD1-CZ 3.47Å; Y388-F504 HydrophobicContact CD2-CE2 4.05Å; Y388-F504 HydrophobicContact CD2-CZ 4.39Å; Y388-F504 HydrophobicContact CE1-CE2 4.25Å; Y388-F504 AromaticContact CE1-CZ 3.67Å; Y388-F504 HydrophobicContact CE1-CZ 3.67Å; Y388-F504 AromaticContact CG-CE2 3.59Å; Y388-F504 HydrophobicContact CG-CE2 3.59Å; Y388-F504 AromaticContact CG-CZ 3.87Å; Y388-F504 HydrophobicContact CG-CZ 3.87Å
389	R	97.2	Very high	95.3	Very high	162 Å²	162	70.4 Å²	70.4	61%	0.611	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-42.9	173.4	175.6	175.9	175.4	179.5	-0.8	112.3	G386 L387 M495 V503	G386-R389 PolarHBondContact O-N 3.42Å; G386-R389 VanDerWaalsContact O-N 3.11Å; L387-R389 PolarHBondContact O-N 3.11Å; R389-M495 HydrophobicContact CB-CE 3.73Å; R389-M495 HydrophobicContact CB-SD 3.52Å; R389-M495 VanDerWaalsContact CB-SD 3.52Å; R389-M495 HydrophobicContact CG-SD 4.37Å; R389-V503 HydrophobicContact CB-CG2 4.49Å
390	L	96.5	Very high	95.2	Very high	81 Å²	81	63.8 Å²	63.8	42%	0.424	32%	0.323	S	S	.	.	S	Bend	trans	-75.4	154.8	173.9	-60.5	-178.5	0	0	0	110.8	A385 G386 H420 K427	A385-L390 WeakPolarHBondContact O-CD1 3.42Å; G386-L390 PolarHBondContact O-N 3.02Å; L390-H420 HydrophobicContact CB-CB 4.45Å; L390-K427 PolarHBondContact O-NZ 3.1Å
391	S	94.9	Very high	94.9	Very high	95 Å²	95	61.7 Å²	61.7	66%	0.664	32%	0.316	S	S	*	.			trans	-114.3	125.2	176.2	-69.9	0	0	0	0	109.1
392	G	94.4	Very high	94.5	Very high	9 Å²	9	65.8 Å²	65.8	9%	0.093	34%	0.335	C	S	.	.			trans	-73.7	178.8	167	0	0	0	0	0	112.2	D394 D418 H420	G392-D394 PolarHBondContact O-N 2.88Å; G392-D418 WeakPolarHBondContact CA-OD2 3.34Å; G392-H420 PolarHBondContact N-O 3.04Å
393	A	95.3	Very high	94	Very high	53 Å²	53	67.8 Å²	67.8	44%	0.438	34%	0.342	S	S	.	.			trans	-64.4	117.3	-175.8	0	0	0	0	0	112.7	R395 T396 V397 D418	A393-R395 PolarHBondContact O-N 2.92Å; A393-T396 WeakPolarHBondContact O-CA 3.48Å; A393-T396 VanDerWaalsContact O-CB 3.29Å; A393-T396 WeakPolarHBondContact O-CB 3.41Å; A393-T396 PolarHBondContact O-N 3.37Å; A393-V397 PolarHBondContact O-N 2.86Å; A393-D418 PolarHBondContact N-OD2 3.05Å
394	D	93.1	Very high	93.6	Very high	109 Å²	109	63.7 Å²	63.7	58%	0.583	32%	0.323	S	S	*	.	H	α-helix	trans	-47.5	-38.9	-179.6	-87.8	6.9	0	0	0	114.3	G392 V397 K398	G392-D394 PolarHBondContact O-N 2.88Å; D394-V397 PolarHBondContact O-N 2.67Å; D394-K398 WeakPolarHBondContact O-CG 3.23Å; D394-K398 PolarHBondContact O-N 3.02Å
395	R	95	Very high	92.9	Very high	198 Å²	198	61.1 Å²	61.1	75%	0.747	31%	0.312	S	S	*	.	H	α-helix	trans	-60.3	-49.5	176	-176.5	177.2	179.5	169.2	3.3	110.6	A393 V397 K398 D399	A393-R395 PolarHBondContact O-N 2.92Å; R395-V397 VanDerWaalsContact C-N 3.33Å; R395-V397 PolarHBondContact O-N 3.36Å; R395-K398 PolarHBondContact O-N 3.32Å; R395-D399 WeakPolarHBondContact O-CB 3.41Å; R395-D399 PolarHBondContact O-N 3.44Å
396	T	94.3	Very high	92	Very high	51 Å²	51	67.6 Å²	67.6	31%	0.313	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-41	177.2	-51.7	0	0	0	0	111.5	A393 D399 L400 V416 A421	A393-T396 WeakPolarHBondContact O-CA 3.48Å; A393-T396 VanDerWaalsContact O-CB 3.29Å; A393-T396 WeakPolarHBondContact O-CB 3.41Å; A393-T396 PolarHBondContact O-N 3.37Å; T396-D399 PolarHBondContact O-N 2.65Å; T396-L400 HydrophobicContact CG2-CD1 4Å; T396-L400 HydrophobicContact CG2-CG 4.47Å; T396-L400 WeakPolarHBondContact O-CB 3.17Å; T396-L400 WeakPolarHBondContact O-CG 3.48Å; T396-L400 PolarHBondContact O-N 2.89Å; T396-V416 HydrophobicContact CG2-CG1 3.87Å; T396-A421 HydrophobicContact CG2-CB 3.88Å
397	V	95.3	Very high	90.6	Very high	12 Å²	12	69.5 Å²	69.5	7%	0.073	34%	0.339	C	S	.	.	H	α-helix	trans	-59.1	-51.3	175.1	178.3	0	0	0	0	111	A393 D394 R395 L400 K401 A421 D428	A393-V397 PolarHBondContact O-N 2.86Å; D394-V397 PolarHBondContact O-N 2.67Å; R395-V397 VanDerWaalsContact C-N 3.33Å; R395-V397 PolarHBondContact O-N 3.36Å; V397-L400 PolarHBondContact O-N 3.47Å; V397-K401 WeakPolarHBondContact O-CB 3.38Å; V397-K401 PolarHBondContact O-N 3.26Å; V397-A421 HydrophobicContact CG2-CB 4.38Å; V397-D428 HydrophobicContact CG1-CB 4.2Å
398	K	92.3	Very high	88.9	Confident	141 Å²	141	77.5 Å²	77.5	61%	0.613	37%	0.373	S	S	*	.	H	α-helix	trans	-62.8	-46.7	178.6	-71.4	170.6	-179.6	174	0	111.9	D394 R395 L400 K401 E402	D394-K398 WeakPolarHBondContact O-CG 3.23Å; D394-K398 PolarHBondContact O-N 3.02Å; R395-K398 PolarHBondContact O-N 3.32Å; K398-L400 VanDerWaalsContact C-N 3.3Å; K398-L400 PolarHBondContact O-N 2.92Å; K398-K401 PolarHBondContact O-N 2.93Å; K398-E402 PolarHBondContact O-N 3.03Å
399	D	91.4	Very high	87.4	Confident	65 Å²	65	80.5 Å²	80.5	35%	0.348	39%	0.392	S	S	.	.	H	α-helix	trans	-55	-42.2	175.6	-103.1	55.9	0	0	0	112.5	R395 T396 K403	R395-D399 WeakPolarHBondContact O-CB 3.41Å; R395-D399 PolarHBondContact O-N 3.44Å; T396-D399 PolarHBondContact O-N 2.65Å; D399-K403 WeakPolarHBondContact O-CB 3.49Å; D399-K403 WeakPolarHBondContact O-CD 3.43Å; D399-K403 VanDerWaalsContact O-CE 3.27Å; D399-K403 WeakPolarHBondContact O-CE 3.44Å; D399-K403 WeakPolarHBondContact O-CG 3.29Å; D399-K403 PolarHBondContact O-N 2.91Å; D399-K403 IonicContact OD2-NZ 2.97Å; D399-K403 PolarHBondContact OD2-NZ 3.47Å
400	L	92.3	Very high	86.2	Confident	10 Å²	10	74.6 Å²	74.6	5%	0.052	37%	0.374	C	S	.	.	H	α-helix	trans	-74.5	-38.9	177.6	-69.8	167.4	0	0	0	112.1	T396 V397 K398 K403 F404 P411 L413 V416 L425	T396-L400 HydrophobicContact CG2-CD1 4Å; T396-L400 HydrophobicContact CG2-CG 4.47Å; T396-L400 WeakPolarHBondContact O-CB 3.17Å; T396-L400 WeakPolarHBondContact O-CG 3.48Å; T396-L400 PolarHBondContact O-N 2.89Å; V397-L400 PolarHBondContact O-N 3.47Å; K398-L400 VanDerWaalsContact C-N 3.3Å; K398-L400 PolarHBondContact O-N 2.92Å; L400-K403 PolarHBondContact O-N 3.35Å; L400-F404 PolarHBondContact O-N 2.95Å; L400-P411 HydrophobicContact CD2-CB 4.36Å; L400-P411 HydrophobicContact CD2-CG 4.48Å; L400-L413 HydrophobicContact CD2-CD2 4.37Å; L400-V416 HydrophobicContact CD1-CG1 3.99Å; L400-V416 HydrophobicContact CD1-CG2 3.82Å; L400-V416 HydrophobicContact CD2-CG2 3.79Å; L400-V416 HydrophobicContact CG-CG2 4.38Å; L400-L425 HydrophobicContact CB-CD1 4.23Å; L400-L425 HydrophobicContact CB-CD2 3.79Å; L400-L425 HydrophobicContact CD1-CD2 4.34Å
401	K	89.9	Confident	85.4	Confident	17 Å²	17	71.5 Å²	71.5	7%	0.074	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-44.7	177.4	-168.3	178.7	-166.8	177.5	0	111.6	I350 V397 K398 F404 L405 L425 D428 N432	I350-K401 HydrophobicContact CG2-CD 4.16Å; V397-K401 WeakPolarHBondContact O-CB 3.38Å; V397-K401 PolarHBondContact O-N 3.26Å; K398-K401 PolarHBondContact O-N 2.93Å; K401-F404 PolarHBondContact O-N 3.15Å; K401-L405 HydrophobicContact CG-CD1 3.86Å; K401-L405 WeakPolarHBondContact O-CB 3.24Å; K401-L405 WeakPolarHBondContact O-CG 3.48Å; K401-L405 PolarHBondContact O-N 3.31Å; K401-L425 HydrophobicContact CB-CD1 3.7Å; K401-L425 HydrophobicContact CG-CD1 4.27Å; K401-D428 VanDerWaalsContact CD-OD2 3.27Å; K401-D428 WeakPolarHBondContact CD-OD2 3.37Å; K401-D428 WeakPolarHBondContact CE-OD2 3.25Å; K401-D428 PolarHBondContact NZ-O 3.41Å; K401-D428 IonicContact NZ-OD2 2.68Å; K401-D428 PolarHBondContact NZ-OD2 3.45Å; K401-N432 PolarHBondContact NZ-ND2 3.46Å
402	E	87.8	Confident	84.6	Confident	86 Å²	86	68.1 Å²	68.1	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-44.7	172.5	-174.8	178.1	-164.6	0	0	111.1	I350 K398 F404 L405 R406	I350-E402 HydrophobicContact CD1-CB 4.44Å; K398-E402 PolarHBondContact O-N 3.03Å; E402-F404 PolarHBondContact O-N 2.99Å; E402-L405 PolarHBondContact O-N 3.32Å; E402-R406 HydrophobicContact CG-CB 3.95Å; E402-R406 WeakPolarHBondContact O-CA 3.45Å; E402-R406 WeakPolarHBondContact O-CB 3.31Å; E402-R406 PolarHBondContact O-N 2.78Å; E402-R406 WeakPolarHBondContact OE1-CD 3.35Å; E402-R406 IonicContact OE1-CZ 2.78Å; E402-R406 IonicContact OE1-NE 2.66Å; E402-R406 IonicContact OE1-NH1 3.51Å; E402-R406 PolarHBondContact OE1-NH1 3.46Å
403	K	85.7	Confident	84.3	Confident	83 Å²	83	68 Å²	68	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-58	-45.7	178.9	-73.9	158.4	-159.9	152.1	0	111.7	D399 L400 S407 P411	D399-K403 WeakPolarHBondContact O-CB 3.49Å; D399-K403 WeakPolarHBondContact O-CD 3.43Å; D399-K403 VanDerWaalsContact O-CE 3.27Å; D399-K403 WeakPolarHBondContact O-CE 3.44Å; D399-K403 WeakPolarHBondContact O-CG 3.29Å; D399-K403 PolarHBondContact O-N 2.91Å; D399-K403 IonicContact OD2-NZ 2.97Å; D399-K403 PolarHBondContact OD2-NZ 3.47Å; L400-K403 PolarHBondContact O-N 3.35Å; K403-S407 WeakPolarHBondContact O-CB 3.33Å; K403-S407 PolarHBondContact O-N 3.44Å; K403-S407 VanDerWaalsContact O-N 3.14Å; K403-S407 PolarHBondContact O-OG 3.48Å; K403-P411 HydrophobicContact CB-CB 4Å; K403-P411 HydrophobicContact CB-CG 4.15Å
404	F	85.1	Confident	83.8	Confident	26 Å²	26	69.1 Å²	69.1	11%	0.114	34%	0.336	C	S	.	.	H	α-helix	trans	-64.2	-47.6	176	-93.7	-76.8	0	0	0	113.8	L369 H372 L400 K401 E402 V410 P411 L413 L425	L369-F404 HydrophobicContact CB-CD1 3.95Å; L369-F404 HydrophobicContact CB-CE1 4.18Å; L369-F404 HydrophobicContact CB-CG 4.33Å; L369-F404 HydrophobicContact CD1-CB 3.84Å; L369-F404 HydrophobicContact CD1-CD1 4.41Å; L369-F404 HydrophobicContact CD1-CD2 4.27Å; L369-F404 HydrophobicContact CD1-CG 3.95Å; L369-F404 HydrophobicContact CG-CB 4.42Å; L369-F404 HydrophobicContact CG-CD1 4.1Å; L369-F404 HydrophobicContact CG-CD2 4.17Å; L369-F404 HydrophobicContact CG-CE1 4.37Å; L369-F404 HydrophobicContact CG-CE2 4.43Å; L369-F404 HydrophobicContact CG-CG 3.99Å; H372-F404 HydrophobicContact CB-CE1 4.4Å; H372-F404 HydrophobicContact CB-CZ 4.15Å; L400-F404 PolarHBondContact O-N 2.95Å; K401-F404 PolarHBondContact O-N 3.15Å; E402-F404 PolarHBondContact O-N 2.99Å; F404-V410 HydrophobicContact CE1-CG1 3.92Å; F404-V410 HydrophobicContact CE1-CG2 4.47Å; F404-V410 HydrophobicContact CZ-CG1 4.12Å; F404-P411 HydrophobicContact CD1-CG 4.4Å; F404-P411 HydrophobicContact CD2-CG 3.39Å; F404-P411 HydrophobicContact CE1-CG 4.37Å; F404-P411 HydrophobicContact CE2-CG 3.36Å; F404-P411 HydrophobicContact CG-CG 3.94Å; F404-P411 HydrophobicContact CZ-CG 3.89Å; F404-L413 HydrophobicContact CE2-CD1 4.41Å; F404-L413 HydrophobicContact CE2-CD2 4.02Å; F404-L413 HydrophobicContact CE2-CG 4.36Å; F404-L413 HydrophobicContact CZ-CD1 4.18Å; F404-L413 HydrophobicContact CZ-CG 4.37Å; F404-L425 HydrophobicContact CD2-CD2 3.87Å; F404-L425 HydrophobicContact CE2-CD2 3.73Å
405	L	82.1	Confident	83.5	Confident	31 Å²	31	69 Å²	69	16%	0.162	33%	0.33	C	S	.	.	H	α-helix	trans	-85.3	-22.7	-169.9	-61.2	177.2	0	0	0	113.4	I350 Y358 K401 E402 F429	I350-L405 HydrophobicContact CB-CD1 4.21Å; I350-L405 HydrophobicContact CD1-CB 4.44Å; I350-L405 HydrophobicContact CD1-CD1 4.31Å; I350-L405 HydrophobicContact CG1-CB 4.11Å; I350-L405 HydrophobicContact CG1-CD1 3.81Å; I350-L405 HydrophobicContact CG2-CD1 3.85Å; Y358-L405 HydrophobicContact CD1-CD2 4.18Å; Y358-L405 HydrophobicContact CE1-CD2 3.9Å; K401-L405 HydrophobicContact CG-CD1 3.86Å; K401-L405 WeakPolarHBondContact O-CB 3.24Å; K401-L405 WeakPolarHBondContact O-CG 3.48Å; K401-L405 PolarHBondContact O-N 3.31Å; E402-L405 PolarHBondContact O-N 3.32Å; L405-F429 HydrophobicContact CD2-CE2 4.5Å
406	R	76.9	Confident	83.4	Confident	178 Å²	178	60.3 Å²	60.3	67%	0.672	30%	0.299	S	S	*	.	H	α-helix	trans	-107.6	-23.4	-175.7	-154.8	177.3	-169.8	174	5	113.8	E402	E402-R406 HydrophobicContact CG-CB 3.95Å; E402-R406 WeakPolarHBondContact O-CA 3.45Å; E402-R406 WeakPolarHBondContact O-CB 3.31Å; E402-R406 PolarHBondContact O-N 2.78Å; E402-R406 WeakPolarHBondContact OE1-CD 3.35Å; E402-R406 IonicContact OE1-CZ 2.78Å; E402-R406 IonicContact OE1-NE 2.66Å; E402-R406 IonicContact OE1-NH1 3.51Å; E402-R406 PolarHBondContact OE1-NH1 3.46Å
407	S	67.4	Low	83.3	Confident	52 Å²	52	65.1 Å²	65.1	36%	0.364	32%	0.323	S	S	.	.	S	Bend	trans	-95	142.3	-179.9	-41.4	0	0	0	0	111.5	K403 T409	K403-S407 WeakPolarHBondContact O-CB 3.33Å; K403-S407 PolarHBondContact O-N 3.44Å; K403-S407 VanDerWaalsContact O-N 3.14Å; K403-S407 PolarHBondContact O-OG 3.48Å; S407-T409 PolarHBondContact O-N 3.32Å
408	K	61.7	Low	83.3	Confident	168 Å²	168	67.2 Å²	67.2	73%	0.73	33%	0.334	S	S	*	.	S	Bend	trans	-74.5	19.8	174.2	-58	-169.3	177.4	-168.9	0	113.8	N342	N342-K408 PolarHBondContact ND2-O 3.49Å
409	T	66.6	Low	83.5	Confident	64 Å²	64	60.9 Å²	60.9	39%	0.393	31%	0.306	S	S	.	.	S	Bend	trans	-150.8	129.8	-170	52.2	0	0	0	0	110.4	S407	S407-T409 PolarHBondContact O-N 3.32Å
410	V	72.4	Confident	83.8	Confident	37 Å²	37	59.2 Å²	59.2	22%	0.224	30%	0.296	C	S	.	.			trans	-57.7	128.4	173.4	175.2	0	0	0	0	110.3	F404	F404-V410 HydrophobicContact CE1-CG1 3.92Å; F404-V410 HydrophobicContact CE1-CG2 4.47Å; F404-V410 HydrophobicContact CZ-CG1 4.12Å
411	P	78.8	Confident	84.1	Confident	17 Å²	17	58.7 Å²	58.7	11%	0.11	29%	0.294	C	S	.	.			trans	-69.7	154.6	174.2	29.4	-34.1	0	0	0	111.5	L400 K403 F404 L413	L400-P411 HydrophobicContact CD2-CB 4.36Å; L400-P411 HydrophobicContact CD2-CG 4.48Å; K403-P411 HydrophobicContact CB-CB 4Å; K403-P411 HydrophobicContact CB-CG 4.15Å; F404-P411 HydrophobicContact CD1-CG 4.4Å; F404-P411 HydrophobicContact CD2-CG 3.39Å; F404-P411 HydrophobicContact CE1-CG 4.37Å; F404-P411 HydrophobicContact CE2-CG 3.36Å; F404-P411 HydrophobicContact CG-CG 3.94Å; F404-P411 HydrophobicContact CZ-CG 3.89Å; P411-L413 PolarHBondContact O-N 2.88Å
412	V	79.2	Confident	84.4	Confident	24 Å²	24	57.9 Å²	57.9	15%	0.145	29%	0.29	C	S	.	.			trans	-78.1	94.5	-179.1	-165	0	0	0	0	109.8	V305 S414 K415	V305-V412 HydrophobicContact CG1-CG2 3.8Å; V305-V412 WeakPolarHBondContact O-CG2 3.32Å; V412-S414 VanDerWaalsContact C-N 3.27Å; V412-S414 WeakPolarHBondContact CG1-OG 3.26Å; V412-S414 PolarHBondContact O-N 2.82Å; V412-K415 HydrophobicContact CB-CB 4.38Å; V412-K415 HydrophobicContact CB-CD 4Å; V412-K415 HydrophobicContact CB-CG 4.12Å; V412-K415 HydrophobicContact CG1-CB 4.33Å; V412-K415 HydrophobicContact CG1-CD 3.98Å; V412-K415 HydrophobicContact CG1-CG 3.74Å; V412-K415 HydrophobicContact CG2-CD 4.42Å; V412-K415 PolarHBondContact O-N 3.04Å
413	L	87.4	Confident	84.9	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-63.3	-33.2	177.6	-72.3	-174.9	0	0	0	112.5	H372 E376 R380 L400 F404 P411 K415 V416 I422 L425	H372-L413 HydrophobicContact CB-CD1 4.11Å; H372-L413 WeakPolarHBondContact O-CD1 3.46Å; E376-L413 HydrophobicContact CB-CB 4.17Å; E376-L413 HydrophobicContact CB-CD1 4.17Å; E376-L413 HydrophobicContact CG-CB 3.87Å; E376-L413 VanDerWaalsContact OE2-C 3.27Å; E376-L413 VanDerWaalsContact OE2-CB 3.23Å; E376-L413 WeakPolarHBondContact OE2-CB 3.37Å; R380-L413 PolarHBondContact NH2-O 3.36Å; L400-L413 HydrophobicContact CD2-CD2 4.37Å; F404-L413 HydrophobicContact CE2-CD1 4.41Å; F404-L413 HydrophobicContact CE2-CD2 4.02Å; F404-L413 HydrophobicContact CE2-CG 4.36Å; F404-L413 HydrophobicContact CZ-CD1 4.18Å; F404-L413 HydrophobicContact CZ-CG 4.37Å; P411-L413 PolarHBondContact O-N 2.88Å; L413-K415 PolarHBondContact O-N 2.72Å; L413-V416 WeakPolarHBondContact O-CB 3.31Å; L413-V416 PolarHBondContact O-N 2.89Å; L413-I422 HydrophobicContact CB-CD1 3.99Å; L413-I422 HydrophobicContact CD1-CG2 4.22Å; L413-I422 HydrophobicContact CD2-CD1 3.99Å; L413-I422 HydrophobicContact CD2-CG1 4.28Å; L413-I422 HydrophobicContact CD2-CG2 4.38Å; L413-I422 HydrophobicContact CG-CD1 4.42Å; L413-L425 HydrophobicContact CD2-CD2 4.39Å
414	S	85.5	Confident	85.5	Confident	78 Å²	78	50.3 Å²	50.3	55%	0.545	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-69.2	17.2	173.7	86	0	0	0	0	115.4	E376 V412	E376-S414 WeakPolarHBondContact OE1-CA 3.41Å; E376-S414 PolarHBondContact OE1-N 3.17Å; E376-S414 PolarHBondContact OE2-N 3.16Å; V412-S414 VanDerWaalsContact C-N 3.27Å; V412-S414 WeakPolarHBondContact CG1-OG 3.26Å; V412-S414 PolarHBondContact O-N 2.82Å
415	K	86.9	Confident	86.1	Confident	105 Å²	105	49.1 Å²	49.1	46%	0.457	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-125.3	7	170.6	-71.3	-175.1	172.8	-168.9	0	112.7	P306 C307 V412 L413	P306-K415 WeakPolarHBondContact O-CE 3.4Å; C307-K415 PolarHBondContact O-NZ 3.42Å; V412-K415 HydrophobicContact CB-CB 4.38Å; V412-K415 HydrophobicContact CB-CD 4Å; V412-K415 HydrophobicContact CB-CG 4.12Å; V412-K415 HydrophobicContact CG1-CB 4.33Å; V412-K415 HydrophobicContact CG1-CD 3.98Å; V412-K415 HydrophobicContact CG1-CG 3.74Å; V412-K415 HydrophobicContact CG2-CD 4.42Å; V412-K415 PolarHBondContact O-N 3.04Å; L413-K415 PolarHBondContact O-N 2.72Å
416	V	92.3	Very high	86.8	Confident	16 Å²	16	47.6 Å²	47.6	10%	0.097	25%	0.246	C	C	.	.			trans	-102.3	92.7	177.1	-175.3	0	0	0	0	106	R380 T396 L400 L413 D418 A421 I422	R380-V416 PolarHBondContact NH1-O 3.18Å; R380-V416 PolarHBondContact NH2-O 3.14Å; T396-V416 HydrophobicContact CG2-CG1 3.87Å; L400-V416 HydrophobicContact CD1-CG1 3.99Å; L400-V416 HydrophobicContact CD1-CG2 3.82Å; L400-V416 HydrophobicContact CD2-CG2 3.79Å; L400-V416 HydrophobicContact CG-CG2 4.38Å; L413-V416 WeakPolarHBondContact O-CB 3.31Å; L413-V416 PolarHBondContact O-N 2.89Å; V416-D418 VanDerWaalsContact C-N 3.31Å; V416-D418 PolarHBondContact O-N 3.43Å; V416-A421 HydrophobicContact CG1-CB 4Å; V416-I422 HydrophobicContact CB-CD1 4.16Å; V416-I422 HydrophobicContact CB-CG1 4.3Å; V416-I422 HydrophobicContact CG1-CG1 4.14Å
417	D	92	Very high	87.8	Confident	153 Å²	153	39.9 Å²	39.9	82%	0.818	22%	0.217	S	C	*	.			trans	-55.1	-49.6	-170.2	-49.8	-61.8	0	0	0	111.1	R380 I419	R380-D417 PolarHBondContact NH1-O 2.72Å; D417-I419 PolarHBondContact O-N 2.86Å
418	D	95.3	Very high	89.2	Confident	56 Å²	56	38.8 Å²	38.8	30%	0.299	21%	0.207	S	C	.	.			trans	-63.4	106.3	172.3	171.9	17.7	0	0	0	112.8	G392 A393 V416 H420 A421	G392-D418 WeakPolarHBondContact CA-OD2 3.34Å; A393-D418 PolarHBondContact N-OD2 3.05Å; V416-D418 VanDerWaalsContact C-N 3.31Å; V416-D418 PolarHBondContact O-N 3.43Å; D418-H420 VanDerWaalsContact C-N 3.27Å; D418-H420 PolarHBondContact O-N 3.19Å; D418-H420 WeakPolarHBondContact OD1-CA 3.32Å; D418-H420 VanDerWaalsContact OD1-CB 3.25Å; D418-H420 WeakPolarHBondContact OD1-CB 3.29Å; D418-H420 IonicContact OD1-CD2 2.72Å; D418-H420 IonicContact OD1-CG 2.96Å; D418-H420 PolarHBondContact OD1-N 2.82Å; D418-A421 HydrophobicContact CB-CB 4.38Å; D418-A421 PolarHBondContact O-N 3.47Å; D418-A421 PolarHBondContact OD1-N 2.72Å; D418-A421 WeakPolarHBondContact OD2-CB 3.15Å; D418-A421 PolarHBondContact OD2-N 2.81Å
419	I	97.3	Very high	90.8	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.036	17%	0.174	C	C	.	.	H	α-helix	trans	-67.2	-28.1	175.3	-165.1	60	0	0	0	112.5	E376 I377 R380 E384 L387 D417 A421 I422 T423	E376-I419 HydrophobicContact CG-CD1 4.49Å; I377-I419 HydrophobicContact CG1-CD1 3.91Å; I377-I419 HydrophobicContact CG1-CG1 4.35Å; R380-I419 HydrophobicContact CG-CD1 4.43Å; E384-I419 HydrophobicContact CB-CG2 4.07Å; E384-I419 HydrophobicContact CG-CG2 3.99Å; L387-I419 HydrophobicContact CD2-CG1 4.31Å; L387-I419 HydrophobicContact CD2-CG2 4.18Å; D417-I419 PolarHBondContact O-N 2.86Å; I419-A421 PolarHBondContact O-N 3.13Å; I419-I422 HydrophobicContact CD1-CB 4.32Å; I419-I422 HydrophobicContact CD1-CD1 4.07Å; I419-I422 HydrophobicContact CD1-CG1 4.47Å; I419-I422 WeakPolarHBondContact O-CA 3.43Å; I419-I422 WeakPolarHBondContact O-CB 3.5Å; I419-I422 PolarHBondContact O-N 2.83Å; I419-T423 PolarHBondContact O-N 3.16Å
420	H	97.7	Very high	92.3	Very high	30 Å²	30	28.1 Å²	28.1	14%	0.139	16%	0.155	C	C	.	.	H	α-helix	trans	-69	-23.5	-179.5	-50.4	-65.4	0	0	0	111.5	L390 G392 D418 I422 T423 G424	L390-H420 HydrophobicContact CB-CB 4.45Å; G392-H420 PolarHBondContact N-O 3.04Å; D418-H420 VanDerWaalsContact C-N 3.27Å; D418-H420 PolarHBondContact O-N 3.19Å; D418-H420 WeakPolarHBondContact OD1-CA 3.32Å; D418-H420 VanDerWaalsContact OD1-CB 3.25Å; D418-H420 WeakPolarHBondContact OD1-CB 3.29Å; D418-H420 IonicContact OD1-CD2 2.72Å; D418-H420 IonicContact OD1-CG 2.96Å; D418-H420 PolarHBondContact OD1-N 2.82Å; H420-I422 VanDerWaalsContact C-N 3.3Å; H420-I422 PolarHBondContact O-N 3.22Å; H420-T423 WeakPolarHBondContact CA-OG1 3.21Å; H420-T423 PolarHBondContact O-N 2.9Å; H420-T423 PolarHBondContact O-OG1 3.02Å; H420-G424 PolarHBondContact O-N 3.22Å
421	A	97.4	Very high	93.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-31.3	168.6	0	0	0	0	0	112.3	T396 V397 V416 D418 I419 L425	T396-A421 HydrophobicContact CG2-CB 3.88Å; V397-A421 HydrophobicContact CG2-CB 4.38Å; V416-A421 HydrophobicContact CG1-CB 4Å; D418-A421 HydrophobicContact CB-CB 4.38Å; D418-A421 PolarHBondContact O-N 3.47Å; D418-A421 PolarHBondContact OD1-N 2.72Å; D418-A421 WeakPolarHBondContact OD2-CB 3.15Å; D418-A421 PolarHBondContact OD2-N 2.81Å; I419-A421 PolarHBondContact O-N 3.13Å; A421-L425 WeakPolarHBondContact O-CB 3.43Å; A421-L425 PolarHBondContact O-N 3.49Å
422	I	97.6	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-78.6	-40.9	176	-50.1	-172.3	0	0	0	110.5	C373 E376 I377 L413 V416 I419 H420 G424 L425 L426	C373-I422 HydrophobicContact CB-CG2 3.95Å; E376-I422 HydrophobicContact CB-CD1 4.46Å; E376-I422 HydrophobicContact CG-CD1 3.64Å; I377-I422 HydrophobicContact CD1-CG2 4Å; I377-I422 HydrophobicContact CG1-CB 4.41Å; I377-I422 HydrophobicContact CG1-CG2 4.04Å; L413-I422 HydrophobicContact CB-CD1 3.99Å; L413-I422 HydrophobicContact CD1-CG2 4.22Å; L413-I422 HydrophobicContact CD2-CD1 3.99Å; L413-I422 HydrophobicContact CD2-CG1 4.28Å; L413-I422 HydrophobicContact CD2-CG2 4.38Å; L413-I422 HydrophobicContact CG-CD1 4.42Å; V416-I422 HydrophobicContact CB-CD1 4.16Å; V416-I422 HydrophobicContact CB-CG1 4.3Å; V416-I422 HydrophobicContact CG1-CG1 4.14Å; I419-I422 HydrophobicContact CD1-CB 4.32Å; I419-I422 HydrophobicContact CD1-CD1 4.07Å; I419-I422 HydrophobicContact CD1-CG1 4.47Å; I419-I422 WeakPolarHBondContact O-CA 3.43Å; I419-I422 WeakPolarHBondContact O-CB 3.5Å; I419-I422 PolarHBondContact O-N 2.83Å; H420-I422 VanDerWaalsContact C-N 3.3Å; H420-I422 PolarHBondContact O-N 3.22Å; I422-G424 PolarHBondContact O-N 2.95Å; I422-L425 WeakPolarHBondContact O-CB 3.4Å; I422-L425 PolarHBondContact O-N 3.23Å; I422-L426 PolarHBondContact O-N 2.76Å
423	T	98.1	Very high	94.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-36	169.8	77	0	0	0	0	111.4	I377 L387 Y388 I419 H420 K427	I377-T423 HydrophobicContact CD1-CG2 3.95Å; I377-T423 HydrophobicContact CG1-CG2 4.33Å; L387-T423 HydrophobicContact CD2-CG2 3.88Å; Y388-T423 HydrophobicContact CD1-CG2 4.14Å; Y388-T423 HydrophobicContact CE1-CG2 4.09Å; Y388-T423 HydrophobicContact CG-CG2 4.37Å; I419-T423 PolarHBondContact O-N 3.16Å; H420-T423 WeakPolarHBondContact CA-OG1 3.21Å; H420-T423 PolarHBondContact O-N 2.9Å; H420-T423 PolarHBondContact O-OG1 3.02Å; T423-K427 WeakPolarHBondContact O-CB 3.42Å; T423-K427 WeakPolarHBondContact O-CE 3.43Å; T423-K427 VanDerWaalsContact O-CG 3.31Å; T423-K427 WeakPolarHBondContact O-CG 3.33Å; T423-K427 PolarHBondContact O-N 3Å
424	G	97.8	Very high	94.9	Very high	10 Å²	10	40.4 Å²	40.4	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-48.3	173.8	0	0	0	0	0	112.2	H420 I422 L426 K427 D428	H420-G424 PolarHBondContact O-N 3.22Å; I422-G424 PolarHBondContact O-N 2.95Å; G424-L426 PolarHBondContact O-N 2.65Å; G424-K427 PolarHBondContact O-N 2.84Å; G424-D428 VanDerWaalsContact O-CB 3.23Å; G424-D428 WeakPolarHBondContact O-CB 3.26Å; G424-D428 PolarHBondContact O-N 3.16Å
425	L	97.3	Very high	95.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.8	-43.9	175.4	175	64.5	0	0	0	112.6	L369 L400 K401 F404 L413 A421 I422 D428 F429	L369-L425 HydrophobicContact CD1-CD1 4.47Å; L369-L425 HydrophobicContact CD2-CG 4.47Å; L400-L425 HydrophobicContact CB-CD1 4.23Å; L400-L425 HydrophobicContact CB-CD2 3.79Å; L400-L425 HydrophobicContact CD1-CD2 4.34Å; K401-L425 HydrophobicContact CB-CD1 3.7Å; K401-L425 HydrophobicContact CG-CD1 4.27Å; F404-L425 HydrophobicContact CD2-CD2 3.87Å; F404-L425 HydrophobicContact CE2-CD2 3.73Å; L413-L425 HydrophobicContact CD2-CD2 4.39Å; A421-L425 WeakPolarHBondContact O-CB 3.43Å; A421-L425 PolarHBondContact O-N 3.49Å; I422-L425 WeakPolarHBondContact O-CB 3.4Å; I422-L425 PolarHBondContact O-N 3.23Å; L425-D428 PolarHBondContact O-N 3.45Å; L425-F429 WeakPolarHBondContact O-CB 3.28Å; L425-F429 PolarHBondContact O-N 3.39Å
426	L	97.9	Very high	95.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-47.4	178.1	-177.9	57.3	0	0	0	111.7	V370 C373 V374 Y388 I422 G424 D428 F429 L430 L480	V370-L426 HydrophobicContact CB-CD1 4.17Å; V370-L426 HydrophobicContact CG1-CD1 4.08Å; V370-L426 HydrophobicContact CG2-CD1 3.86Å; C373-L426 HydrophobicContact CB-CB 4.15Å; C373-L426 HydrophobicContact CB-CD1 4.46Å; C373-L426 HydrophobicContact CB-CD2 4.47Å; V374-L426 HydrophobicContact CG2-CD2 3.98Å; Y388-L426 HydrophobicContact CE1-CD2 4.08Å; Y388-L426 WeakPolarHBondContact OH-CD2 3.46Å; I422-L426 PolarHBondContact O-N 2.76Å; G424-L426 PolarHBondContact O-N 2.65Å; L426-D428 VanDerWaalsContact C-N 3.31Å; L426-D428 PolarHBondContact O-N 3.39Å; L426-F429 PolarHBondContact O-N 3.43Å; L426-L430 HydrophobicContact CD1-CD1 4.11Å; L426-L430 HydrophobicContact CD1-CG 4.33Å; L426-L430 HydrophobicContact CG-CD1 4.24Å; L426-L430 WeakPolarHBondContact O-CG 3.36Å; L426-L430 PolarHBondContact O-N 3.41Å; L426-L430 VanDerWaalsContact O-N 3.12Å; L426-L480 HydrophobicContact CD2-CD1 4.28Å
427	K	97.6	Very high	96	Very high	15 Å²	15	34 Å²	34	7%	0.065	17%	0.165	C	C	.	.	H	α-helix	trans	-56.6	-44.5	173.8	-73	176.6	-69.4	175.8	0	111.6	Y388 L390 T423 G424 R431 V503 F504 T507	Y388-K427 HydrophobicContact CD1-CD 4.2Å; Y388-K427 HydrophobicContact CD1-CG 4.06Å; Y388-K427 WeakPolarHBondContact O-CE 3.18Å; Y388-K427 PolarHBondContact O-NZ 3.25Å; L390-K427 PolarHBondContact O-NZ 3.1Å; T423-K427 WeakPolarHBondContact O-CB 3.42Å; T423-K427 WeakPolarHBondContact O-CE 3.43Å; T423-K427 VanDerWaalsContact O-CG 3.31Å; T423-K427 WeakPolarHBondContact O-CG 3.33Å; T423-K427 PolarHBondContact O-N 3Å; G424-K427 PolarHBondContact O-N 2.84Å; K427-R431 VanDerWaalsContact O-CB 3.24Å; K427-R431 WeakPolarHBondContact O-CB 3.32Å; K427-R431 PolarHBondContact O-N 3.22Å; K427-V503 HydrophobicContact CD-CG1 3.75Å; K427-F504 HydrophobicContact CG-CZ 4.49Å; K427-T507 HydrophobicContact CB-CG2 4.37Å
428	D	96.4	Very high	96.3	Very high	30 Å²	30	26.7 Å²	26.7	16%	0.16	13%	0.126	C	C	.	.	H	α-helix	trans	-78.9	-21.1	-176.7	-165.8	69.4	0	0	0	113.8	V397 K401 G424 L425 L426 R431 N432	V397-D428 HydrophobicContact CG1-CB 4.2Å; K401-D428 VanDerWaalsContact CD-OD2 3.27Å; K401-D428 WeakPolarHBondContact CD-OD2 3.37Å; K401-D428 WeakPolarHBondContact CE-OD2 3.25Å; K401-D428 PolarHBondContact NZ-O 3.41Å; K401-D428 IonicContact NZ-OD2 2.68Å; K401-D428 PolarHBondContact NZ-OD2 3.45Å; G424-D428 VanDerWaalsContact O-CB 3.23Å; G424-D428 WeakPolarHBondContact O-CB 3.26Å; G424-D428 PolarHBondContact O-N 3.16Å; L425-D428 PolarHBondContact O-N 3.45Å; L426-D428 VanDerWaalsContact C-N 3.31Å; L426-D428 PolarHBondContact O-N 3.39Å; D428-R431 IonicContact OD1-CZ 3.6Å; D428-R431 IonicContact OD1-NE 3.38Å; D428-R431 IonicContact OD1-NH2 2.71Å; D428-R431 PolarHBondContact OD1-NH2 2.99Å; D428-N432 VanDerWaalsContact CG-ND2 3.28Å; D428-N432 WeakPolarHBondContact O-CB 3.33Å; D428-N432 PolarHBondContact O-ND2 3.07Å; D428-N432 PolarHBondContact OD1-ND2 3.38Å; D428-N432 PolarHBondContact OD2-ND2 3.36Å
429	F	96	Very high	96.4	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-67.9	-56.9	164.7	172.9	-105.3	0	0	0	110.4	Y358 P367 L369 V370 L405 L425 L426 R431 N432 L433	Y358-F429 HydrophobicContact CD1-CE2 4.4Å; Y358-F429 HydrophobicContact CD2-CE2 4.04Å; Y358-F429 HydrophobicContact CD2-CZ 4.03Å; Y358-F429 HydrophobicContact CE2-CE2 4.38Å; Y358-F429 HydrophobicContact CG-CE2 4.05Å; Y358-F429 HydrophobicContact CG-CZ 4.06Å; P367-F429 HydrophobicContact CB-CE1 4.08Å; P367-F429 HydrophobicContact CB-CZ 3.98Å; P367-F429 HydrophobicContact CG-CE1 3.94Å; P367-F429 HydrophobicContact CG-CZ 3.99Å; L369-F429 HydrophobicContact CD1-CB 4.09Å; L369-F429 HydrophobicContact CD1-CD2 3.77Å; L369-F429 HydrophobicContact CD1-CE2 4.46Å; L369-F429 HydrophobicContact CD1-CG 3.96Å; L369-F429 HydrophobicContact CD2-CB 3.66Å; L369-F429 HydrophobicContact CD2-CD1 4.01Å; L369-F429 HydrophobicContact CD2-CD2 4.37Å; L369-F429 HydrophobicContact CD2-CG 3.74Å; L369-F429 HydrophobicContact CG-CG 4.43Å; V370-F429 HydrophobicContact CG2-CD1 3.75Å; V370-F429 HydrophobicContact CG2-CE1 3.62Å; L405-F429 HydrophobicContact CD2-CE2 4.5Å; L425-F429 WeakPolarHBondContact O-CB 3.28Å; L425-F429 PolarHBondContact O-N 3.39Å; L426-F429 PolarHBondContact O-N 3.43Å; F429-R431 PolarHBondContact O-N 2.86Å; F429-N432 PolarHBondContact O-N 3.36Å; F429-L433 HydrophobicContact CE1-CD2 4.34Å; F429-L433 HydrophobicContact CE2-CD2 4.27Å; F429-L433 HydrophobicContact CZ-CD2 3.95Å; F429-L433 PolarHBondContact O-N 3.46Å
430	L	96.8	Very high	96.4	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-43.6	-174.8	-66.1	171.6	0	0	0	112.9	V370 L426 N432 L433 L480 F504 T507 I508	V370-L430 HydrophobicContact CG2-CD2 4.4Å; L426-L430 HydrophobicContact CD1-CD1 4.11Å; L426-L430 HydrophobicContact CD1-CG 4.33Å; L426-L430 HydrophobicContact CG-CD1 4.24Å; L426-L430 WeakPolarHBondContact O-CG 3.36Å; L426-L430 PolarHBondContact O-N 3.41Å; L426-L430 VanDerWaalsContact O-N 3.12Å; L430-N432 VanDerWaalsContact C-N 3.29Å; L430-N432 PolarHBondContact O-N 3.24Å; L430-L433 HydrophobicContact CD2-CD1 4.39Å; L430-L433 WeakPolarHBondContact O-CG 3.42Å; L430-L433 PolarHBondContact O-N 3.16Å; L430-L480 HydrophobicContact CD1-CD1 4.45Å; L430-L480 HydrophobicContact CD1-CD2 3.77Å; L430-F504 HydrophobicContact CD1-CE1 4.44Å; L430-T507 HydrophobicContact CB-CG2 3.98Å; L430-I508 HydrophobicContact CD1-CG2 4.15Å
431	R	95.3	Very high	96.4	Very high	127 Å²	127	33.3 Å²	33.3	48%	0.479	15%	0.148	S	C	.	.	H	α-helix	trans	-66.2	-26.2	179.1	179.5	177.6	58.2	-122	-1.9	114.1	K427 D428 F429 T507	K427-R431 VanDerWaalsContact O-CB 3.24Å; K427-R431 WeakPolarHBondContact O-CB 3.32Å; K427-R431 PolarHBondContact O-N 3.22Å; D428-R431 IonicContact OD1-CZ 3.6Å; D428-R431 IonicContact OD1-NE 3.38Å; D428-R431 IonicContact OD1-NH2 2.71Å; D428-R431 PolarHBondContact OD1-NH2 2.99Å; F429-R431 PolarHBondContact O-N 2.86Å; R431-T507 HydrophobicContact CB-CG2 4.35Å
432	N	93.3	Very high	96.4	Very high	68 Å²	68	34 Å²	34	36%	0.364	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	25.3	-178.2	-63.1	-87.9	0	0	0	112.4	K401 D428 F429 L430	K401-N432 PolarHBondContact NZ-ND2 3.46Å; D428-N432 VanDerWaalsContact CG-ND2 3.28Å; D428-N432 WeakPolarHBondContact O-CB 3.33Å; D428-N432 PolarHBondContact O-ND2 3.07Å; D428-N432 PolarHBondContact OD1-ND2 3.38Å; D428-N432 PolarHBondContact OD2-ND2 3.36Å; F429-N432 PolarHBondContact O-N 3.36Å; L430-N432 VanDerWaalsContact C-N 3.29Å; L430-N432 PolarHBondContact O-N 3.24Å
433	L	92.9	Very high	96.4	Very high	16 Å²	16	34.1 Å²	34.1	8%	0.084	15%	0.152	C	C	.	.	S	Bend	trans	-69	151.7	159.3	-66.3	171.4	0	0	0	109.1	L355 Y358 F429 L430 E435	L355-L433 HydrophobicContact CB-CD1 4.36Å; L355-L433 HydrophobicContact CB-CD2 4.44Å; L355-L433 HydrophobicContact CD1-CD1 4.09Å; L355-L433 HydrophobicContact CD1-CD2 4.22Å; Y358-L433 HydrophobicContact CD2-CD2 3.99Å; Y358-L433 HydrophobicContact CE2-CD2 4.04Å; F429-L433 HydrophobicContact CE1-CD2 4.34Å; F429-L433 HydrophobicContact CE2-CD2 4.27Å; F429-L433 HydrophobicContact CZ-CD2 3.95Å; F429-L433 PolarHBondContact O-N 3.46Å; L430-L433 HydrophobicContact CD2-CD1 4.39Å; L430-L433 WeakPolarHBondContact O-CG 3.42Å; L430-L433 PolarHBondContact O-N 3.16Å; L433-E435 WeakPolarHBondContact CB-O 3.25Å; L433-E435 PolarHBondContact O-N 2.94Å
434	K	92.1	Very high	96.4	Very high	129 Å²	129	42 Å²	42	56%	0.561	18%	0.182	S	C	*	.	S	Bend	trans	-62.1	-22	179.9	178.5	171.5	172	-175.9	0	114.3	E352 G353 V354 F440	E352-K434 WeakPolarHBondContact O-CD 3.33Å; G353-K434 WeakPolarHBondContact O-CB 3.5Å; G353-K434 PolarHBondContact O-N 3.18Å; G353-K434 VanDerWaalsContact O-N 3.11Å; V354-K434 HydrophobicContact CG2-CB 4.38Å; V354-K434 HydrophobicContact CG2-CD 3.92Å; K434-F440 WeakPolarHBondContact O-CE2 3.41Å
435	E	93.1	Very high	96.4	Very high	47 Å²	47	43.4 Å²	43.4	22%	0.22	19%	0.193	C	C	.	.	S	Bend	trans	-137	155.6	164.7	70.6	171.5	151.2	0	0	109.2	L433 T439 F440	L433-E435 WeakPolarHBondContact CB-O 3.25Å; L433-E435 PolarHBondContact O-N 2.94Å; E435-T439 VanDerWaalsContact OE2-CA 3.25Å; E435-T439 WeakPolarHBondContact OE2-CA 3.46Å; E435-T439 VanDerWaalsContact OE2-CB 3.26Å; E435-T439 WeakPolarHBondContact OE2-CB 3.2Å; E435-F440 HydrophobicContact CB-CD2 3.41Å; E435-F440 VanDerWaalsContact CB-CD2 3.41Å; E435-F440 HydrophobicContact CB-CE2 3.3Å; E435-F440 HydrophobicContact CB-CG 4.18Å; E435-F440 HydrophobicContact CB-CZ 3.99Å; E435-F440 PolarHBondContact OE2-N 3.32Å
436	P	96.6	Very high	96.5	Very high	17 Å²	17	43.4 Å²	43.4	11%	0.11	19%	0.193	C	C	.	.			trans	-60.4	158.3	176.8	25.5	-34.9	0	0	0	111.8	L438 T439 F440 V509	P436-L438 PolarHBondContact O-N 3.3Å; P436-L438 VanDerWaalsContact O-N 3.16Å; P436-T439 WeakPolarHBondContact O-CA 3.47Å; P436-T439 PolarHBondContact O-N 2.91Å; P436-F440 VanDerWaalsContact CD-CE1 3.48Å; P436-F440 HydrophobicContact CG-CD1 4.27Å; P436-F440 HydrophobicContact CG-CE1 4.31Å; P436-V509 WeakPolarHBondContact CB-O 3.39Å
437	L	97.8	Very high	96.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.8	-179.5	179	61.1	0	0	0	112.4	L355 T439 N473 T476 L477 L480 I508	L355-L437 HydrophobicContact CD2-CD1 3.52Å; L437-T439 VanDerWaalsContact C-N 3.25Å; L437-T439 PolarHBondContact O-N 3.21Å; L437-N473 HydrophobicContact CD1-CB 4.33Å; L437-N473 WeakPolarHBondContact O-CB 3.47Å; L437-N473 PolarHBondContact O-ND2 3.27Å; L437-T476 HydrophobicContact CD1-CG2 3.97Å; L437-L477 HydrophobicContact CD2-CB 4.22Å; L437-L477 HydrophobicContact CD2-CD1 3.95Å; L437-L477 HydrophobicContact CG-CB 4.49Å; L437-L480 HydrophobicContact CD2-CD2 4.1Å; L437-I508 HydrophobicContact CB-CB 3.96Å; L437-I508 HydrophobicContact CB-CG2 4.24Å; L437-I508 HydrophobicContact CD2-CB 4.09Å; L437-I508 HydrophobicContact CD2-CG2 3.87Å; L437-I508 PolarHBondContact N-O 3.26Å
438	L	98.3	Very high	96.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.6	175.1	-58.3	-169.1	0	0	0	114.8	P436 F446 L469 L477 I508 V509 V531 L535	P436-L438 PolarHBondContact O-N 3.3Å; P436-L438 VanDerWaalsContact O-N 3.16Å; L438-F446 HydrophobicContact CB-CD2 3.81Å; L438-F446 HydrophobicContact CB-CE2 3.87Å; L438-F446 HydrophobicContact CD1-CB 4.32Å; L438-F446 HydrophobicContact CD1-CD1 4.18Å; L438-F446 HydrophobicContact CD1-CD2 3.82Å; L438-F446 HydrophobicContact CD1-CE1 4.47Å; L438-F446 HydrophobicContact CD1-CE2 4.14Å; L438-F446 HydrophobicContact CD1-CG 3.85Å; L438-F446 HydrophobicContact CD1-CZ 4.47Å; L438-F446 HydrophobicContact CD2-CE2 4.01Å; L438-F446 HydrophobicContact CD2-CZ 4.07Å; L438-F446 HydrophobicContact CG-CD2 4.25Å; L438-F446 HydrophobicContact CG-CE2 4.21Å; L438-L469 HydrophobicContact CD2-CD1 4.31Å; L438-L477 HydrophobicContact CD2-CD1 3.99Å; L438-L477 HydrophobicContact CD2-CD2 3.55Å; L438-L477 HydrophobicContact CD2-CG 4.38Å; L438-I508 PolarHBondContact N-O 2.93Å; L438-V509 HydrophobicContact CD1-CB 4.21Å; L438-V509 HydrophobicContact CD1-CG1 4.2Å; L438-V509 HydrophobicContact CD1-CG2 3.82Å; L438-V531 HydrophobicContact CD1-CG1 3.75Å; L438-L535 HydrophobicContact CD1-CD1 4.09Å; L438-L535 HydrophobicContact CD2-CD1 4.46Å
439	T	97.4	Very high	96.6	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	20%	0.198	C	C	.	.			trans	64.3	152.9	-176.5	74.8	0	0	0	0	115.5	E435 P436 L437 R441 L442 N443 L469 P470	E435-T439 VanDerWaalsContact OE2-CA 3.25Å; E435-T439 WeakPolarHBondContact OE2-CA 3.46Å; E435-T439 VanDerWaalsContact OE2-CB 3.26Å; E435-T439 WeakPolarHBondContact OE2-CB 3.2Å; P436-T439 WeakPolarHBondContact O-CA 3.47Å; P436-T439 PolarHBondContact O-N 2.91Å; L437-T439 VanDerWaalsContact C-N 3.25Å; L437-T439 PolarHBondContact O-N 3.21Å; T439-R441 PolarHBondContact O-N 2.99Å; T439-L442 PolarHBondContact OG1-N 2.91Å; T439-L442 VanDerWaalsContact OG1-N 3.16Å; T439-N443 WeakPolarHBondContact O-CB 3.39Å; T439-N443 PolarHBondContact O-N 2.73Å; T439-N443 VanDerWaalsContact O-N 3.16Å; T439-L469 HydrophobicContact CG2-CD2 4.15Å; T439-P470 HydrophobicContact CG2-CG 4.06Å
440	F	97.3	Very high	96.6	Very high	57 Å²	57	44 Å²	44	25%	0.25	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.8	170.6	-69.1	-55.1	0	0	0	112.2	K434 E435 P436 H511 P514	K434-F440 WeakPolarHBondContact O-CE2 3.41Å; E435-F440 HydrophobicContact CB-CD2 3.41Å; E435-F440 VanDerWaalsContact CB-CD2 3.41Å; E435-F440 HydrophobicContact CB-CE2 3.3Å; E435-F440 HydrophobicContact CB-CG 4.18Å; E435-F440 HydrophobicContact CB-CZ 3.99Å; E435-F440 PolarHBondContact OE2-N 3.32Å; P436-F440 VanDerWaalsContact CD-CE1 3.48Å; P436-F440 HydrophobicContact CG-CD1 4.27Å; P436-F440 HydrophobicContact CG-CE1 4.31Å; F440-H511 VanDerWaalsContact CD1-O 3.25Å; F440-H511 WeakPolarHBondContact CD1-O 3.47Å; F440-P514 HydrophobicContact CE1-CG 4.21Å; F440-P514 HydrophobicContact CE2-CG 3.89Å; F440-P514 HydrophobicContact CZ-CB 4.07Å; F440-P514 HydrophobicContact CZ-CG 3.61Å
441	R	97.2	Very high	96.6	Very high	172 Å²	172	48 Å²	48	65%	0.649	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-43.2	-175.9	-171.9	-174.4	73.2	-166.6	2.7	112.9	T439 D468	T439-R441 PolarHBondContact O-N 2.99Å; R441-D468 PolarHBondContact NH2-O 3.01Å
442	L	97.9	Very high	96.7	Very high	14 Å²	14	43.9 Å²	43.9	7%	0.073	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-10	-173.4	-58.7	175.4	0	0	0	113.6	T439 R444 A445 F446 T465 D468 L469	T439-L442 PolarHBondContact OG1-N 2.91Å; T439-L442 VanDerWaalsContact OG1-N 3.16Å; L442-R444 VanDerWaalsContact C-N 3.28Å; L442-R444 PolarHBondContact O-N 2.72Å; L442-R444 VanDerWaalsContact O-N 3.16Å; L442-A445 WeakPolarHBondContact O-CB 3.31Å; L442-A445 PolarHBondContact O-N 3.38Å; L442-F446 HydrophobicContact CB-CD2 3.94Å; L442-F446 HydrophobicContact CB-CE2 3.91Å; L442-F446 WeakPolarHBondContact O-CD2 3.37Å; L442-F446 PolarHBondContact O-N 3.37Å; L442-T465 HydrophobicContact CB-CG2 4.14Å; L442-T465 HydrophobicContact CD2-CG2 4.47Å; L442-D468 HydrophobicContact CD1-CB 3.88Å; L442-D468 HydrophobicContact CD2-CB 4.18Å; L442-L469 HydrophobicContact CD1-CD2 3.94Å; L442-L469 HydrophobicContact CD1-CG 4.08Å
443	N	98.1	Very high	96.8	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-42.3	-52.3	177.1	172.3	-85.3	0	0	0	112.5	T439 F446 M447 V509 G510 A512	T439-N443 WeakPolarHBondContact O-CB 3.39Å; T439-N443 PolarHBondContact O-N 2.73Å; T439-N443 VanDerWaalsContact O-N 3.16Å; N443-F446 PolarHBondContact O-N 3.24Å; N443-M447 WeakPolarHBondContact O-CG 3.41Å; N443-M447 PolarHBondContact O-N 3.37Å; N443-V509 PolarHBondContact ND2-O 3.42Å; N443-G510 VanDerWaalsContact ND2-C 3.34Å; N443-G510 PolarHBondContact ND2-O 2.69Å; N443-A512 HydrophobicContact CB-CB 4.29Å; N443-A512 PolarHBondContact OD1-N 2.86Å
444	R	97.1	Very high	97	Very high	165 Å²	165	49.4 Å²	49.4	62%	0.623	24%	0.244	S	C	*	.	H	α-helix	trans	-65.7	-42.7	178.7	-178	171.4	-178.8	148.7	7.3	113.3	L442 F446 M447 D448	L442-R444 VanDerWaalsContact C-N 3.28Å; L442-R444 PolarHBondContact O-N 2.72Å; L442-R444 VanDerWaalsContact O-N 3.16Å; R444-F446 VanDerWaalsContact C-N 3.27Å; R444-F446 PolarHBondContact O-N 3.43Å; R444-M447 PolarHBondContact O-N 2.93Å; R444-D448 VanDerWaalsContact CG-OD2 3.32Å; R444-D448 WeakPolarHBondContact CG-OD2 3.37Å; R444-D448 IonicContact CZ-OD2 2.77Å; R444-D448 IonicContact NE-OD1 2.67Å; R444-D448 IonicContact NE-OD2 3.93Å; R444-D448 PolarHBondContact NE-OD2 3.18Å; R444-D448 IonicContact NH2-OD2 3Å; R444-D448 WeakPolarHBondContact O-CB 3.47Å; R444-D448 PolarHBondContact O-N 3.08Å
445	A	98.2	Very high	97.1	Very high	41 Å²	41	48.3 Å²	48.3	34%	0.339	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-38.7	178.6	0	0	0	0	0	111.6	L442 A449 T465	L442-A445 WeakPolarHBondContact O-CB 3.31Å; L442-A445 PolarHBondContact O-N 3.38Å; A445-A449 WeakPolarHBondContact O-CB 3.48Å; A445-A449 PolarHBondContact O-N 3.17Å; A445-T465 HydrophobicContact CB-CG2 3.77Å
446	F	98.6	Very high	97.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-45.4	172.9	-84	-67.6	0	0	0	113.1	L438 L442 N443 R444 A450 M462 T465 I466 L469 V531 L535	L438-F446 HydrophobicContact CB-CD2 3.81Å; L438-F446 HydrophobicContact CB-CE2 3.87Å; L438-F446 HydrophobicContact CD1-CB 4.32Å; L438-F446 HydrophobicContact CD1-CD1 4.18Å; L438-F446 HydrophobicContact CD1-CD2 3.82Å; L438-F446 HydrophobicContact CD1-CE1 4.47Å; L438-F446 HydrophobicContact CD1-CE2 4.14Å; L438-F446 HydrophobicContact CD1-CG 3.85Å; L438-F446 HydrophobicContact CD1-CZ 4.47Å; L438-F446 HydrophobicContact CD2-CE2 4.01Å; L438-F446 HydrophobicContact CD2-CZ 4.07Å; L438-F446 HydrophobicContact CG-CD2 4.25Å; L438-F446 HydrophobicContact CG-CE2 4.21Å; L442-F446 HydrophobicContact CB-CD2 3.94Å; L442-F446 HydrophobicContact CB-CE2 3.91Å; L442-F446 WeakPolarHBondContact O-CD2 3.37Å; L442-F446 PolarHBondContact O-N 3.37Å; N443-F446 PolarHBondContact O-N 3.24Å; R444-F446 VanDerWaalsContact C-N 3.27Å; R444-F446 PolarHBondContact O-N 3.43Å; F446-A450 WeakPolarHBondContact O-CB 3.3Å; F446-A450 PolarHBondContact O-N 3.4Å; F446-M462 HydrophobicContact CD1-CE 3.85Å; F446-M462 HydrophobicContact CD1-SD 3.97Å; F446-M462 HydrophobicContact CE1-CE 4.11Å; F446-T465 HydrophobicContact CD1-CG2 3.93Å; F446-T465 HydrophobicContact CD2-CG2 3.62Å; F446-T465 HydrophobicContact CE1-CG2 3.87Å; F446-T465 HydrophobicContact CE2-CG2 3.56Å; F446-T465 HydrophobicContact CG-CG2 3.8Å; F446-T465 HydrophobicContact CZ-CG2 3.68Å; F446-I466 HydrophobicContact CE1-CG1 3.83Å; F446-I466 HydrophobicContact CZ-CG1 4.11Å; F446-L469 HydrophobicContact CE2-CD1 4.32Å; F446-L469 HydrophobicContact CE2-CD2 4.15Å; F446-L469 HydrophobicContact CE2-CG 4.23Å; F446-L469 HydrophobicContact CZ-CD1 3.91Å; F446-L469 HydrophobicContact CZ-CG 4.17Å; F446-V531 HydrophobicContact CB-CG1 3.84Å; F446-V531 HydrophobicContact CB-CG2 4.34Å; F446-V531 HydrophobicContact CD1-CG1 4.16Å; F446-V531 HydrophobicContact CG-CG1 4.27Å; F446-L535 HydrophobicContact CE1-CD2 4.3Å
447	M	98.1	Very high	97.2	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-49.5	176.7	-54.5	-67	-167.6	0	0	111.4	N443 R444 A449 A450 E451 V509 D524 R527 Q528 V531	N443-M447 WeakPolarHBondContact O-CG 3.41Å; N443-M447 PolarHBondContact O-N 3.37Å; R444-M447 PolarHBondContact O-N 2.93Å; M447-A449 VanDerWaalsContact C-N 3.27Å; M447-A449 PolarHBondContact O-N 3.37Å; M447-A450 PolarHBondContact O-N 2.95Å; M447-A450 VanDerWaalsContact O-N 3.13Å; M447-E451 PolarHBondContact O-N 2.86Å; M447-E451 VanDerWaalsContact O-N 3.08Å; M447-V509 HydrophobicContact CE-CG1 3.47Å; M447-V509 VanDerWaalsContact CE-CG1 3.47Å; M447-V509 HydrophobicContact SD-CG1 3.94Å; M447-D524 HydrophobicContact CE-CB 4.32Å; M447-R527 HydrophobicContact CB-CB 4.41Å; M447-R527 VanDerWaalsContact CB-NH1 3.29Å; M447-R527 HydrophobicContact CE-CB 4.4Å; M447-R527 HydrophobicContact CG-CB 4.29Å; M447-R527 HydrophobicContact SD-CB 3.47Å; M447-R527 WeakPolarHBondContact SD-CB 3.48Å; M447-Q528 HydrophobicContact CE-CG 3.67Å; M447-V531 HydrophobicContact CG-CG2 4.4Å; M447-V531 HydrophobicContact SD-CG2 3.56Å; M447-V531 VanDerWaalsContact SD-CG2 3.56Å
448	D	97.9	Very high	97.2	Very high	57 Å²	57	56.1 Å²	56.1	31%	0.305	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-32.1	-175	-64.2	8.4	0	0	0	110.3	R444 V452 R527	R444-D448 VanDerWaalsContact CG-OD2 3.32Å; R444-D448 WeakPolarHBondContact CG-OD2 3.37Å; R444-D448 IonicContact CZ-OD2 2.77Å; R444-D448 IonicContact NE-OD1 2.67Å; R444-D448 IonicContact NE-OD2 3.93Å; R444-D448 PolarHBondContact NE-OD2 3.18Å; R444-D448 IonicContact NH2-OD2 3Å; R444-D448 WeakPolarHBondContact O-CB 3.47Å; R444-D448 PolarHBondContact O-N 3.08Å; D448-V452 WeakPolarHBondContact O-CG2 3.46Å; D448-R527 IonicContact OD1-CZ 3.84Å; D448-R527 IonicContact OD1-NH1 3.74Å; D448-R527 PolarHBondContact OD1-NH1 3.15Å; D448-R527 IonicContact OD1-NH2 3.91Å; D448-R527 PolarHBondContact OD1-NH2 3.3Å
449	A	98.1	Very high	97.2	Very high	4 Å²	4	57.8 Å²	57.8	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-72.1	-37.5	171.1	0	0	0	0	0	113.8	A445 M447 E451 V452 S458 L461 M462	A445-A449 WeakPolarHBondContact O-CB 3.48Å; A445-A449 PolarHBondContact O-N 3.17Å; M447-A449 VanDerWaalsContact C-N 3.27Å; M447-A449 PolarHBondContact O-N 3.37Å; A449-E451 VanDerWaalsContact C-N 3.33Å; A449-V452 PolarHBondContact O-N 2.96Å; A449-S458 PolarHBondContact O-OG 3.39Å; A449-L461 HydrophobicContact CB-CB 3.66Å; A449-M462 HydrophobicContact CB-CG 4.37Å; A449-M462 HydrophobicContact CB-SD 4.05Å
450	A	97.6	Very high	97.2	Very high	2 Å²	2	60.3 Å²	60.3	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-73	-25	-179.3	0	0	0	0	0	113.5	F446 M447 M530 V531 R534	F446-A450 WeakPolarHBondContact O-CB 3.3Å; F446-A450 PolarHBondContact O-N 3.4Å; M447-A450 PolarHBondContact O-N 2.95Å; M447-A450 VanDerWaalsContact O-N 3.13Å; A450-M530 HydrophobicContact CB-CB 4.34Å; A450-V531 HydrophobicContact CB-CB 4.43Å; A450-V531 HydrophobicContact CB-CG2 3.87Å; A450-R534 HydrophobicContact CB-CG 3.88Å; A450-R534 PolarHBondContact O-NE 3Å
451	E	96.7	Very high	97.2	Very high	86 Å²	86	60.8 Å²	60.8	40%	0.402	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-4.2	175.9	-73.9	-179.6	167.3	0	0	114.5	M447 A449 S453 R527 M530	M447-E451 PolarHBondContact O-N 2.86Å; M447-E451 VanDerWaalsContact O-N 3.08Å; A449-E451 VanDerWaalsContact C-N 3.33Å; E451-S453 PolarHBondContact O-N 3.16Å; E451-R527 VanDerWaalsContact CD-NE 3.33Å; E451-R527 VanDerWaalsContact CD-NH2 3.34Å; E451-R527 WeakPolarHBondContact OE1-CG 3.44Å; E451-R527 IonicContact OE1-CZ 3.96Å; E451-R527 IonicContact OE1-NE 3.58Å; E451-R527 PolarHBondContact OE1-NE 2.86Å; E451-R527 IonicContact OE1-NH2 3.68Å; E451-R527 IonicContact OE2-CZ 3.71Å; E451-R527 IonicContact OE2-NE 2.85Å; E451-R527 PolarHBondContact OE2-NE 3.25Å; E451-R527 IonicContact OE2-NH2 2.79Å; E451-R527 PolarHBondContact OE2-NH2 3.03Å; E451-M530 HydrophobicContact CG-CE 3.98Å; E451-M530 HydrophobicContact CG-SD 4.44Å
452	V	97.5	Very high	97.3	Very high	40 Å²	40	52.6 Å²	52.6	24%	0.242	29%	0.289	C	S	.	.			trans	-65.2	120.9	174.2	178.8	0	0	0	0	109.7	D448 A449 D454 N457 L461 R534	D448-V452 WeakPolarHBondContact O-CG2 3.46Å; A449-V452 PolarHBondContact O-N 2.96Å; V452-D454 HydrophobicContact CG1-CB 4.23Å; V452-D454 PolarHBondContact O-N 2.68Å; V452-N457 HydrophobicContact CG1-CB 4.09Å; V452-L461 HydrophobicContact CG2-CD1 3.91Å; V452-R534 PolarHBondContact O-NH2 3.45Å
453	S	95.2	Very high	97.3	Very high	121 Å²	121	55.4 Å²	55.4	85%	0.846	30%	0.299	S	S	*	.	S	Bend	trans	-71.1	-16.9	-177.8	-44.6	0	0	0	0	114.4	E451	E451-S453 PolarHBondContact O-N 3.16Å
454	D	96.8	Very high	97.3	Very high	79 Å²	79	60.7 Å²	60.7	42%	0.422	32%	0.323	S	S	.	.	S	Bend	trans	-91.3	118.8	173.1	-179.4	84.6	0	0	0	109.5	V452 D456 N457 S458	V452-D454 HydrophobicContact CG1-CB 4.23Å; V452-D454 PolarHBondContact O-N 2.68Å; D454-D456 PolarHBondContact O-N 2.75Å; D454-D456 PolarHBondContact OD2-N 3.38Å; D454-N457 HydrophobicContact CB-CB 4.3Å; D454-N457 WeakPolarHBondContact OD2-CB 3.41Å; D454-N457 PolarHBondContact OD2-N 3.47Å; D454-N457 PolarHBondContact OD2-ND2 3.49Å; D454-S458 VanDerWaalsContact O-CB 3.32Å; D454-S458 WeakPolarHBondContact O-CB 3.36Å; D454-S458 PolarHBondContact O-N 2.85Å
455	E	94.1	Very high	97.3	Very high	106 Å²	106	53.3 Å²	53.3	50%	0.495	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-43.9	-171.3	-67.7	-68.2	119.8	0	0	112.4	S458 V459 R534	E455-S458 PolarHBondContact O-N 2.71Å; E455-V459 WeakPolarHBondContact O-CB 2.86Å; E455-V459 WeakPolarHBondContact O-CG2 3.32Å; E455-V459 PolarHBondContact O-N 3.38Å; E455-R534 IonicContact OE1-CZ 3.81Å; E455-R534 VanDerWaalsContact OE1-CZ 3.23Å; E455-R534 IonicContact OE1-NH1 3.57Å; E455-R534 PolarHBondContact OE1-NH1 3.37Å; E455-R534 IonicContact OE1-NH2 2.84Å; E455-R534 PolarHBondContact OE1-NH2 3.23Å; E455-R534 IonicContact OE2-CZ 3.67Å; E455-R534 IonicContact OE2-NH1 2.86Å; E455-R534 PolarHBondContact OE2-NH1 3Å; E455-R534 IonicContact OE2-NH2 3.72Å
456	D	95.1	Very high	97.3	Very high	131 Å²	131	51.4 Å²	51.4	70%	0.701	28%	0.28	S	S	*	.	H	α-helix	trans	-68.9	-42.3	-176.9	-72.5	-33.2	0	0	0	111.4	D454 V459 A460	D454-D456 PolarHBondContact O-N 2.75Å; D454-D456 PolarHBondContact OD2-N 3.38Å; D456-V459 PolarHBondContact O-N 3.24Å; D456-A460 WeakPolarHBondContact O-CB 3.45Å; D456-A460 PolarHBondContact O-N 3.34Å
457	N	96.8	Very high	97.2	Very high	97 Å²	97	54.4 Å²	54.4	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-67.2	-37.3	173.2	-77.1	-82.4	0	0	0	112.2	V452 D454 A460 L461	V452-N457 HydrophobicContact CG1-CB 4.09Å; D454-N457 HydrophobicContact CB-CB 4.3Å; D454-N457 WeakPolarHBondContact OD2-CB 3.41Å; D454-N457 PolarHBondContact OD2-N 3.47Å; D454-N457 PolarHBondContact OD2-ND2 3.49Å; N457-A460 PolarHBondContact O-N 3.08Å; N457-L461 WeakPolarHBondContact O-CB 3.36Å; N457-L461 WeakPolarHBondContact O-CG 3.33Å; N457-L461 PolarHBondContact O-N 2.95Å
458	S	97.6	Very high	97.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.6	-48.8	173.6	-171.3	0	0	0	0	110.9	A449 D454 E455 A460 L461 M462 R534	A449-S458 PolarHBondContact O-OG 3.39Å; D454-S458 VanDerWaalsContact O-CB 3.32Å; D454-S458 WeakPolarHBondContact O-CB 3.36Å; D454-S458 PolarHBondContact O-N 2.85Å; E455-S458 PolarHBondContact O-N 2.71Å; S458-A460 PolarHBondContact O-N 2.94Å; S458-L461 PolarHBondContact O-N 3.48Å; S458-M462 WeakPolarHBondContact O-CB 3.49Å; S458-M462 WeakPolarHBondContact O-CG 3.22Å; S458-M462 PolarHBondContact O-N 3Å; S458-R534 PolarHBondContact OG-NE 2.83Å
459	V	97.1	Very high	97.2	Very high	35 Å²	35	55.7 Å²	55.7	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.5	166.5	0	0	0	0	111.8	E455 D456 M462 Y463 L538	E455-V459 WeakPolarHBondContact O-CB 2.86Å; E455-V459 WeakPolarHBondContact O-CG2 3.32Å; E455-V459 PolarHBondContact O-N 3.38Å; D456-V459 PolarHBondContact O-N 3.24Å; V459-M462 PolarHBondContact O-N 3.22Å; V459-Y463 HydrophobicContact CG1-CD2 3.87Å; V459-Y463 HydrophobicContact CG1-CE2 3.36Å; V459-Y463 WeakPolarHBondContact O-CD2 3.16Å; V459-Y463 PolarHBondContact O-N 3.08Å; V459-L538 HydrophobicContact CG1-CD2 3.95Å; V459-L538 HydrophobicContact CG2-CD2 4.28Å
460	A	97.6	Very high	97.2	Very high	55 Å²	55	57.9 Å²	57.9	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-46.1	176.6	0	0	0	0	0	112.6	D456 N457 S458 M462 Y463 Q464	D456-A460 WeakPolarHBondContact O-CB 3.45Å; D456-A460 PolarHBondContact O-N 3.34Å; N457-A460 PolarHBondContact O-N 3.08Å; S458-A460 PolarHBondContact O-N 2.94Å; A460-M462 VanDerWaalsContact C-N 3.35Å; A460-Y463 PolarHBondContact O-N 3.09Å; A460-Q464 PolarHBondContact O-N 2.66Å
461	L	98.1	Very high	97.1	Very high	67 Å²	67	61.6 Å²	61.6	35%	0.351	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-34.9	176.9	-71.6	167.3	0	0	0	112.3	A449 V452 N457 S458 Q464 T465	A449-L461 HydrophobicContact CB-CB 3.66Å; V452-L461 HydrophobicContact CG2-CD1 3.91Å; N457-L461 WeakPolarHBondContact O-CB 3.36Å; N457-L461 WeakPolarHBondContact O-CG 3.33Å; N457-L461 PolarHBondContact O-N 2.95Å; S458-L461 PolarHBondContact O-N 3.48Å; L461-Q464 PolarHBondContact O-N 3.43Å; L461-T465 WeakPolarHBondContact O-CB 3.5Å; L461-T465 PolarHBondContact O-N 3.43Å; L461-T465 PolarHBondContact O-OG1 2.9Å
462	M	98.4	Very high	97	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-47.9	172.1	-72.7	-65.3	-65.5	0	0	110.9	F446 A449 S458 V459 A460 Q464 T465 I466 R534 L535	F446-M462 HydrophobicContact CD1-CE 3.85Å; F446-M462 HydrophobicContact CD1-SD 3.97Å; F446-M462 HydrophobicContact CE1-CE 4.11Å; A449-M462 HydrophobicContact CB-CG 4.37Å; A449-M462 HydrophobicContact CB-SD 4.05Å; S458-M462 WeakPolarHBondContact O-CB 3.49Å; S458-M462 WeakPolarHBondContact O-CG 3.22Å; S458-M462 PolarHBondContact O-N 3Å; V459-M462 PolarHBondContact O-N 3.22Å; A460-M462 VanDerWaalsContact C-N 3.35Å; M462-Q464 VanDerWaalsContact C-N 3.34Å; M462-Q464 PolarHBondContact O-N 2.95Å; M462-T465 PolarHBondContact O-N 3.45Å; M462-I466 WeakPolarHBondContact O-CB 3.48Å; M462-I466 VanDerWaalsContact O-CD1 3.29Å; M462-I466 WeakPolarHBondContact O-CD1 3.43Å; M462-I466 WeakPolarHBondContact O-CG1 3.32Å; M462-I466 PolarHBondContact O-N 3.2Å; M462-R534 HydrophobicContact CE-CB 3.9Å; M462-R534 HydrophobicContact CG-CB 4.26Å; M462-R534 HydrophobicContact SD-CB 4.29Å; M462-L535 HydrophobicContact CE-CD2 3.59Å; M462-L535 HydrophobicContact CE-CG 3.62Å
463	Y	98.2	Very high	97	Very high	73 Å²	73	56.8 Å²	56.8	29%	0.286	32%	0.316	S	S	.	.	H	α-helix	trans	-58.3	-43.7	175.4	-71.2	-42.5	0	0	0	112.7	V459 A460 I466 S467 L538 P539 Y542	V459-Y463 HydrophobicContact CG1-CD2 3.87Å; V459-Y463 HydrophobicContact CG1-CE2 3.36Å; V459-Y463 WeakPolarHBondContact O-CD2 3.16Å; V459-Y463 PolarHBondContact O-N 3.08Å; A460-Y463 PolarHBondContact O-N 3.09Å; Y463-I466 PolarHBondContact O-N 3.43Å; Y463-S467 PolarHBondContact O-N 2.98Å; Y463-L538 HydrophobicContact CD1-CD1 4Å; Y463-L538 HydrophobicContact CD1-CD2 4.34Å; Y463-L538 HydrophobicContact CE1-CB 4.43Å; Y463-L538 HydrophobicContact CE1-CD1 3.86Å; Y463-L538 HydrophobicContact CE1-CD2 3.76Å; Y463-L538 HydrophobicContact CE1-CG 4.22Å; Y463-P539 VanDerWaalsContact OH-CD 3.27Å; Y463-P539 WeakPolarHBondContact OH-CD 3.45Å; Y463-Y542 HydrophobicContact CD1-CD1 4.19Å; Y463-Y542 AromaticContact CD1-CD2 3.79Å; Y463-Y542 HydrophobicContact CD1-CD2 3.79Å; Y463-Y542 AromaticContact CD1-CE1 3.84Å; Y463-Y542 HydrophobicContact CD1-CE1 3.84Å; Y463-Y542 AromaticContact CD1-CE2 3.41Å; Y463-Y542 HydrophobicContact CD1-CE2 3.41Å; Y463-Y542 VanDerWaalsContact CD1-CE2 3.41Å; Y463-Y542 HydrophobicContact CD1-CG 4.17Å; Y463-Y542 AromaticContact CD1-CZ 3.44Å; Y463-Y542 VanDerWaalsContact CD1-CZ 3.44Å; Y463-Y542 AromaticContact CE1-CD1 3.79Å; Y463-Y542 HydrophobicContact CE1-CD1 3.79Å; Y463-Y542 AromaticContact CE1-CD2 3.49Å; Y463-Y542 HydrophobicContact CE1-CD2 3.49Å; Y463-Y542 VanDerWaalsContact CE1-CD2 3.49Å; Y463-Y542 AromaticContact CE1-CE1 3.94Å; Y463-Y542 HydrophobicContact CE1-CE1 3.94Å; Y463-Y542 AromaticContact CE1-CE2 3.65Å; Y463-Y542 HydrophobicContact CE1-CE2 3.65Å; Y463-Y542 AromaticContact CE1-CG 3.57Å; Y463-Y542 HydrophobicContact CE1-CG 3.57Å; Y463-Y542 AromaticContact CE1-CZ 3.88Å; Y463-Y542 HydrophobicContact CG-CE2 4.35Å
464	Q	98	Very high	97.2	Very high	114 Å²	114	53.1 Å²	53.1	53%	0.533	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-51.8	175.3	-176.9	178.2	-8.7	0	0	111.1	A460 L461 M462 I466 S467 D468	A460-Q464 PolarHBondContact O-N 2.66Å; L461-Q464 PolarHBondContact O-N 3.43Å; M462-Q464 VanDerWaalsContact C-N 3.34Å; M462-Q464 PolarHBondContact O-N 2.95Å; Q464-I466 VanDerWaalsContact C-N 3.3Å; Q464-I466 PolarHBondContact O-N 2.88Å; Q464-S467 WeakPolarHBondContact O-CA 3.37Å; Q464-S467 WeakPolarHBondContact O-CB 3.33Å; Q464-S467 PolarHBondContact O-N 3.28Å; Q464-S467 PolarHBondContact O-OG 3.37Å; Q464-D468 PolarHBondContact O-N 3.01Å; Q464-D468 VanDerWaalsContact O-N 3.15Å
465	T	98.2	Very high	97.2	Very high	10 Å²	10	49.5 Å²	49.5	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-65.4	-31.6	-176.9	-47.3	0	0	0	0	112.4	L442 A445 F446 L461 M462	L442-T465 HydrophobicContact CB-CG2 4.14Å; L442-T465 HydrophobicContact CD2-CG2 4.47Å; A445-T465 HydrophobicContact CB-CG2 3.77Å; F446-T465 HydrophobicContact CD1-CG2 3.93Å; F446-T465 HydrophobicContact CD2-CG2 3.62Å; F446-T465 HydrophobicContact CE1-CG2 3.87Å; F446-T465 HydrophobicContact CE2-CG2 3.56Å; F446-T465 HydrophobicContact CG-CG2 3.8Å; F446-T465 HydrophobicContact CZ-CG2 3.68Å; L461-T465 WeakPolarHBondContact O-CB 3.5Å; L461-T465 PolarHBondContact O-N 3.43Å; L461-T465 PolarHBondContact O-OG1 2.9Å; M462-T465 PolarHBondContact O-N 3.45Å
466	I	98.4	Very high	97.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-36.2	171.9	-63.6	157.8	0	0	0	111.1	F446 M462 Y463 Q464 D468 L469 R474 L535 L538 Y542 W543	F446-I466 HydrophobicContact CE1-CG1 3.83Å; F446-I466 HydrophobicContact CZ-CG1 4.11Å; M462-I466 WeakPolarHBondContact O-CB 3.48Å; M462-I466 VanDerWaalsContact O-CD1 3.29Å; M462-I466 WeakPolarHBondContact O-CD1 3.43Å; M462-I466 WeakPolarHBondContact O-CG1 3.32Å; M462-I466 PolarHBondContact O-N 3.2Å; Y463-I466 PolarHBondContact O-N 3.43Å; Q464-I466 VanDerWaalsContact C-N 3.3Å; Q464-I466 PolarHBondContact O-N 2.88Å; I466-D468 VanDerWaalsContact C-N 3.32Å; I466-D468 PolarHBondContact O-N 3.43Å; I466-L469 WeakPolarHBondContact O-CB 3.35Å; I466-L469 PolarHBondContact O-N 3.06Å; I466-R474 HydrophobicContact CG2-CG 4Å; I466-R474 WeakPolarHBondContact O-CD 3.44Å; I466-L535 HydrophobicContact CD1-CD2 3.81Å; I466-L535 HydrophobicContact CG1-CD2 4.06Å; I466-L538 HydrophobicContact CD1-CD1 3.38Å; I466-Y542 WeakPolarHBondContact CB-OH 3.42Å; I466-Y542 HydrophobicContact CD1-CE1 4.06Å; I466-Y542 HydrophobicContact CG2-CE1 4.27Å; I466-Y542 VanDerWaalsContact CG2-OH 3.23Å; I466-Y542 WeakPolarHBondContact CG2-OH 3.48Å; I466-W543 HydrophobicContact CD1-CH2 3.63Å; I466-W543 HydrophobicContact CD1-CZ2 3.94Å; I466-W543 HydrophobicContact CD1-CZ3 4.47Å; I466-W543 HydrophobicContact CG1-CH2 4.06Å; I466-W543 HydrophobicContact CG2-CH2 3.98Å; I466-W543 HydrophobicContact CG2-CZ3 3.85Å
467	S	96.8	Very high	97.5	Very high	63 Å²	63	38.2 Å²	38.2	44%	0.441	21%	0.207	S	C	.	.	H	α-helix	trans	-66.1	-34.4	177.8	79.8	0	0	0	0	112.8	Y463 Q464 L469	Y463-S467 PolarHBondContact O-N 2.98Å; Q464-S467 WeakPolarHBondContact O-CA 3.37Å; Q464-S467 WeakPolarHBondContact O-CB 3.33Å; Q464-S467 PolarHBondContact O-N 3.28Å; Q464-S467 PolarHBondContact O-OG 3.37Å; S467-L469 VanDerWaalsContact C-N 3.27Å; S467-L469 PolarHBondContact O-N 3.27Å
468	D	97.8	Very high	97.6	Very high	81 Å²	81	33.6 Å²	33.6	43%	0.433	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.6	177.3	-79	-39.4	0	0	0	114.4	R441 L442 Q464 I466	R441-D468 PolarHBondContact NH2-O 3.01Å; L442-D468 HydrophobicContact CD1-CB 3.88Å; L442-D468 HydrophobicContact CD2-CB 4.18Å; Q464-D468 PolarHBondContact O-N 3.01Å; Q464-D468 VanDerWaalsContact O-N 3.15Å; I466-D468 VanDerWaalsContact C-N 3.32Å; I466-D468 PolarHBondContact O-N 3.43Å
469	L	97.9	Very high	97.6	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	19%	0.19	C	C	.	.	S	Bend	trans	-64.7	142.8	176.9	-80	168.8	0	0	0	111.6	L438 T439 L442 F446 I466 S467 N473 R474 L477	L438-L469 HydrophobicContact CD2-CD1 4.31Å; T439-L469 HydrophobicContact CG2-CD2 4.15Å; L442-L469 HydrophobicContact CD1-CD2 3.94Å; L442-L469 HydrophobicContact CD1-CG 4.08Å; F446-L469 HydrophobicContact CE2-CD1 4.32Å; F446-L469 HydrophobicContact CE2-CD2 4.15Å; F446-L469 HydrophobicContact CE2-CG 4.23Å; F446-L469 HydrophobicContact CZ-CD1 3.91Å; F446-L469 HydrophobicContact CZ-CG 4.17Å; I466-L469 WeakPolarHBondContact O-CB 3.35Å; I466-L469 PolarHBondContact O-N 3.06Å; S467-L469 VanDerWaalsContact C-N 3.27Å; S467-L469 PolarHBondContact O-N 3.27Å; L469-N473 HydrophobicContact CB-CB 4.47Å; L469-N473 HydrophobicContact CD2-CB 4.11Å; L469-R474 HydrophobicContact CB-CB 3.94Å; L469-R474 HydrophobicContact CD1-CB 4.48Å; L469-L477 HydrophobicContact CD1-CD2 3.67Å
470	P	96.8	Very high	97.7	Very high	50 Å²	50	33.6 Å²	33.6	33%	0.325	18%	0.18	S	C	.	.			trans	-54.9	143.5	166	-19.9	30.9	0	0	0	110.6	T439 N473 R474	T439-P470 HydrophobicContact CG2-CG 4.06Å; P470-N473 WeakPolarHBondContact O-CA 3.4Å; P470-N473 WeakPolarHBondContact O-CB 3.38Å; P470-N473 PolarHBondContact O-N 2.87Å; P470-R474 PolarHBondContact O-N 3.02Å
471	Q	95.3	Very high	97.8	Very high	80 Å²	80	31 Å²	31	37%	0.374	16%	0.158	S	C	.	.	H	α-helix	trans	-54.6	-45.6	-174.4	178.2	166.8	1.5	0	0	114.3	M365 N473 R474 D475	M365-Q471 HydrophobicContact CG-CG 4.22Å; M365-Q471 HydrophobicContact SD-CB 4.33Å; M365-Q471 HydrophobicContact SD-CG 3.92Å; Q471-N473 PolarHBondContact O-N 2.98Å; Q471-R474 PolarHBondContact O-N 3.11Å; Q471-D475 WeakPolarHBondContact CG-OD1 3.42Å; Q471-D475 VanDerWaalsContact CG-OD2 3.24Å; Q471-D475 WeakPolarHBondContact CG-OD2 3.45Å; Q471-D475 PolarHBondContact NE2-OD2 2.82Å; Q471-D475 WeakPolarHBondContact O-CB 3.45Å; Q471-D475 VanDerWaalsContact O-CG 3.25Å; Q471-D475 PolarHBondContact O-N 2.94Å
472	P	95.9	Very high	97.8	Very high	18 Å²	18	28.6 Å²	28.6	12%	0.117	15%	0.146	C	C	.	.	H	α-helix	trans	-52.7	-41	173.5	-29.7	37.7	0	0	0	113.7	L355 V359 M365 T476	L355-P472 HydrophobicContact CD2-CB 4.36Å; L355-P472 WeakPolarHBondContact CD2-O 3.35Å; L355-P472 HydrophobicContact CG-CB 4.23Å; V359-P472 HydrophobicContact CG1-CB 4.14Å; V359-P472 HydrophobicContact CG2-CB 4.1Å; V359-P472 HydrophobicContact CG2-CG 4.12Å; M365-P472 HydrophobicContact CB-CB 4.42Å; M365-P472 HydrophobicContact CB-CG 4.34Å; M365-P472 HydrophobicContact CE-CG 4.31Å; M365-P472 HydrophobicContact SD-CG 4.02Å; P472-T476 WeakPolarHBondContact O-CB 3.46Å; P472-T476 PolarHBondContact O-N 3.4Å; P472-T476 VanDerWaalsContact O-N 3.14Å; P472-T476 PolarHBondContact O-OG1 3.14Å
473	N	97.8	Very high	97.8	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.032	15%	0.146	C	C	.	.	H	α-helix	trans	-70.5	-45.6	179.7	-61	62.4	0	0	0	111.3	L355 L437 L469 P470 Q471 L477	L355-N473 HydrophobicContact CD2-CB 4.21Å; L437-N473 HydrophobicContact CD1-CB 4.33Å; L437-N473 WeakPolarHBondContact O-CB 3.47Å; L437-N473 PolarHBondContact O-ND2 3.27Å; L469-N473 HydrophobicContact CB-CB 4.47Å; L469-N473 HydrophobicContact CD2-CB 4.11Å; P470-N473 WeakPolarHBondContact O-CA 3.4Å; P470-N473 WeakPolarHBondContact O-CB 3.38Å; P470-N473 PolarHBondContact O-N 2.87Å; Q471-N473 PolarHBondContact O-N 2.98Å; N473-L477 WeakPolarHBondContact O-CB 3.45Å; N473-L477 PolarHBondContact O-N 3.47Å
474	R	97.9	Very high	97.8	Very high	44 Å²	44	25.1 Å²	25.1	17%	0.166	13%	0.132	C	C	.	.	H	α-helix	trans	-67.6	-46.3	-179.2	-167.9	-177.4	60.6	-122.3	-12.3	112.4	I466 L469 P470 Q471 L477 A478 Y546	I466-R474 HydrophobicContact CG2-CG 4Å; I466-R474 WeakPolarHBondContact O-CD 3.44Å; L469-R474 HydrophobicContact CB-CB 3.94Å; L469-R474 HydrophobicContact CD1-CB 4.48Å; P470-R474 PolarHBondContact O-N 3.02Å; Q471-R474 PolarHBondContact O-N 3.11Å; R474-L477 PolarHBondContact O-N 3.41Å; R474-A478 WeakPolarHBondContact O-CB 3.45Å; R474-A478 PolarHBondContact O-N 3.5Å; R474-Y546 HydrophobicContact CG-CD1 4.48Å; R474-Y546 HydrophobicContact CG-CD2 4.5Å; R474-Y546 HydrophobicContact CG-CG 4.47Å
475	D	97.1	Very high	97.8	Very high	3 Å²	3	21 Å²	21	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-66	-41	-179.8	-62.4	6.7	0	0	0	110.3	P364 M365 I366 Q471 F479	P364-D475 HydrophobicContact CB-CB 4.46Å; M365-D475 HydrophobicContact CB-CB 4.47Å; M365-D475 PolarHBondContact N-OD2 3.45Å; I366-D475 HydrophobicContact CG1-CB 4.31Å; Q471-D475 WeakPolarHBondContact CG-OD1 3.42Å; Q471-D475 VanDerWaalsContact CG-OD2 3.24Å; Q471-D475 WeakPolarHBondContact CG-OD2 3.45Å; Q471-D475 PolarHBondContact NE2-OD2 2.82Å; Q471-D475 WeakPolarHBondContact O-CB 3.45Å; Q471-D475 VanDerWaalsContact O-CG 3.25Å; Q471-D475 PolarHBondContact O-N 2.94Å; D475-F479 PolarHBondContact O-N 3.43Å; D475-F479 VanDerWaalsContact O-N 3.16Å
476	T	98.2	Very high	97.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66	-41.2	173.7	-61.2	0	0	0	0	112.5	L355 M365 P367 L437 P472 L480	L355-T476 HydrophobicContact CD2-CG2 4.48Å; M365-T476 PolarHBondContact O-OG1 2.89Å; P367-T476 VanDerWaalsContact CD-OG1 3.26Å; P367-T476 WeakPolarHBondContact CD-OG1 3.24Å; L437-T476 HydrophobicContact CD1-CG2 3.97Å; P472-T476 WeakPolarHBondContact O-CB 3.46Å; P472-T476 PolarHBondContact O-N 3.4Å; P472-T476 VanDerWaalsContact O-N 3.14Å; P472-T476 PolarHBondContact O-OG1 3.14Å; T476-L480 WeakPolarHBondContact O-CB 3.4Å; T476-L480 PolarHBondContact O-N 3.23Å
477	L	98.4	Very high	97.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.7	-45.4	176.5	179.8	66.3	0	0	0	111.2	L437 L438 L469 N473 R474 F479 L480 I481 I508 L535 W543	L437-L477 HydrophobicContact CD2-CB 4.22Å; L437-L477 HydrophobicContact CD2-CD1 3.95Å; L437-L477 HydrophobicContact CG-CB 4.49Å; L438-L477 HydrophobicContact CD2-CD1 3.99Å; L438-L477 HydrophobicContact CD2-CD2 3.55Å; L438-L477 HydrophobicContact CD2-CG 4.38Å; L469-L477 HydrophobicContact CD1-CD2 3.67Å; N473-L477 WeakPolarHBondContact O-CB 3.45Å; N473-L477 PolarHBondContact O-N 3.47Å; R474-L477 PolarHBondContact O-N 3.41Å; L477-F479 PolarHBondContact O-N 3.18Å; L477-L480 PolarHBondContact O-N 3.44Å; L477-I481 HydrophobicContact CD1-CD1 4.39Å; L477-I481 HydrophobicContact CD1-CG1 3.94Å; L477-I481 HydrophobicContact CG-CG1 4.22Å; L477-I481 WeakPolarHBondContact O-CB 3.24Å; L477-I481 WeakPolarHBondContact O-CG1 3.49Å; L477-I481 PolarHBondContact O-N 2.98Å; L477-I508 HydrophobicContact CD1-CD1 4.01Å; L477-L535 HydrophobicContact CD1-CD1 4.33Å; L477-L535 HydrophobicContact CD2-CD2 4.18Å; L477-W543 HydrophobicContact CD2-CH2 3.75Å; L477-W543 HydrophobicContact CD2-CZ3 4.09Å; L477-W543 HydrophobicContact CG-CH2 3.95Å; L477-W543 HydrophobicContact CG-CZ3 4.08Å
478	A	98.2	Very high	97.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.3	-47.9	178.2	0	0	0	0	0	112	R474 L480 I481 L482 W543 Y546 V547	R474-A478 WeakPolarHBondContact O-CB 3.45Å; R474-A478 PolarHBondContact O-N 3.5Å; A478-L480 VanDerWaalsContact C-N 3.35Å; A478-L480 PolarHBondContact O-N 3.36Å; A478-I481 PolarHBondContact O-N 2.8Å; A478-L482 WeakPolarHBondContact O-CB 3.46Å; A478-L482 VanDerWaalsContact O-CG 3.27Å; A478-L482 WeakPolarHBondContact O-CG 3.31Å; A478-L482 PolarHBondContact O-N 2.77Å; A478-W543 VanDerWaalsContact CA-CE3 3.45Å; A478-W543 HydrophobicContact CB-CB 4.48Å; A478-W543 HydrophobicContact CB-CE3 3.6Å; A478-W543 HydrophobicContact CB-CZ3 4.22Å; A478-Y546 HydrophobicContact CB-CD2 4.11Å; A478-Y546 HydrophobicContact CB-CG 4.39Å; A478-V547 HydrophobicContact CB-CG2 3.89Å
479	F	98.2	Very high	97.8	Very high	36 Å²	36	26.2 Å²	26.2	16%	0.158	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-40.6	176.2	-177.1	-101.8	0	0	0	112.6	I366 V370 V371 V374 D475 L477 H483 V547	I366-F479 HydrophobicContact CD1-CB 3.64Å; I366-F479 HydrophobicContact CD1-CD2 3.98Å; I366-F479 HydrophobicContact CD1-CG 3.82Å; I366-F479 HydrophobicContact CG1-CB 4.24Å; I366-F479 HydrophobicContact CG2-CB 4.4Å; I366-F479 HydrophobicContact CG2-CD1 3.92Å; I366-F479 HydrophobicContact CG2-CE1 4.49Å; I366-F479 HydrophobicContact CG2-CG 4.25Å; V370-F479 HydrophobicContact CG1-CD1 3.86Å; V370-F479 HydrophobicContact CG1-CE1 4.03Å; V371-F479 HydrophobicContact CB-CE1 4.42Å; V371-F479 HydrophobicContact CB-CZ 4.32Å; V371-F479 HydrophobicContact CG1-CZ 4.17Å; V371-F479 HydrophobicContact CG2-CE1 4.2Å; V371-F479 HydrophobicContact CG2-CZ 4.26Å; V374-F479 HydrophobicContact CB-CE1 3.59Å; V374-F479 HydrophobicContact CB-CZ 3.85Å; V374-F479 HydrophobicContact CG1-CE1 3.73Å; V374-F479 HydrophobicContact CG1-CZ 3.62Å; V374-F479 HydrophobicContact CG2-CD1 4.34Å; V374-F479 HydrophobicContact CG2-CE1 3.67Å; V374-F479 HydrophobicContact CG2-CZ 4.4Å; D475-F479 PolarHBondContact O-N 3.43Å; D475-F479 VanDerWaalsContact O-N 3.16Å; L477-F479 PolarHBondContact O-N 3.18Å; F479-H483 PolarHBondContact O-N 3.04Å; F479-V547 HydrophobicContact CB-CG2 4.16Å; F479-V547 HydrophobicContact CD2-CG1 3.99Å
480	L	98.6	Very high	97.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.6	-44.4	176.1	-179.1	64.2	0	0	0	112.5	L426 L430 L437 T476 L477 A478 H483 L484 F504 I508	L426-L480 HydrophobicContact CD2-CD1 4.28Å; L430-L480 HydrophobicContact CD1-CD1 4.45Å; L430-L480 HydrophobicContact CD1-CD2 3.77Å; L437-L480 HydrophobicContact CD2-CD2 4.1Å; T476-L480 WeakPolarHBondContact O-CB 3.4Å; T476-L480 PolarHBondContact O-N 3.23Å; L477-L480 PolarHBondContact O-N 3.44Å; A478-L480 VanDerWaalsContact C-N 3.35Å; A478-L480 PolarHBondContact O-N 3.36Å; L480-H483 WeakPolarHBondContact O-CB 3.49Å; L480-H483 PolarHBondContact O-N 3.47Å; L480-L484 HydrophobicContact CD1-CD1 4.1Å; L480-L484 HydrophobicContact CD1-CG 4.13Å; L480-L484 HydrophobicContact CG-CD1 3.95Å; L480-L484 HydrophobicContact CG-CG 4.32Å; L480-L484 VanDerWaalsContact O-CG 3.32Å; L480-L484 WeakPolarHBondContact O-CG 3.32Å; L480-L484 PolarHBondContact O-N 3.4Å; L480-F504 HydrophobicContact CD1-CE1 4.06Å; L480-F504 HydrophobicContact CD1-CZ 4.43Å; L480-F504 HydrophobicContact CD2-CD1 4.25Å; L480-F504 HydrophobicContact CD2-CE1 4.15Å; L480-I508 HydrophobicContact CD2-CD1 4.39Å; L480-I508 HydrophobicContact CD2-CG2 3.84Å
481	I	98.6	Very high	97.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68	-38.4	-178.9	-66.8	-65.9	0	0	0	111.4	L477 A478 H483 L484 K485 L535 L536 W543	L477-I481 HydrophobicContact CD1-CD1 4.39Å; L477-I481 HydrophobicContact CD1-CG1 3.94Å; L477-I481 HydrophobicContact CG-CG1 4.22Å; L477-I481 WeakPolarHBondContact O-CB 3.24Å; L477-I481 WeakPolarHBondContact O-CG1 3.49Å; L477-I481 PolarHBondContact O-N 2.98Å; A478-I481 PolarHBondContact O-N 2.8Å; I481-H483 VanDerWaalsContact C-N 3.31Å; I481-H483 PolarHBondContact O-N 3.29Å; I481-L484 PolarHBondContact O-N 3.29Å; I481-K485 WeakPolarHBondContact O-CG 3.28Å; I481-K485 PolarHBondContact O-N 3.05Å; I481-L535 HydrophobicContact CD1-CB 3.78Å; I481-L535 HydrophobicContact CG1-CB 4.39Å; I481-L536 HydrophobicContact CD1-CD2 4.18Å; I481-L536 HydrophobicContact CD1-CG 4.25Å; I481-L536 HydrophobicContact CG2-CD2 4.21Å; I481-W543 HydrophobicContact CB-CD2 4.28Å; I481-W543 HydrophobicContact CB-CG 4.48Å; I481-W543 HydrophobicContact CB-CZ2 4.4Å; I481-W543 HydrophobicContact CG1-CH2 4.47Å; I481-W543 HydrophobicContact CG1-CZ2 4.13Å; I481-W543 HydrophobicContact CG2-CD2 4.17Å; I481-W543 HydrophobicContact CG2-CG 4.12Å; I481-W543 HydrophobicContact CG2-CZ2 4.19Å; I481-W543 VanDerWaalsContact CG2-NE1 3.31Å
482	L	98.4	Very high	97.7	Very high	17 Å²	17	33.2 Å²	33.2	9%	0.089	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-41.2	171.7	-72.4	168.3	0	0	0	112.1	A478 R486 V540 W543 V547	A478-L482 WeakPolarHBondContact O-CB 3.46Å; A478-L482 VanDerWaalsContact O-CG 3.27Å; A478-L482 WeakPolarHBondContact O-CG 3.31Å; A478-L482 PolarHBondContact O-N 2.77Å; L482-R486 WeakPolarHBondContact O-CG 3.32Å; L482-R486 PolarHBondContact O-N 2.85Å; L482-V540 HydrophobicContact CD2-CG1 3.84Å; L482-W543 HydrophobicContact CD1-CB 4.24Å; L482-W543 HydrophobicContact CD2-CB 3.85Å; L482-W543 HydrophobicContact CG-CB 3.79Å; L482-V547 HydrophobicContact CD1-CB 4.44Å; L482-V547 HydrophobicContact CD1-CG2 3.87Å
483	H	98.3	Very high	97.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-48.1	174.3	175.5	56.3	0	0	0	112.4	V374 E378 Y388 F479 L480 I481 K485 R486 V487	V374-H483 HydrophobicContact CG1-CB 3.84Å; V374-H483 HydrophobicContact CG2-CB 4.21Å; E378-H483 WeakPolarHBondContact CG-ND1 3.23Å; E378-H483 IonicContact OE1-CE1 3.44Å; E378-H483 IonicContact OE1-CG 3.51Å; E378-H483 IonicContact OE1-ND1 3.6Å; E378-H483 PolarHBondContact OE1-ND1 2.88Å; Y388-H483 AromaticContact CE2-NE2 3.55Å; Y388-H483 AromaticContact CZ-NE2 3.6Å; Y388-H483 PolarHBondContact OH-CD2 3.42Å; Y388-H483 PolarHBondContact OH-NE2 3.3Å; F479-H483 PolarHBondContact O-N 3.04Å; L480-H483 WeakPolarHBondContact O-CB 3.49Å; L480-H483 PolarHBondContact O-N 3.47Å; I481-H483 VanDerWaalsContact C-N 3.31Å; I481-H483 PolarHBondContact O-N 3.29Å; H483-K485 VanDerWaalsContact C-N 3.31Å; H483-K485 PolarHBondContact O-N 3.39Å; H483-R486 WeakPolarHBondContact O-CB 3.46Å; H483-R486 PolarHBondContact O-N 3.47Å; H483-R486 VanDerWaalsContact O-N 3.13Å; H483-V487 PolarHBondContact O-N 3.32Å; H483-V487 VanDerWaalsContact O-N 3.12Å
484	L	98.6	Very high	97.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-29.6	-176.5	-68.5	179.7	0	0	0	113.1	Y388 L480 I481 V487 A488 L500 F504 L536	Y388-L484 HydrophobicContact CD2-CD2 4.04Å; Y388-L484 HydrophobicContact CE2-CD2 3.8Å; L480-L484 HydrophobicContact CD1-CD1 4.1Å; L480-L484 HydrophobicContact CD1-CG 4.13Å; L480-L484 HydrophobicContact CG-CD1 3.95Å; L480-L484 HydrophobicContact CG-CG 4.32Å; L480-L484 VanDerWaalsContact O-CG 3.32Å; L480-L484 WeakPolarHBondContact O-CG 3.32Å; L480-L484 PolarHBondContact O-N 3.4Å; I481-L484 PolarHBondContact O-N 3.29Å; L484-V487 PolarHBondContact O-N 2.91Å; L484-A488 PolarHBondContact O-N 3Å; L484-A488 VanDerWaalsContact O-N 3.1Å; L484-L500 HydrophobicContact CB-CD1 4.3Å; L484-L500 HydrophobicContact CD2-CD1 4.47Å; L484-L500 HydrophobicContact CD2-CD2 4.31Å; L484-L500 VanDerWaalsContact O-CD1 3.25Å; L484-L500 WeakPolarHBondContact O-CD1 3.47Å; L484-F504 HydrophobicContact CD1-CD1 4.02Å; L484-F504 HydrophobicContact CD1-CD2 3.7Å; L484-F504 HydrophobicContact CD1-CE1 4.11Å; L484-F504 HydrophobicContact CD1-CE2 3.8Å; L484-F504 HydrophobicContact CD1-CG 3.81Å; L484-F504 HydrophobicContact CD1-CZ 4Å; L484-F504 HydrophobicContact CD2-CD2 4.06Å; L484-F504 HydrophobicContact CD2-CE2 3.41Å; L484-F504 VanDerWaalsContact CD2-CE2 3.41Å; L484-F504 HydrophobicContact CD2-CZ 3.71Å; L484-F504 HydrophobicContact CG-CE2 4.26Å; L484-F504 HydrophobicContact CG-CZ 4.42Å; L484-L536 HydrophobicContact CB-CD2 3.78Å
485	K	98.1	Very high	97.7	Very high	26 Å²	26	37.5 Å²	37.5	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-52.8	167.1	-76.1	174	174.5	-74.7	0	111.4	I481 H483 V487 A488 D489 L536 L538 V540	I481-K485 WeakPolarHBondContact O-CG 3.28Å; I481-K485 PolarHBondContact O-N 3.05Å; H483-K485 VanDerWaalsContact C-N 3.31Å; H483-K485 PolarHBondContact O-N 3.39Å; K485-V487 PolarHBondContact O-N 2.92Å; K485-V487 VanDerWaalsContact O-N 3.14Å; K485-A488 CarbonylContact O-C 3.55Å; K485-A488 WeakPolarHBondContact O-CA 3.38Å; K485-A488 WeakPolarHBondContact O-CB 3.36Å; K485-A488 PolarHBondContact O-N 3.1Å; K485-D489 PolarHBondContact O-N 3.23Å; K485-D489 VanDerWaalsContact O-OD2 3.1Å; K485-L536 WeakPolarHBondContact CE-O 3.38Å; K485-L536 HydrophobicContact CG-CD2 4.11Å; K485-L536 PolarHBondContact NZ-O 3.04Å; K485-L538 WeakPolarHBondContact CE-O 3.4Å; K485-L538 PolarHBondContact NZ-O 3.47Å; K485-V540 HydrophobicContact CD-CG2 3.86Å
486	R	98.1	Very high	97.7	Very high	119 Å²	119	41 Å²	41	45%	0.449	20%	0.204	S	C	.	.	H	α-helix	trans	-58.3	-30.1	178.3	-63.7	161.3	178.3	172.9	-2.2	113.6	E378 L482 H483 S490	E378-R486 WeakPolarHBondContact OE1-CD 3.35Å; E378-R486 IonicContact OE1-CZ 3.83Å; E378-R486 IonicContact OE1-NE 3.72Å; E378-R486 IonicContact OE1-NH1 2.68Å; E378-R486 PolarHBondContact OE1-NH1 2.95Å; E378-R486 IonicContact OE2-CZ 3.09Å; E378-R486 IonicContact OE2-NH1 3.78Å; E378-R486 PolarHBondContact OE2-NH1 3.37Å; L482-R486 WeakPolarHBondContact O-CG 3.32Å; L482-R486 PolarHBondContact O-N 2.85Å; H483-R486 WeakPolarHBondContact O-CB 3.46Å; H483-R486 PolarHBondContact O-N 3.47Å; H483-R486 VanDerWaalsContact O-N 3.13Å; R486-S490 PolarHBondContact O-N 3.03Å
487	V	98.3	Very high	97.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.4	-45.6	173	174	0	0	0	0	110.8	L382 L387 Y388 H483 L484 K485 S490 T493 M495 L500	L382-V487 HydrophobicContact CD2-CG2 3.81Å; L387-V487 HydrophobicContact CB-CG1 4.16Å; L387-V487 HydrophobicContact CD1-CG1 4.02Å; L387-V487 HydrophobicContact CD1-CG2 4.07Å; Y388-V487 HydrophobicContact CE2-CG2 4.21Å; H483-V487 PolarHBondContact O-N 3.32Å; H483-V487 VanDerWaalsContact O-N 3.12Å; L484-V487 PolarHBondContact O-N 2.91Å; K485-V487 PolarHBondContact O-N 2.92Å; K485-V487 VanDerWaalsContact O-N 3.14Å; V487-S490 PolarHBondContact O-N 2.97Å; V487-T493 HydrophobicContact CG1-CG2 4.23Å; V487-T493 PolarHBondContact O-OG1 3.43Å; V487-M495 HydrophobicContact CG1-CB 4.3Å; V487-L500 HydrophobicContact CB-CD1 4.19Å; V487-L500 HydrophobicContact CG1-CD1 4.04Å; V487-L500 HydrophobicContact CG1-CD2 3.99Å
488	A	97.8	Very high	97.7	Very high	25 Å²	25	45.6 Å²	45.6	21%	0.207	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-33.2	176.6	0	0	0	0	0	113.6	L484 K485 S490 M495 I497 L500	L484-A488 PolarHBondContact O-N 3Å; L484-A488 VanDerWaalsContact O-N 3.1Å; K485-A488 CarbonylContact O-C 3.55Å; K485-A488 WeakPolarHBondContact O-CA 3.38Å; K485-A488 WeakPolarHBondContact O-CB 3.36Å; K485-A488 PolarHBondContact O-N 3.1Å; A488-S490 PolarHBondContact O-N 2.64Å; A488-M495 WeakPolarHBondContact CA-O 3.39Å; A488-I497 HydrophobicContact CB-CG1 4.03Å; A488-L500 HydrophobicContact CB-CD1 3.99Å
489	D	97.1	Very high	97.7	Very high	121 Å²	121	47.6 Å²	47.6	65%	0.647	24%	0.242	S	C	*	.	H	α-helix	trans	-68.5	-23.9	175.7	-60.2	-36.1	0	0	0	112	K485 L491	K485-D489 PolarHBondContact O-N 3.23Å; K485-D489 VanDerWaalsContact O-OD2 3.1Å; D489-L491 PolarHBondContact O-N 2.88Å
490	S	96.9	Very high	97.7	Very high	27 Å²	27	45.9 Å²	45.9	19%	0.189	23%	0.234	C	C	.	.			trans	-85.9	107.8	178.1	-176.2	0	0	0	0	112.3	L382 R486 V487 A488 D492 T493	L382-S490 PolarHBondContact O-OG 3.27Å; R486-S490 PolarHBondContact O-N 3.03Å; V487-S490 PolarHBondContact O-N 2.97Å; A488-S490 PolarHBondContact O-N 2.64Å; S490-D492 PolarHBondContact O-N 2.99Å; S490-T493 PolarHBondContact O-N 3.01Å; S490-T493 PolarHBondContact O-OG1 3.02Å
491	L	95.6	Very high	97.7	Very high	156 Å²	156	45.9 Å²	45.9	82%	0.817	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-56.7	-32.9	-179.7	-59	178.6	0	0	0	113.8	D489 T493 K494	D489-L491 PolarHBondContact O-N 2.88Å; L491-T493 VanDerWaalsContact C-N 3.28Å; L491-T493 PolarHBondContact O-N 3.41Å; L491-K494 PolarHBondContact O-N 3.49Å
492	D	96.3	Very high	97.7	Very high	98 Å²	98	52.5 Å²	52.5	52%	0.524	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-65.8	-31.5	-178.2	-71.2	-32	0	0	0	112.4	S490 K494	S490-D492 PolarHBondContact O-N 2.99Å; D492-K494 VanDerWaalsContact C-N 3.27Å; D492-K494 PolarHBondContact O-N 3.07Å
493	T	96.7	Very high	97.7	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-67.7	-29.4	179.7	75.4	0	0	0	0	112.2	L382 G386 L387 V487 S490 L491 M495	L382-T493 VanDerWaalsContact O-CG2 3.28Å; L382-T493 WeakPolarHBondContact O-CG2 3.43Å; G386-T493 PolarHBondContact N-O 3.37Å; L387-T493 HydrophobicContact CD1-CG2 3.96Å; L387-T493 HydrophobicContact CG-CG2 4.36Å; V487-T493 HydrophobicContact CG1-CG2 4.23Å; V487-T493 PolarHBondContact O-OG1 3.43Å; S490-T493 PolarHBondContact O-N 3.01Å; S490-T493 PolarHBondContact O-OG1 3.02Å; L491-T493 VanDerWaalsContact C-N 3.28Å; L491-T493 PolarHBondContact O-N 3.41Å; T493-M495 WeakPolarHBondContact O-CG 3.4Å; T493-M495 PolarHBondContact O-N 3Å; T493-M495 PolarHBondContact OG1-N 2.97Å
494	K	96.9	Very high	97.7	Very high	154 Å²	154	53.3 Å²	53.3	67%	0.67	26%	0.264	S	S	*	.			trans	55.6	31.8	-174.3	-55.6	164.8	-167.6	171.3	0	112.7	A385 L491 D492	A385-K494 HydrophobicContact CB-CD 4.43Å; L491-K494 PolarHBondContact O-N 3.49Å; D492-K494 VanDerWaalsContact C-N 3.27Å; D492-K494 PolarHBondContact O-N 3.07Å
495	M	97.6	Very high	97.7	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.015	26%	0.264	C	S	.	.			trans	-121.7	76.9	-175.5	-75	-64.5	-56.8	0	0	111.2	L387 R389 V487 A488 T493 N499 L500	L387-M495 WeakPolarHBondContact O-CE 3.46Å; L387-M495 WeakPolarHBondContact O-CG 3.35Å; R389-M495 HydrophobicContact CB-CE 3.73Å; R389-M495 HydrophobicContact CB-SD 3.52Å; R389-M495 VanDerWaalsContact CB-SD 3.52Å; R389-M495 HydrophobicContact CG-SD 4.37Å; V487-M495 HydrophobicContact CG1-CB 4.3Å; A488-M495 WeakPolarHBondContact CA-O 3.39Å; T493-M495 WeakPolarHBondContact O-CG 3.4Å; T493-M495 PolarHBondContact O-N 3Å; T493-M495 PolarHBondContact OG1-N 2.97Å; M495-N499 HydrophobicContact CE-CB 3.77Å; M495-N499 HydrophobicContact SD-CB 4.08Å; M495-L500 HydrophobicContact CB-CD2 4.08Å; M495-L500 HydrophobicContact CB-CG 4.28Å; M495-L500 HydrophobicContact CE-CD2 3.73Å; M495-L500 HydrophobicContact CE-CG 4.23Å
496	D	97.7	Very high	97.6	Very high	76 Å²	76	55 Å²	55	41%	0.406	28%	0.278	S	S	.	.			trans	-60	169	173.8	62.1	64.5	0	0	0	113.5	S498 N499 L500	D496-S498 PolarHBondContact O-N 3.26Å; D496-S498 VanDerWaalsContact O-N 3.16Å; D496-S498 WeakPolarHBondContact OD1-CA 3.29Å; D496-S498 VanDerWaalsContact OD1-CB 3.32Å; D496-S498 WeakPolarHBondContact OD1-CB 3.43Å; D496-S498 PolarHBondContact OD1-N 2.95Å; D496-N499 PolarHBondContact O-N 3.39Å; D496-N499 VanDerWaalsContact O-N 3.12Å; D496-N499 PolarHBondContact OD1-N 3.4Å; D496-N499 PolarHBondContact OD1-ND2 2.94Å; D496-N499 PolarHBondContact OD2-ND2 3.29Å; D496-L500 PolarHBondContact O-N 3.44Å
497	I	97.9	Very high	97.6	Very high	68 Å²	68	49.7 Å²	49.7	35%	0.349	26%	0.259	S	S	.	.	H	α-helix	trans	-48.6	-41.7	178.5	-71.8	175.3	0	0	0	112.5	A488 A501 E533 L536	A488-I497 HydrophobicContact CB-CG1 4.03Å; I497-A501 WeakPolarHBondContact O-CB 3.41Å; I497-A501 PolarHBondContact O-N 3.49Å; I497-E533 HydrophobicContact CG2-CB 4.35Å; I497-E533 HydrophobicContact CG2-CG 4.25Å; I497-L536 HydrophobicContact CB-CD1 4.39Å; I497-L536 HydrophobicContact CD1-CB 4.41Å; I497-L536 HydrophobicContact CG1-CB 4.27Å; I497-L536 HydrophobicContact CG1-CD1 4.5Å; I497-L536 HydrophobicContact CG2-CB 3.77Å; I497-L536 HydrophobicContact CG2-CD1 3.89Å; I497-L536 HydrophobicContact CG2-CG 4.48Å
498	S	97.9	Very high	97.6	Very high	29 Å²	29	49.7 Å²	49.7	20%	0.203	26%	0.259	C	S	.	.	H	α-helix	trans	-75	-37.8	-176.3	-165.6	0	0	0	0	111.7	D496 A501 R502 E533	D496-S498 PolarHBondContact O-N 3.26Å; D496-S498 VanDerWaalsContact O-N 3.16Å; D496-S498 WeakPolarHBondContact OD1-CA 3.29Å; D496-S498 VanDerWaalsContact OD1-CB 3.32Å; D496-S498 WeakPolarHBondContact OD1-CB 3.43Å; D496-S498 PolarHBondContact OD1-N 2.95Å; S498-A501 PolarHBondContact O-N 3.36Å; S498-R502 VanDerWaalsContact C-NH1 3.25Å; S498-R502 WeakPolarHBondContact O-CG 3.47Å; S498-R502 PolarHBondContact O-N 2.93Å; S498-R502 PolarHBondContact O-NH1 3.31Å; S498-R502 VanDerWaalsContact O-NH1 3.09Å; S498-R502 PolarHBondContact OG-NH1 3.31Å; S498-R502 PolarHBondContact OG-NH2 3.34Å; S498-E533 VanDerWaalsContact CA-OE1 3.25Å; S498-E533 WeakPolarHBondContact CA-OE1 3.3Å; S498-E533 WeakPolarHBondContact CB-OE1 3.29Å; S498-E533 PolarHBondContact OG-OE1 3.28Å
499	N	98	Very high	97.6	Very high	43 Å²	43	48.5 Å²	48.5	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-39.1	173.1	-82.6	-57.1	0	0	0	112.3	M495 D496	M495-N499 HydrophobicContact CE-CB 3.77Å; M495-N499 HydrophobicContact SD-CB 4.08Å; D496-N499 PolarHBondContact O-N 3.39Å; D496-N499 VanDerWaalsContact O-N 3.12Å; D496-N499 PolarHBondContact OD1-N 3.4Å; D496-N499 PolarHBondContact OD1-ND2 2.94Å; D496-N499 PolarHBondContact OD2-ND2 3.29Å
500	L	98.6	Very high	97.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-43	171.3	-67.6	174.6	0	0	0	111.5	Y388 L484 V487 A488 M495 D496 R502 V503 F504 L536	Y388-L500 HydrophobicContact CD2-CD2 4.19Å; L484-L500 HydrophobicContact CB-CD1 4.3Å; L484-L500 HydrophobicContact CD2-CD1 4.47Å; L484-L500 HydrophobicContact CD2-CD2 4.31Å; L484-L500 VanDerWaalsContact O-CD1 3.25Å; L484-L500 WeakPolarHBondContact O-CD1 3.47Å; V487-L500 HydrophobicContact CB-CD1 4.19Å; V487-L500 HydrophobicContact CG1-CD1 4.04Å; V487-L500 HydrophobicContact CG1-CD2 3.99Å; A488-L500 HydrophobicContact CB-CD1 3.99Å; M495-L500 HydrophobicContact CB-CD2 4.08Å; M495-L500 HydrophobicContact CB-CG 4.28Å; M495-L500 HydrophobicContact CE-CD2 3.73Å; M495-L500 HydrophobicContact CE-CG 4.23Å; D496-L500 PolarHBondContact O-N 3.44Å; L500-R502 PolarHBondContact O-N 3.35Å; L500-V503 PolarHBondContact O-N 2.95Å; L500-F504 WeakPolarHBondContact O-CD2 3.45Å; L500-F504 PolarHBondContact O-N 2.91Å; L500-L536 HydrophobicContact CB-CD1 4.38Å
501	A	98.5	Very high	97.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-40.2	179	0	0	0	0	0	113.5	I497 S498 V503 F504 G505 P529 V532 E533	I497-A501 WeakPolarHBondContact O-CB 3.41Å; I497-A501 PolarHBondContact O-N 3.49Å; S498-A501 PolarHBondContact O-N 3.36Å; A501-V503 VanDerWaalsContact C-N 3.26Å; A501-V503 PolarHBondContact O-N 3.46Å; A501-F504 PolarHBondContact O-N 3.28Å; A501-G505 PolarHBondContact O-N 2.8Å; A501-P529 HydrophobicContact CB-CB 4.3Å; A501-P529 WeakPolarHBondContact CB-O 3.38Å; A501-V532 HydrophobicContact CB-CB 3.85Å; A501-V532 HydrophobicContact CB-CG1 4.04Å; A501-E533 HydrophobicContact CB-CG 3.41Å; A501-E533 VanDerWaalsContact CB-CG 3.41Å
502	R	98.1	Very high	97.4	Very high	139 Å²	139	38.5 Å²	38.5	53%	0.525	20%	0.202	S	C	.	.	H	α-helix	trans	-61.3	-31.5	173.3	-72.5	178.9	-169.7	82.5	19.5	113.4	S498 L500 P529	S498-R502 VanDerWaalsContact C-NH1 3.25Å; S498-R502 WeakPolarHBondContact O-CG 3.47Å; S498-R502 PolarHBondContact O-N 2.93Å; S498-R502 PolarHBondContact O-NH1 3.31Å; S498-R502 VanDerWaalsContact O-NH1 3.09Å; S498-R502 PolarHBondContact OG-NH1 3.31Å; S498-R502 PolarHBondContact OG-NH2 3.34Å; L500-R502 PolarHBondContact O-N 3.35Å; R502-P529 HydrophobicContact CG-CB 4.45Å; R502-P529 HydrophobicContact CG-CG 4.47Å
503	V	98.1	Very high	97.3	Very high	34 Å²	34	37.4 Å²	37.4	21%	0.206	20%	0.198	C	C	.	.	H	α-helix	trans	-81.9	-41.2	177.1	174	0	0	0	0	111.7	Y388 R389 K427 L500 A501 T507	Y388-V503 WeakPolarHBondContact O-CG1 3.17Å; R389-V503 HydrophobicContact CB-CG2 4.49Å; K427-V503 HydrophobicContact CD-CG1 3.75Å; L500-V503 PolarHBondContact O-N 2.95Å; A501-V503 VanDerWaalsContact C-N 3.26Å; A501-V503 PolarHBondContact O-N 3.46Å; V503-T507 PolarHBondContact O-OG1 2.91Å
504	F	98.6	Very high	97	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-86.3	-26.2	-173	-84.2	-84.2	0	0	0	114	Y388 K427 L430 L480 L484 L500 A501 T507 I508 V532	Y388-F504 AromaticContact CD1-CE2 3.69Å; Y388-F504 HydrophobicContact CD1-CE2 3.69Å; Y388-F504 AromaticContact CD1-CZ 3.47Å; Y388-F504 HydrophobicContact CD1-CZ 3.47Å; Y388-F504 VanDerWaalsContact CD1-CZ 3.47Å; Y388-F504 HydrophobicContact CD2-CE2 4.05Å; Y388-F504 HydrophobicContact CD2-CZ 4.39Å; Y388-F504 HydrophobicContact CE1-CE2 4.25Å; Y388-F504 AromaticContact CE1-CZ 3.67Å; Y388-F504 HydrophobicContact CE1-CZ 3.67Å; Y388-F504 AromaticContact CG-CE2 3.59Å; Y388-F504 HydrophobicContact CG-CE2 3.59Å; Y388-F504 AromaticContact CG-CZ 3.87Å; Y388-F504 HydrophobicContact CG-CZ 3.87Å; K427-F504 HydrophobicContact CG-CZ 4.49Å; L430-F504 HydrophobicContact CD1-CE1 4.44Å; L480-F504 HydrophobicContact CD1-CE1 4.06Å; L480-F504 HydrophobicContact CD1-CZ 4.43Å; L480-F504 HydrophobicContact CD2-CD1 4.25Å; L480-F504 HydrophobicContact CD2-CE1 4.15Å; L484-F504 HydrophobicContact CD1-CD1 4.02Å; L484-F504 HydrophobicContact CD1-CD2 3.7Å; L484-F504 HydrophobicContact CD1-CE1 4.11Å; L484-F504 HydrophobicContact CD1-CE2 3.8Å; L484-F504 HydrophobicContact CD1-CG 3.81Å; L484-F504 HydrophobicContact CD1-CZ 4Å; L484-F504 HydrophobicContact CD2-CD2 4.06Å; L484-F504 HydrophobicContact CD2-CE2 3.41Å; L484-F504 VanDerWaalsContact CD2-CE2 3.41Å; L484-F504 HydrophobicContact CD2-CZ 3.71Å; L484-F504 HydrophobicContact CG-CE2 4.26Å; L484-F504 HydrophobicContact CG-CZ 4.42Å; L500-F504 WeakPolarHBondContact O-CD2 3.45Å; L500-F504 PolarHBondContact O-N 2.91Å; A501-F504 PolarHBondContact O-N 3.28Å; F504-T507 HydrophobicContact CD1-CG2 4.31Å; F504-T507 CarbonylContact O-C 3.59Å; F504-T507 WeakPolarHBondContact O-CA 3.43Å; F504-T507 WeakPolarHBondContact O-CB 3.33Å; F504-T507 PolarHBondContact O-N 3.48Å; F504-I508 HydrophobicContact CB-CG1 4.5Å; F504-I508 HydrophobicContact CD1-CG2 4.08Å; F504-I508 WeakPolarHBondContact O-CG1 3.42Å; F504-I508 PolarHBondContact O-N 2.73Å; F504-V532 HydrophobicContact CB-CG1 4.08Å; F504-V532 HydrophobicContact CB-CG2 4.49Å
505	G	98.2	Very high	96.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-48.3	-59.9	176.6	0	0	0	0	0	113.4	A501 T507 V509 G510	A501-G505 PolarHBondContact O-N 2.8Å; G505-T507 PolarHBondContact O-N 2.93Å; G505-T507 VanDerWaalsContact O-N 3.14Å; G505-V509 VanDerWaalsContact O-CB 3.24Å; G505-V509 WeakPolarHBondContact O-CB 3.45Å; G505-V509 PolarHBondContact O-N 2.98Å; G505-G510 PolarHBondContact O-N 2.88Å
506	P	97.1	Very high	96.4	Very high	62 Å²	62	42.7 Å²	42.7	40%	0.403	24%	0.241	S	C	.	.	I	π-helix	trans	-64.7	-14.2	174.6	-20.4	31.2	0	0	0	114.9
507	T	97.7	Very high	96.2	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.049	25%	0.253	C	S	.	.	I	π-helix	trans	-95.5	-35.2	-174.1	-58.7	0	0	0	0	113	K427 L430 R431 V503 F504 G505	K427-T507 HydrophobicContact CB-CG2 4.37Å; L430-T507 HydrophobicContact CB-CG2 3.98Å; R431-T507 HydrophobicContact CB-CG2 4.35Å; V503-T507 PolarHBondContact O-OG1 2.91Å; F504-T507 HydrophobicContact CD1-CG2 4.31Å; F504-T507 CarbonylContact O-C 3.59Å; F504-T507 WeakPolarHBondContact O-CA 3.43Å; F504-T507 WeakPolarHBondContact O-CB 3.33Å; F504-T507 PolarHBondContact O-N 3.48Å; G505-T507 PolarHBondContact O-N 2.93Å; G505-T507 VanDerWaalsContact O-N 3.14Å
508	I	98.3	Very high	96	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-119.1	-30.1	-176.1	68.1	173.7	0	0	0	114.3	L430 L437 L438 L477 L480 F504 V532	L430-I508 HydrophobicContact CD1-CG2 4.15Å; L437-I508 HydrophobicContact CB-CB 3.96Å; L437-I508 HydrophobicContact CB-CG2 4.24Å; L437-I508 HydrophobicContact CD2-CB 4.09Å; L437-I508 HydrophobicContact CD2-CG2 3.87Å; L437-I508 PolarHBondContact N-O 3.26Å; L438-I508 PolarHBondContact N-O 2.93Å; L477-I508 HydrophobicContact CD1-CD1 4.01Å; L480-I508 HydrophobicContact CD2-CD1 4.39Å; L480-I508 HydrophobicContact CD2-CG2 3.84Å; F504-I508 HydrophobicContact CB-CG1 4.5Å; F504-I508 HydrophobicContact CD1-CG2 4.08Å; F504-I508 WeakPolarHBondContact O-CG1 3.42Å; F504-I508 PolarHBondContact O-N 2.73Å; I508-V532 HydrophobicContact CD1-CG2 4.13Å; I508-V532 HydrophobicContact CG1-CG2 4.13Å
509	V	98.1	Very high	95.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.289	C	S	.	.	I	π-helix	trans	-84	-49.7	177.6	-169.7	0	0	0	0	109.4	P436 L438 N443 M447 G505 Q528 V531 V532	P436-V509 WeakPolarHBondContact CB-O 3.39Å; L438-V509 HydrophobicContact CD1-CB 4.21Å; L438-V509 HydrophobicContact CD1-CG1 4.2Å; L438-V509 HydrophobicContact CD1-CG2 3.82Å; N443-V509 PolarHBondContact ND2-O 3.42Å; M447-V509 HydrophobicContact CE-CG1 3.47Å; M447-V509 VanDerWaalsContact CE-CG1 3.47Å; M447-V509 HydrophobicContact SD-CG1 3.94Å; G505-V509 VanDerWaalsContact O-CB 3.24Å; G505-V509 WeakPolarHBondContact O-CB 3.45Å; G505-V509 PolarHBondContact O-N 2.98Å; V509-Q528 HydrophobicContact CB-CG 4.18Å; V509-Q528 HydrophobicContact CG1-CG 4.29Å; V509-V531 HydrophobicContact CG1-CB 4.43Å; V509-V531 HydrophobicContact CG1-CG1 4.33Å; V509-V531 HydrophobicContact CG1-CG2 4.34Å; V509-V531 HydrophobicContact CG2-CB 4.01Å; V509-V531 HydrophobicContact CG2-CG1 3.87Å; V509-V532 HydrophobicContact CG2-CG2 3.7Å
510	G	94.6	Very high	95.4	Very high	10 Å²	10	52.6 Å²	52.6	10%	0.103	29%	0.293	C	S	.	.			trans	58.5	-141.3	179.8	0	0	0	0	0	112.8	N443 G505 Q528	N443-G510 VanDerWaalsContact ND2-C 3.34Å; N443-G510 PolarHBondContact ND2-O 2.69Å; G505-G510 PolarHBondContact O-N 2.88Å; G510-Q528 PolarHBondContact O-NE2 3.11Å
511	H	96.1	Very high	95.2	Very high	39 Å²	39	55.8 Å²	55.8	18%	0.181	31%	0.309	C	S	.	.			trans	-124	159.2	-177.5	-59.1	-74.7	0	0	0	110.5	F440 V513 P516 D524 Q528	F440-H511 VanDerWaalsContact CD1-O 3.25Å; F440-H511 WeakPolarHBondContact CD1-O 3.47Å; H511-V513 PolarHBondContact O-N 2.91Å; H511-P516 HydrophobicContact CB-CB 4.13Å; H511-P516 HydrophobicContact CB-CG 3.9Å; H511-D524 IonicContact CE1-OD2 3.74Å; H511-D524 IonicContact CG-OD2 2.73Å; H511-D524 WeakPolarHBondContact ND1-CB 3.43Å; H511-D524 IonicContact ND1-OD2 3.17Å; H511-D524 PolarHBondContact ND1-OD2 2.84Å; H511-Q528 PolarHBondContact CE1-NE2 3.43Å; H511-Q528 PolarHBondContact NE2-NE2 3.44Å
512	A	94.4	Very high	94.9	Very high	45 Å²	45	60.7 Å²	60.7	37%	0.372	34%	0.335	S	S	.	.	S	Bend	trans	-70.4	-8.2	179.8	0	0	0	0	0	114.7	N443	N443-A512 HydrophobicContact CB-CB 4.29Å; N443-A512 PolarHBondContact OD1-N 2.86Å
513	V	94	Very high	94.6	Very high	74 Å²	74	59.5 Å²	59.5	45%	0.448	34%	0.335	S	S	.	.	S	Bend	trans	-141.3	157.2	177.7	-67.1	0	0	0	0	110.9	H511 N515 P516	H511-V513 PolarHBondContact O-N 2.91Å; V513-N515 PolarHBondContact O-N 2.85Å; V513-P516 HydrophobicContact CG2-CB 3.97Å
514	P	90.1	Very high	94.5	Very high	93 Å²	93	58.5 Å²	58.5	60%	0.604	33%	0.329	S	S	*	.	S	Bend	trans	-63.7	-39.2	-179.1	-21.9	31.1	0	0	0	114.4	F440 P516	F440-P514 HydrophobicContact CE1-CG 4.21Å; F440-P514 HydrophobicContact CE2-CG 3.89Å; F440-P514 HydrophobicContact CZ-CB 4.07Å; F440-P514 HydrophobicContact CZ-CG 3.61Å; P514-P516 WeakPolarHBondContact O-CD 3.2Å
515	N	90.6	Very high	94.3	Very high	152 Å²	152	61.9 Å²	61.9	81%	0.813	35%	0.35	S	S	*	.	S	Bend	trans	-122.2	78.7	-178.2	-66	-25.9	0	0	0	109.2	V513	V513-N515 PolarHBondContact O-N 2.85Å
516	P	92.3	Very high	94	Very high	25 Å²	25	69.3 Å²	69.3	16%	0.162	38%	0.382	C	S	.	.			trans	-72.1	152.9	178.8	30.8	-36.6	0	0	0	112.1	H511 V513 P514 T520 I521	H511-P516 HydrophobicContact CB-CB 4.13Å; H511-P516 HydrophobicContact CB-CG 3.9Å; V513-P516 HydrophobicContact CG2-CB 3.97Å; P514-P516 WeakPolarHBondContact O-CD 3.2Å; P516-T520 HydrophobicContact CB-CG2 4.3Å; P516-I521 HydrophobicContact CB-CG1 4.01Å; P516-I521 HydrophobicContact CG-CD1 3.99Å; P516-I521 HydrophobicContact CG-CG1 3.56Å
517	E	92.5	Very high	94	Very high	141 Å²	141	68.5 Å²	68.5	66%	0.659	37%	0.371	S	S	*	.			trans	-69.8	150.5	173.6	-65.7	-178.4	-176.1	0	0	111.3	M519 T520 I521	E517-M519 PolarHBondContact O-N 2.84Å; E517-M519 VanDerWaalsContact O-N 3.09Å; E517-T520 WeakPolarHBondContact O-CA 3.32Å; E517-T520 WeakPolarHBondContact O-CB 3.41Å; E517-T520 PolarHBondContact O-N 2.8Å; E517-I521 PolarHBondContact O-N 2.7Å
518	P	93.6	Very high	94.1	Very high	109 Å²	109	68.2 Å²	68.2	71%	0.708	37%	0.369	S	S	*	.	H	α-helix	trans	-55.1	-32.9	-177.4	-28.3	35.8	0	0	0	114.8	I521 L522	P518-I521 PolarHBondContact O-N 2.98Å; P518-L522 PolarHBondContact O-N 3.18Å; P518-L522 VanDerWaalsContact O-N 3.08Å
519	M	92	Very high	94.1	Very high	123 Å²	123	69.1 Å²	69.1	61%	0.606	38%	0.375	S	S	*	.	H	α-helix	trans	-69.5	-39.5	176.3	-164.4	67.7	71.3	0	0	111.9	E517 L522 Q523	E517-M519 PolarHBondContact O-N 2.84Å; E517-M519 VanDerWaalsContact O-N 3.09Å; M519-L522 PolarHBondContact O-N 3.32Å; M519-Q523 WeakPolarHBondContact O-CG 3.45Å; M519-Q523 PolarHBondContact O-N 3.34Å; M519-Q523 VanDerWaalsContact O-N 3.08Å
520	T	92.1	Very high	94.1	Very high	50 Å²	50	72.5 Å²	72.5	31%	0.307	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-43	173.6	-50.9	0	0	0	0	110.8	P516 E517 L522 Q523 D524	P516-T520 HydrophobicContact CB-CG2 4.3Å; E517-T520 WeakPolarHBondContact O-CA 3.32Å; E517-T520 WeakPolarHBondContact O-CB 3.41Å; E517-T520 PolarHBondContact O-N 2.8Å; T520-L522 VanDerWaalsContact C-N 3.32Å; T520-L522 PolarHBondContact O-N 3.18Å; T520-Q523 PolarHBondContact O-N 3.07Å; T520-D524 WeakPolarHBondContact O-CB 3.34Å; T520-D524 PolarHBondContact O-N 2.97Å
521	I	93.7	Very high	94.3	Very high	67 Å²	67	72 Å²	72	34%	0.344	39%	0.387	S	S	.	.	H	α-helix	trans	-57	-47.2	174.7	-60.5	172.2	0	0	0	110.6	P516 E517 P518 Q523 D524 T525	P516-I521 HydrophobicContact CB-CG1 4.01Å; P516-I521 HydrophobicContact CG-CD1 3.99Å; P516-I521 HydrophobicContact CG-CG1 3.56Å; E517-I521 PolarHBondContact O-N 2.7Å; P518-I521 PolarHBondContact O-N 2.98Å; I521-Q523 VanDerWaalsContact C-N 3.3Å; I521-Q523 PolarHBondContact O-N 2.89Å; I521-D524 PolarHBondContact O-N 3.45Å; I521-T525 VanDerWaalsContact O-CB 3.31Å; I521-T525 WeakPolarHBondContact O-CB 3.43Å; I521-T525 PolarHBondContact O-N 2.91Å; I521-T525 PolarHBondContact O-OG1 3.22Å
522	L	92.6	Very high	94.4	Very high	104 Å²	104	70.2 Å²	70.2	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-65	-31.1	-179.2	-177.4	62.5	0	0	0	113.4	P518 M519 T520	P518-L522 PolarHBondContact O-N 3.18Å; P518-L522 VanDerWaalsContact O-N 3.08Å; M519-L522 PolarHBondContact O-N 3.32Å; T520-L522 VanDerWaalsContact C-N 3.32Å; T520-L522 PolarHBondContact O-N 3.18Å
523	Q	92.6	Very high	94.6	Very high	114 Å²	114	70.9 Å²	70.9	53%	0.533	37%	0.374	S	S	.	.	H	α-helix	trans	-74.6	-57.7	173.4	-70.7	174.9	4.5	0	0	110.6	M519 T520 I521 T525 K526	M519-Q523 WeakPolarHBondContact O-CG 3.45Å; M519-Q523 PolarHBondContact O-N 3.34Å; M519-Q523 VanDerWaalsContact O-N 3.08Å; T520-Q523 PolarHBondContact O-N 3.07Å; I521-Q523 VanDerWaalsContact C-N 3.3Å; I521-Q523 PolarHBondContact O-N 2.89Å; Q523-T525 VanDerWaalsContact C-N 3.27Å; Q523-T525 PolarHBondContact O-N 2.91Å; Q523-K526 WeakPolarHBondContact O-CB 3.22Å; Q523-K526 PolarHBondContact O-N 3.3Å
524	D	94.6	Very high	94.8	Very high	12 Å²	12	69.5 Å²	69.5	6%	0.064	36%	0.36	C	S	.	.	H	α-helix	trans	-56	-39.6	-177.7	-73.6	-15.3	0	0	0	112.3	M447 H511 T520 I521 K526 R527 Q528	M447-D524 HydrophobicContact CE-CB 4.32Å; H511-D524 IonicContact CE1-OD2 3.74Å; H511-D524 IonicContact CG-OD2 2.73Å; H511-D524 WeakPolarHBondContact ND1-CB 3.43Å; H511-D524 IonicContact ND1-OD2 3.17Å; H511-D524 PolarHBondContact ND1-OD2 2.84Å; T520-D524 WeakPolarHBondContact O-CB 3.34Å; T520-D524 PolarHBondContact O-N 2.97Å; I521-D524 PolarHBondContact O-N 3.45Å; D524-K526 PolarHBondContact O-N 3.01Å; D524-R527 PolarHBondContact O-N 2.97Å; D524-Q528 HydrophobicContact CB-CG 4.5Å; D524-Q528 WeakPolarHBondContact O-CB 3.46Å; D524-Q528 WeakPolarHBondContact O-CG 3.49Å; D524-Q528 PolarHBondContact O-N 3.35Å
525	T	94.5	Very high	95.2	Very high	72 Å²	72	65 Å²	65	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-56.2	-24.2	179.3	-58.5	0	0	0	0	113.1	I521 Q523 P529	I521-T525 VanDerWaalsContact O-CB 3.31Å; I521-T525 WeakPolarHBondContact O-CB 3.43Å; I521-T525 PolarHBondContact O-N 2.91Å; I521-T525 PolarHBondContact O-OG1 3.22Å; Q523-T525 VanDerWaalsContact C-N 3.27Å; Q523-T525 PolarHBondContact O-N 2.91Å; T525-P529 WeakPolarHBondContact O-CD 3.48Å
526	K	93.8	Very high	95.6	Very high	155 Å²	155	57.9 Å²	57.9	67%	0.674	29%	0.293	S	S	*	.	H	α-helix	trans	-85.8	-30.7	175.3	-59.4	179.3	-176.4	-179.9	0	113.2	Q523 D524 P529	Q523-K526 WeakPolarHBondContact O-CB 3.22Å; Q523-K526 PolarHBondContact O-N 3.3Å; D524-K526 PolarHBondContact O-N 3.01Å; K526-P529 WeakPolarHBondContact O-CD 3.27Å
527	R	97	Very high	95.8	Very high	46 Å²	46	59.9 Å²	59.9	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-84.7	-37.8	-177.1	-48.6	176.8	83.2	-149	0.6	111.7	M447 D448 E451 D524 P529 M530 V531	M447-R527 HydrophobicContact CB-CB 4.41Å; M447-R527 VanDerWaalsContact CB-NH1 3.29Å; M447-R527 HydrophobicContact CE-CB 4.4Å; M447-R527 HydrophobicContact CG-CB 4.29Å; M447-R527 HydrophobicContact SD-CB 3.47Å; M447-R527 WeakPolarHBondContact SD-CB 3.48Å; D448-R527 IonicContact OD1-CZ 3.84Å; D448-R527 IonicContact OD1-NH1 3.74Å; D448-R527 PolarHBondContact OD1-NH1 3.15Å; D448-R527 IonicContact OD1-NH2 3.91Å; D448-R527 PolarHBondContact OD1-NH2 3.3Å; E451-R527 VanDerWaalsContact CD-NE 3.33Å; E451-R527 VanDerWaalsContact CD-NH2 3.34Å; E451-R527 WeakPolarHBondContact OE1-CG 3.44Å; E451-R527 IonicContact OE1-CZ 3.96Å; E451-R527 IonicContact OE1-NE 3.58Å; E451-R527 PolarHBondContact OE1-NE 2.86Å; E451-R527 IonicContact OE1-NH2 3.68Å; E451-R527 IonicContact OE2-CZ 3.71Å; E451-R527 IonicContact OE2-NE 2.85Å; E451-R527 PolarHBondContact OE2-NE 3.25Å; E451-R527 IonicContact OE2-NH2 2.79Å; E451-R527 PolarHBondContact OE2-NH2 3.03Å; D524-R527 PolarHBondContact O-N 2.97Å; R527-P529 VanDerWaalsContact C-CD 3.47Å; R527-M530 WeakPolarHBondContact O-CB 3.42Å; R527-M530 PolarHBondContact O-N 3.44Å; R527-V531 PolarHBondContact O-N 3.02Å
528	Q	98.2	Very high	96	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-48.4	-42.3	-179.2	-80.2	171.4	0.8	0	0	114.7	M447 V509 G510 H511 D524	M447-Q528 HydrophobicContact CE-CG 3.67Å; V509-Q528 HydrophobicContact CB-CG 4.18Å; V509-Q528 HydrophobicContact CG1-CG 4.29Å; G510-Q528 PolarHBondContact O-NE2 3.11Å; H511-Q528 PolarHBondContact CE1-NE2 3.43Å; H511-Q528 PolarHBondContact NE2-NE2 3.44Å; D524-Q528 HydrophobicContact CB-CG 4.5Å; D524-Q528 WeakPolarHBondContact O-CB 3.46Å; D524-Q528 WeakPolarHBondContact O-CG 3.49Å; D524-Q528 PolarHBondContact O-N 3.35Å
529	P	98.5	Very high	96.2	Very high	20 Å²	20	51 Å²	51	13%	0.13	26%	0.262	C	S	.	.	H	α-helix	trans	-67.3	-41.8	177.2	-21	34.7	0	0	0	112.5	A501 R502 T525 K526 R527 V531 V532 E533	A501-P529 HydrophobicContact CB-CB 4.3Å; A501-P529 WeakPolarHBondContact CB-O 3.38Å; R502-P529 HydrophobicContact CG-CB 4.45Å; R502-P529 HydrophobicContact CG-CG 4.47Å; T525-P529 WeakPolarHBondContact O-CD 3.48Å; K526-P529 WeakPolarHBondContact O-CD 3.27Å; R527-P529 VanDerWaalsContact C-CD 3.47Å; P529-V531 VanDerWaalsContact C-N 3.26Å; P529-V531 PolarHBondContact O-N 3.24Å; P529-V532 CarbonylContact O-C 3.59Å; P529-V532 WeakPolarHBondContact O-CA 3.32Å; P529-V532 PolarHBondContact O-N 2.98Å; P529-E533 WeakPolarHBondContact O-CG 3.43Å; P529-E533 PolarHBondContact O-N 3Å
530	M	98.1	Very high	96.3	Very high	71 Å²	71	48.4 Å²	48.4	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-57.5	-41	-177.9	-62.9	173.2	61.6	0	0	111.4	A450 E451 R527 V532 E533 R534	A450-M530 HydrophobicContact CB-CB 4.34Å; E451-M530 HydrophobicContact CG-CE 3.98Å; E451-M530 HydrophobicContact CG-SD 4.44Å; R527-M530 WeakPolarHBondContact O-CB 3.42Å; R527-M530 PolarHBondContact O-N 3.44Å; M530-V532 VanDerWaalsContact C-N 3.3Å; M530-V532 PolarHBondContact O-N 3.18Å; M530-E533 PolarHBondContact O-N 3Å; M530-R534 VanDerWaalsContact O-CG 3.28Å; M530-R534 WeakPolarHBondContact O-CG 3.35Å; M530-R534 PolarHBondContact O-N 3.32Å
531	V	98.7	Very high	96.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.5	-43.8	173.5	178.5	0	0	0	0	111.7	L438 F446 M447 A450 V509 R527 P529 R534 L535	L438-V531 HydrophobicContact CD1-CG1 3.75Å; F446-V531 HydrophobicContact CB-CG1 3.84Å; F446-V531 HydrophobicContact CB-CG2 4.34Å; F446-V531 HydrophobicContact CD1-CG1 4.16Å; F446-V531 HydrophobicContact CG-CG1 4.27Å; M447-V531 HydrophobicContact CG-CG2 4.4Å; M447-V531 HydrophobicContact SD-CG2 3.56Å; M447-V531 VanDerWaalsContact SD-CG2 3.56Å; A450-V531 HydrophobicContact CB-CB 4.43Å; A450-V531 HydrophobicContact CB-CG2 3.87Å; V509-V531 HydrophobicContact CG1-CB 4.43Å; V509-V531 HydrophobicContact CG1-CG1 4.33Å; V509-V531 HydrophobicContact CG1-CG2 4.34Å; V509-V531 HydrophobicContact CG2-CB 4.01Å; V509-V531 HydrophobicContact CG2-CG1 3.87Å; R527-V531 PolarHBondContact O-N 3.02Å; P529-V531 VanDerWaalsContact C-N 3.26Å; P529-V531 PolarHBondContact O-N 3.24Å; V531-R534 PolarHBondContact O-N 3.07Å; V531-L535 HydrophobicContact CG1-CD1 4.04Å; V531-L535 VanDerWaalsContact O-CG 3.23Å; V531-L535 WeakPolarHBondContact O-CG 3.37Å; V531-L535 PolarHBondContact O-N 2.99Å
532	V	98.7	Very high	96.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-76.4	-33.3	-178.4	-175.1	0	0	0	0	111.9	A501 F504 I508 V509 P529 M530 L535 L536	A501-V532 HydrophobicContact CB-CB 3.85Å; A501-V532 HydrophobicContact CB-CG1 4.04Å; F504-V532 HydrophobicContact CB-CG1 4.08Å; F504-V532 HydrophobicContact CB-CG2 4.49Å; I508-V532 HydrophobicContact CD1-CG2 4.13Å; I508-V532 HydrophobicContact CG1-CG2 4.13Å; V509-V532 HydrophobicContact CG2-CG2 3.7Å; P529-V532 CarbonylContact O-C 3.59Å; P529-V532 WeakPolarHBondContact O-CA 3.32Å; P529-V532 PolarHBondContact O-N 2.98Å; M530-V532 VanDerWaalsContact C-N 3.3Å; M530-V532 PolarHBondContact O-N 3.18Å; V532-L535 PolarHBondContact O-N 2.95Å; V532-L536 HydrophobicContact CG1-CD1 3.89Å; V532-L536 HydrophobicContact CG1-CG 4.36Å; V532-L536 VanDerWaalsContact O-CB 3.31Å; V532-L536 WeakPolarHBondContact O-CB 3.46Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.42Å; V532-L536 PolarHBondContact O-N 3.5Å
533	E	98.4	Very high	96.8	Very high	60 Å²	60	45.5 Å²	45.5	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-61.6	-43.7	170.6	-65.6	177.8	158.2	0	0	110.8	I497 S498 A501 P529 M530 L536 S537	I497-E533 HydrophobicContact CG2-CB 4.35Å; I497-E533 HydrophobicContact CG2-CG 4.25Å; S498-E533 VanDerWaalsContact CA-OE1 3.25Å; S498-E533 WeakPolarHBondContact CA-OE1 3.3Å; S498-E533 WeakPolarHBondContact CB-OE1 3.29Å; S498-E533 PolarHBondContact OG-OE1 3.28Å; A501-E533 HydrophobicContact CB-CG 3.41Å; A501-E533 VanDerWaalsContact CB-CG 3.41Å; P529-E533 WeakPolarHBondContact O-CG 3.43Å; P529-E533 PolarHBondContact O-N 3Å; M530-E533 PolarHBondContact O-N 3Å; E533-L536 PolarHBondContact O-N 3.1Å; E533-S537 PolarHBondContact O-N 3.25Å
534	R	98.1	Very high	96.9	Very high	44 Å²	44	41.5 Å²	41.5	17%	0.166	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-44.3	172.9	-67.1	-70.2	-170.9	-149.9	11.9	112.5	A450 V452 E455 S458 M462 M530 V531 L536 S537 L538	A450-R534 HydrophobicContact CB-CG 3.88Å; A450-R534 PolarHBondContact O-NE 3Å; V452-R534 PolarHBondContact O-NH2 3.45Å; E455-R534 IonicContact OE1-CZ 3.81Å; E455-R534 VanDerWaalsContact OE1-CZ 3.23Å; E455-R534 IonicContact OE1-NH1 3.57Å; E455-R534 PolarHBondContact OE1-NH1 3.37Å; E455-R534 IonicContact OE1-NH2 2.84Å; E455-R534 PolarHBondContact OE1-NH2 3.23Å; E455-R534 IonicContact OE2-CZ 3.67Å; E455-R534 IonicContact OE2-NH1 2.86Å; E455-R534 PolarHBondContact OE2-NH1 3Å; E455-R534 IonicContact OE2-NH2 3.72Å; S458-R534 PolarHBondContact OG-NE 2.83Å; M462-R534 HydrophobicContact CE-CB 3.9Å; M462-R534 HydrophobicContact CG-CB 4.26Å; M462-R534 HydrophobicContact SD-CB 4.29Å; M530-R534 VanDerWaalsContact O-CG 3.28Å; M530-R534 WeakPolarHBondContact O-CG 3.35Å; M530-R534 PolarHBondContact O-N 3.32Å; V531-R534 PolarHBondContact O-N 3.07Å; R534-L536 VanDerWaalsContact C-N 3.28Å; R534-L536 PolarHBondContact O-N 2.93Å; R534-S537 PolarHBondContact O-N 2.89Å; R534-S537 PolarHBondContact O-OG 3.19Å; R534-L538 PolarHBondContact O-N 2.87Å
535	L	98.6	Very high	96.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-37.8	175.7	-71.4	166.2	0	0	0	112.2	L438 F446 M462 I466 L477 I481 V531 V532 W543	L438-L535 HydrophobicContact CD1-CD1 4.09Å; L438-L535 HydrophobicContact CD2-CD1 4.46Å; F446-L535 HydrophobicContact CE1-CD2 4.3Å; M462-L535 HydrophobicContact CE-CD2 3.59Å; M462-L535 HydrophobicContact CE-CG 3.62Å; I466-L535 HydrophobicContact CD1-CD2 3.81Å; I466-L535 HydrophobicContact CG1-CD2 4.06Å; L477-L535 HydrophobicContact CD1-CD1 4.33Å; L477-L535 HydrophobicContact CD2-CD2 4.18Å; I481-L535 HydrophobicContact CD1-CB 3.78Å; I481-L535 HydrophobicContact CG1-CB 4.39Å; V531-L535 HydrophobicContact CG1-CD1 4.04Å; V531-L535 VanDerWaalsContact O-CG 3.23Å; V531-L535 WeakPolarHBondContact O-CG 3.37Å; V531-L535 PolarHBondContact O-N 2.99Å; V532-L535 PolarHBondContact O-N 2.95Å; L535-W543 HydrophobicContact CB-CZ2 4.34Å; L535-W543 HydrophobicContact CD2-CH2 3.73Å; L535-W543 HydrophobicContact CD2-CZ2 3.7Å; L535-W543 PolarHBondContact O-NE1 2.91Å
536	L	98.3	Very high	96.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-77.1	-18.8	177.6	-74.3	167.1	0	0	0	113.7	I481 L484 K485 I497 L500 V532 E533 R534	I481-L536 HydrophobicContact CD1-CD2 4.18Å; I481-L536 HydrophobicContact CD1-CG 4.25Å; I481-L536 HydrophobicContact CG2-CD2 4.21Å; L484-L536 HydrophobicContact CB-CD2 3.78Å; K485-L536 WeakPolarHBondContact CE-O 3.38Å; K485-L536 HydrophobicContact CG-CD2 4.11Å; K485-L536 PolarHBondContact NZ-O 3.04Å; I497-L536 HydrophobicContact CB-CD1 4.39Å; I497-L536 HydrophobicContact CD1-CB 4.41Å; I497-L536 HydrophobicContact CG1-CB 4.27Å; I497-L536 HydrophobicContact CG1-CD1 4.5Å; I497-L536 HydrophobicContact CG2-CB 3.77Å; I497-L536 HydrophobicContact CG2-CD1 3.89Å; I497-L536 HydrophobicContact CG2-CG 4.48Å; L500-L536 HydrophobicContact CB-CD1 4.38Å; V532-L536 HydrophobicContact CG1-CD1 3.89Å; V532-L536 HydrophobicContact CG1-CG 4.36Å; V532-L536 VanDerWaalsContact O-CB 3.31Å; V532-L536 WeakPolarHBondContact O-CB 3.46Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.42Å; V532-L536 PolarHBondContact O-N 3.5Å; E533-L536 PolarHBondContact O-N 3.1Å; R534-L536 VanDerWaalsContact C-N 3.28Å; R534-L536 PolarHBondContact O-N 2.93Å
537	S	96.9	Very high	96.3	Very high	67 Å²	67	37.9 Å²	37.9	47%	0.469	20%	0.199	S	C	.	.	H	α-helix	trans	-79.1	-30	174.4	72.9	0	0	0	0	113.1	E533 R534	E533-S537 PolarHBondContact O-N 3.25Å; R534-S537 PolarHBondContact O-N 2.89Å; R534-S537 PolarHBondContact O-OG 3.19Å
538	L	97.4	Very high	95	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	22%	0.222	C	C	.	.	S	Bend	trans	-56.2	147.6	-180	-60	-176.6	0	0	0	112.9	V459 Y463 I466 K485 R534 Y542 W543	V459-L538 HydrophobicContact CG1-CD2 3.95Å; V459-L538 HydrophobicContact CG2-CD2 4.28Å; Y463-L538 HydrophobicContact CD1-CD1 4Å; Y463-L538 HydrophobicContact CD1-CD2 4.34Å; Y463-L538 HydrophobicContact CE1-CB 4.43Å; Y463-L538 HydrophobicContact CE1-CD1 3.86Å; Y463-L538 HydrophobicContact CE1-CD2 3.76Å; Y463-L538 HydrophobicContact CE1-CG 4.22Å; I466-L538 HydrophobicContact CD1-CD1 3.38Å; K485-L538 WeakPolarHBondContact CE-O 3.4Å; K485-L538 PolarHBondContact NZ-O 3.47Å; R534-L538 PolarHBondContact O-N 2.87Å; L538-Y542 HydrophobicContact CB-CD1 4.49Å; L538-Y542 HydrophobicContact CD1-CD1 4.29Å; L538-Y542 HydrophobicContact CD1-CE1 4.14Å; L538-W543 HydrophobicContact CD1-CZ2 3.98Å
539	P	97.1	Very high	92.5	Very high	61 Å²	61	45.7 Å²	45.7	40%	0.396	25%	0.252	S	S	.	.			trans	-58.4	151.2	-174.1	-26.6	36	0	0	0	115.2	Y463 D541 Y542 W543	Y463-P539 VanDerWaalsContact OH-CD 3.27Å; Y463-P539 WeakPolarHBondContact OH-CD 3.45Å; P539-D541 VanDerWaalsContact C-N 3.3Å; P539-D541 PolarHBondContact O-N 3Å; P539-Y542 PolarHBondContact O-N 3.49Å; P539-W543 VanDerWaalsContact O-CD1 3.31Å; P539-W543 PolarHBondContact O-N 2.9Å
540	V	95.4	Very high	89.7	Confident	69 Å²	69	51.4 Å²	51.4	42%	0.418	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-39.3	175.6	172.9	0	0	0	0	111.3	L482 K485 Y542 W543 S544	L482-V540 HydrophobicContact CD2-CG1 3.84Å; K485-V540 HydrophobicContact CD-CG2 3.86Å; V540-Y542 PolarHBondContact O-N 3.49Å; V540-W543 PolarHBondContact O-N 3.27Å; V540-S544 WeakPolarHBondContact O-CB 3.49Å; V540-S544 PolarHBondContact O-N 3.29Å; V540-S544 PolarHBondContact O-OG 3.19Å
541	D	95.3	Very high	86.8	Confident	127 Å²	127	55.8 Å²	55.8	68%	0.679	30%	0.302	S	S	*	.	H	α-helix	trans	-67.1	-38.9	-177.4	-51.3	-50.8	0	0	0	112	P539 W543 S544 Q545	P539-D541 VanDerWaalsContact C-N 3.3Å; P539-D541 PolarHBondContact O-N 3Å; D541-W543 VanDerWaalsContact C-N 3.29Å; D541-W543 PolarHBondContact O-N 3.05Å; D541-S544 PolarHBondContact O-N 3.42Å; D541-S544 VanDerWaalsContact O-N 3.16Å; D541-Q545 PolarHBondContact O-N 3.45Å
542	Y	96.3	Very high	83.6	Confident	32 Å²	32	62.3 Å²	62.3	13%	0.125	34%	0.341	C	S	.	.	H	α-helix	trans	-59	-38.6	175	172.3	-94.7	0	0	0	112.2	Y463 I466 L538 P539 V540 Q545 Y546	Y463-Y542 HydrophobicContact CD1-CD1 4.19Å; Y463-Y542 AromaticContact CD1-CD2 3.79Å; Y463-Y542 HydrophobicContact CD1-CD2 3.79Å; Y463-Y542 AromaticContact CD1-CE1 3.84Å; Y463-Y542 HydrophobicContact CD1-CE1 3.84Å; Y463-Y542 AromaticContact CD1-CE2 3.41Å; Y463-Y542 HydrophobicContact CD1-CE2 3.41Å; Y463-Y542 VanDerWaalsContact CD1-CE2 3.41Å; Y463-Y542 HydrophobicContact CD1-CG 4.17Å; Y463-Y542 AromaticContact CD1-CZ 3.44Å; Y463-Y542 VanDerWaalsContact CD1-CZ 3.44Å; Y463-Y542 AromaticContact CE1-CD1 3.79Å; Y463-Y542 HydrophobicContact CE1-CD1 3.79Å; Y463-Y542 AromaticContact CE1-CD2 3.49Å; Y463-Y542 HydrophobicContact CE1-CD2 3.49Å; Y463-Y542 VanDerWaalsContact CE1-CD2 3.49Å; Y463-Y542 AromaticContact CE1-CE1 3.94Å; Y463-Y542 HydrophobicContact CE1-CE1 3.94Å; Y463-Y542 AromaticContact CE1-CE2 3.65Å; Y463-Y542 HydrophobicContact CE1-CE2 3.65Å; Y463-Y542 AromaticContact CE1-CG 3.57Å; Y463-Y542 HydrophobicContact CE1-CG 3.57Å; Y463-Y542 AromaticContact CE1-CZ 3.88Å; Y463-Y542 HydrophobicContact CG-CE2 4.35Å; I466-Y542 WeakPolarHBondContact CB-OH 3.42Å; I466-Y542 HydrophobicContact CD1-CE1 4.06Å; I466-Y542 HydrophobicContact CG2-CE1 4.27Å; I466-Y542 VanDerWaalsContact CG2-OH 3.23Å; I466-Y542 WeakPolarHBondContact CG2-OH 3.48Å; L538-Y542 HydrophobicContact CB-CD1 4.49Å; L538-Y542 HydrophobicContact CD1-CD1 4.29Å; L538-Y542 HydrophobicContact CD1-CE1 4.14Å; P539-Y542 PolarHBondContact O-N 3.49Å; V540-Y542 PolarHBondContact O-N 3.49Å; Y542-Q545 VanDerWaalsContact O-CG 3.32Å; Y542-Q545 WeakPolarHBondContact O-CG 3.36Å; Y542-Q545 PolarHBondContact O-NE2 3.04Å; Y542-Y546 AromaticContact CE1-CE2 3.95Å; Y542-Y546 HydrophobicContact CE1-CE2 3.95Å; Y542-Y546 HydrophobicContact CE2-CE2 4.18Å; Y542-Y546 AromaticContact CZ-CE2 3.74Å; Y542-Y546 WeakPolarHBondContact O-CD2 3.41Å; Y542-Y546 WeakPolarHBondContact O-CE2 3.49Å; Y542-Y546 PolarHBondContact OH-OH 2.96Å
543	W	96.8	Very high	80.1	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-78.9	-34.3	175.6	-68	115.7	0	0	0	112.5	I466 L477 A478 I481 L482 L535 L538 P539 V540 D541 Q545 Y546	I466-W543 HydrophobicContact CD1-CH2 3.63Å; I466-W543 HydrophobicContact CD1-CZ2 3.94Å; I466-W543 HydrophobicContact CD1-CZ3 4.47Å; I466-W543 HydrophobicContact CG1-CH2 4.06Å; I466-W543 HydrophobicContact CG2-CH2 3.98Å; I466-W543 HydrophobicContact CG2-CZ3 3.85Å; L477-W543 HydrophobicContact CD2-CH2 3.75Å; L477-W543 HydrophobicContact CD2-CZ3 4.09Å; L477-W543 HydrophobicContact CG-CH2 3.95Å; L477-W543 HydrophobicContact CG-CZ3 4.08Å; A478-W543 VanDerWaalsContact CA-CE3 3.45Å; A478-W543 HydrophobicContact CB-CB 4.48Å; A478-W543 HydrophobicContact CB-CE3 3.6Å; A478-W543 HydrophobicContact CB-CZ3 4.22Å; I481-W543 HydrophobicContact CB-CD2 4.28Å; I481-W543 HydrophobicContact CB-CG 4.48Å; I481-W543 HydrophobicContact CB-CZ2 4.4Å; I481-W543 HydrophobicContact CG1-CH2 4.47Å; I481-W543 HydrophobicContact CG1-CZ2 4.13Å; I481-W543 HydrophobicContact CG2-CD2 4.17Å; I481-W543 HydrophobicContact CG2-CG 4.12Å; I481-W543 HydrophobicContact CG2-CZ2 4.19Å; I481-W543 VanDerWaalsContact CG2-NE1 3.31Å; L482-W543 HydrophobicContact CD1-CB 4.24Å; L482-W543 HydrophobicContact CD2-CB 3.85Å; L482-W543 HydrophobicContact CG-CB 3.79Å; L535-W543 HydrophobicContact CB-CZ2 4.34Å; L535-W543 HydrophobicContact CD2-CH2 3.73Å; L535-W543 HydrophobicContact CD2-CZ2 3.7Å; L535-W543 PolarHBondContact O-NE1 2.91Å; L538-W543 HydrophobicContact CD1-CZ2 3.98Å; P539-W543 VanDerWaalsContact O-CD1 3.31Å; P539-W543 PolarHBondContact O-N 2.9Å; V540-W543 PolarHBondContact O-N 3.27Å; D541-W543 VanDerWaalsContact C-N 3.29Å; D541-W543 PolarHBondContact O-N 3.05Å; W543-Q545 VanDerWaalsContact C-N 3.28Å; W543-Q545 PolarHBondContact O-N 3.32Å; W543-Y546 HydrophobicContact CE3-CD2 4.29Å; W543-Y546 PolarHBondContact O-N 3.49Å
544	S	93.9	Very high	77	Confident	31 Å²	31	73.4 Å²	73.4	22%	0.217	40%	0.403	C	S	.	.	H	α-helix	trans	-61.9	-33.3	-178.5	-61.5	0	0	0	0	112.9	V540 D541 Y546 V547 M548	V540-S544 WeakPolarHBondContact O-CB 3.49Å; V540-S544 PolarHBondContact O-N 3.29Å; V540-S544 PolarHBondContact O-OG 3.19Å; D541-S544 PolarHBondContact O-N 3.42Å; D541-S544 VanDerWaalsContact O-N 3.16Å; S544-Y546 PolarHBondContact O-N 3.06Å; S544-Y546 VanDerWaalsContact O-N 3.17Å; S544-V547 PolarHBondContact O-N 3.28Å; S544-V547 VanDerWaalsContact O-N 3.1Å; S544-M548 WeakPolarHBondContact O-CB 3.44Å; S544-M548 PolarHBondContact O-N 3.27Å
545	Q	92.5	Very high	73.6	Confident	102 Å²	102	79.1 Å²	79.1	48%	0.477	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28	178.7	84.4	-168.4	-53.5	0	0	113.8	D541 Y542 W543	D541-Q545 PolarHBondContact O-N 3.45Å; Y542-Q545 VanDerWaalsContact O-CG 3.32Å; Y542-Q545 WeakPolarHBondContact O-CG 3.36Å; Y542-Q545 PolarHBondContact O-NE2 3.04Å; W543-Q545 VanDerWaalsContact C-N 3.28Å; W543-Q545 PolarHBondContact O-N 3.32Å
546	Y	91.2	Very high	70.8	Confident	44 Å²	44	86.5 Å²	86.5	17%	0.173	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.4	-179.4	-58.7	-61.1	0	0	0	113.6	R474 A478 Y542 W543 S544	R474-Y546 HydrophobicContact CG-CD1 4.48Å; R474-Y546 HydrophobicContact CG-CD2 4.5Å; R474-Y546 HydrophobicContact CG-CG 4.47Å; A478-Y546 HydrophobicContact CB-CD2 4.11Å; A478-Y546 HydrophobicContact CB-CG 4.39Å; Y542-Y546 AromaticContact CE1-CE2 3.95Å; Y542-Y546 HydrophobicContact CE1-CE2 3.95Å; Y542-Y546 HydrophobicContact CE2-CE2 4.18Å; Y542-Y546 AromaticContact CZ-CE2 3.74Å; Y542-Y546 WeakPolarHBondContact O-CD2 3.41Å; Y542-Y546 WeakPolarHBondContact O-CE2 3.49Å; Y542-Y546 PolarHBondContact OH-OH 2.96Å; W543-Y546 HydrophobicContact CE3-CD2 4.29Å; W543-Y546 PolarHBondContact O-N 3.49Å; S544-Y546 PolarHBondContact O-N 3.06Å; S544-Y546 VanDerWaalsContact O-N 3.17Å
547	V	85.9	Confident	67.6	Low	17 Å²	17	93.8 Å²	93.8	10%	0.103	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-31.1	-178.1	-169.1	0	0	0	0	111.6	I366 A478 F479 L482 S544	I366-V547 HydrophobicContact CD1-CG1 4.21Å; A478-V547 HydrophobicContact CB-CG2 3.89Å; F479-V547 HydrophobicContact CB-CG2 4.16Å; F479-V547 HydrophobicContact CD2-CG1 3.99Å; L482-V547 HydrophobicContact CD1-CB 4.44Å; L482-V547 HydrophobicContact CD1-CG2 3.87Å; S544-V547 PolarHBondContact O-N 3.28Å; S544-V547 VanDerWaalsContact O-N 3.1Å
548	M	70	Confident	64.5	Low	134 Å²	134	98.3 Å²	98.3	66%	0.66	53%	0.528	S	S	*	.	S	Bend	trans	-100.8	18.3	-174.7	-57.9	-72.1	98	0	0	113.9	S544 E550	S544-M548 WeakPolarHBondContact O-CB 3.44Å; S544-M548 PolarHBondContact O-N 3.27Å; M548-E550 PolarHBondContact O-N 2.92Å
549	A	45.8	Very low	61.4	Low	76 Å²	76	106.9 Å²	106.9	63%	0.628	57%	0.573	S	S	*	*			trans	-73.8	80.5	-169.8	0	0	0	0	0	114.6
550	E	39.3	Very low	58.3	Low	140 Å²	140	110.1 Å²	110.1	65%	0.654	59%	0.586	S	S	*	*			trans	-76.2	131.2	154	-75.3	-169.7	161.7	0	0	110.3	M548 V552	M548-E550 PolarHBondContact O-N 2.92Å; E550-V552 PolarHBondContact O-N 2.95Å; E550-V552 VanDerWaalsContact O-N 3.11Å
551	N	37.9	Very low	55.5	Low	164 Å²	164	114.1 Å²	114.1	88%	0.877	60%	0.603	S	S	*	*			trans	-14.3	94.2	175.6	-63.6	-47.1	0	0	0	118.2
552	V	30.8	Very low	52.3	Low	136 Å²	136	116.9 Å²	116.9	82%	0.824	61%	0.612	S	S	*	*			trans	-112.1	105.5	149.6	-178.8	0	0	0	0	107.8	E550	E550-V552 PolarHBondContact O-N 2.95Å; E550-V552 VanDerWaalsContact O-N 3.11Å
553	Q	26.1	Very low	49	Very low	174 Å²	174	122.7 Å²	122.7	81%	0.813	65%	0.646	S	S	*	*			trans	-68.2	127.5	169.9	-70.1	-179.5	-73.4	0	0	108.9	N555	Q553-N555 PolarHBondContact O-N 3.11Å
554	P	32.6	Very low	45.9	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	68%	0.678	S	S	*	*			trans	-73.9	100.8	176	29.4	-33	0	0	0	109.7	L556	P554-L556 PolarHBondContact O-N 2.68Å
555	N	27.2	Very low	42.7	Very low	165 Å²	165	132.5 Å²	132.5	88%	0.882	71%	0.707	S	S	*	*			trans	-70.8	79.9	162.7	-103.4	-8.9	0	0	0	109	Q553 N557	Q553-N555 PolarHBondContact O-N 3.11Å; N555-N557 VanDerWaalsContact C-N 3.3Å; N555-N557 PolarHBondContact O-N 3.24Å
556	L	39.5	Very low	39.5	Very low	155 Å²	155	134 Å²	134	81%	0.812	73%	0.727	S	S	*	*			trans	-64.7	85.5	170.7	178.9	73.3	0	0	0	109.4	P554	P554-L556 PolarHBondContact O-N 2.68Å
557	N	31.7	Very low	36.5	Very low	154 Å²	154	143 Å²	143	82%	0.824	76%	0.763	S	S	*	*			trans	-170.4	60	165.1	-97.8	-24.8	0	0	0	114	N555	N555-N557 VanDerWaalsContact C-N 3.3Å; N555-N557 PolarHBondContact O-N 3.24Å
558	H	31	Very low	33.7	Very low	161 Å²	161	146.9 Å²	146.9	75%	0.745	80%	0.796	S	S	*	*				-175.1	116.8	128.7	-108.9	-36.7	0	0	0	111.3	I560	H558-I560 VanDerWaalsContact CE1-CD1 3.45Å; H558-I560 WeakPolarHBondContact CE1-CD1 3.5Å
559	L	33.4	Very low	31.6	Very low	183 Å²	183	146.7 Å²	146.7	96%	0.958	80%	0.803	S	S	*	*			trans	-120.8	100.6	151	-78	174.4	0	0	0	106.6
560	I	31.9	Very low	31.4	Very low	130 Å²	130	148.3 Å²	148.3	67%	0.667	81%	0.806	S	S	*	*			trans	-114.1	129.9	161.6	-68.3	-179.4	0	0	0	105.9	H558	H558-I560 VanDerWaalsContact CE1-CD1 3.45Å; H558-I560 WeakPolarHBondContact CE1-CD1 3.5Å
561	I	35.7	Very low	30.7	Very low	152 Å²	152	149.7 Å²	149.7	78%	0.779	81%	0.813	S	S	*	*			trans	-79.6	131.1	176.9	-60.3	160.4	0	0	0	107.6
562	E	28.3	Very low	30.3	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	82%	0.816	S	S	*	*			trans	-152.8	163.9	152	-126.1	159.4	-138.9	0	0	112.7
563	N	27.7	Very low	30.2	Very low	155 Å²	155	155.5 Å²	155.5	83%	0.829	82%	0.817	S	S	*	*			trans	-97	174.1	-156.1	-86.6	-40.7	0	0	0	114.9
564	A	30.9	Very low	30.3	Very low	82 Å²	82	153.2 Å²	153.2	68%	0.678	82%	0.821	S	S	*	*			trans	-68.4	171.5	-179.3	0	0	0	0	0	115.1
565	N	27.1	Very low	30.7	Very low	154 Å²	154	154.3 Å²	154.3	82%	0.824	82%	0.818	S	S	*	*			trans	90.2	109.2	175.3	-52.8	-41.7	0	0	0	116.7
566	C	25.9	Very low	30.8	Very low	133 Å²	133	154.7 Å²	154.7	90%	0.899	82%	0.82	S	S	*	*				-173	165.2	124.2	-94.2	0	0	0	0	111
567	Y	28.5	Very low	30.7	Very low	235 Å²	235	150.5 Å²	150.5	92%	0.922	81%	0.814	S	S	*	*			trans	-107.2	167.9	-172.6	-82	-101.9	0	0	0	113.5
568	A	26.5	Very low	31.1	Very low	97 Å²	97	149.1 Å²	149.1	80%	0.802	81%	0.813	S	S	*	*			trans	91	158.5	156.4	0	0	0	0	0	119.8
569	T	25.3	Very low	31	Very low	131 Å²	131	149 Å²	149	80%	0.804	82%	0.817	S	S	*	*			trans	-138.9	178.7	-167.7	52.7	0	0	0	0	108.9
570	P	41.8	Very low	30.9	Very low	109 Å²	109	147 Å²	147	71%	0.708	81%	0.813	S	S	*	*			cis	-128	-154.5	-26.1	25.1	-0.4	0	0	0	111.7
571	E	25.4	Very low	30.9	Very low	169 Å²	169	147 Å²	147	79%	0.79	82%	0.819	S	S	*	*			trans	81.3	117	160.5	-56.9	-163.7	169	0	0	120.8
572	R	28	Very low	31.5	Very low	252 Å²	252	144.7 Å²	144.7	95%	0.951	81%	0.814	S	S	*	*				-159.3	143.7	108.4	-104.2	171	-171.9	-158.5	0.5	111.2
573	M	29.1	Very low	31.4	Very low	171 Å²	171	144.1 Å²	144.1	84%	0.842	81%	0.811	S	S	*	*			trans	-87.8	152.9	-177.8	-62.4	-178.8	-177.8	0	0	112.2
574	S	29.4	Very low	31.5	Very low	126 Å²	126	144.3 Å²	144.3	88%	0.881	81%	0.807	S	S	*	*			trans	-76.4	150.8	163.3	-166	0	0	0	0	110.5
575	I	39.4	Very low	31.3	Very low	142 Å²	142	147.3 Å²	147.3	73%	0.728	81%	0.807	S	S	*	*			trans	-114.9	143.2	-167.9	-71.2	169	0	0	0	110.4
576	L	30	Very low	31.3	Very low	173 Å²	173	146 Å²	146	91%	0.906	80%	0.799	S	S	*	*			trans	82.6	111.1	-176.4	-51.7	-174	0	0	0	117.6
577	G	37.7	Very low	31.4	Very low	67 Å²	67	145.7 Å²	145.7	69%	0.691	79%	0.788	S	S	*	*			trans	-147.2	164.7	143.3	0	0	0	0	0	108.9
578	P	40.8	Very low	31.4	Very low	124 Å²	124	144.3 Å²	144.3	81%	0.805	79%	0.787	S	S	*	*			trans	-123.4	128.8	153.8	32.8	-20.9	0	0	0	110.3
579	L	27.8	Very low	31.8	Very low	159 Å²	159	146 Å²	146	83%	0.832	79%	0.787	S	S	*	*				65.7	103.6	67	-71.7	172.8	0	0	0	114.6
580	T	32.5	Very low	32.6	Very low	141 Å²	141	145 Å²	145	87%	0.865	78%	0.783	S	S	*	*				-171	152.6	119.4	17.4	0	0	0	0	112.7
581	T	30.2	Very low	32	Very low	129 Å²	129	145.2 Å²	145.2	79%	0.791	79%	0.788	S	S	*	*			trans	-145.9	-168.4	173.2	60.5	0	0	0	0	106
582	P	49.7	Very low	32.2	Very low	104 Å²	104	141.9 Å²	141.9	68%	0.675	78%	0.783	S	S	*	*			cis	-136.1	-147.2	-4.9	27.2	0.9	0	0	0	112.9
583	E	26.1	Very low	32.3	Very low	173 Å²	173	135.1 Å²	135.1	81%	0.808	77%	0.774	S	S	*	*			trans	78.6	164.2	157.8	-61	-168.6	161	0	0	120.8
584	H	29	Very low	32.5	Very low	159 Å²	159	131.8 Å²	131.8	74%	0.736	77%	0.768	S	S	*	*				-164.4	148.3	-62.1	-120.8	-48.6	0	0	0	111.2
585	Q	27.2	Very low	32.5	Very low	146 Å²	146	133.5 Å²	133.5	68%	0.682	77%	0.766	S	S	*	*			trans	68.9	126.7	150.2	-68.4	-167.4	37.2	0	0	123.8
586	L	27.1	Very low	32.3	Very low	127 Å²	127	130.9 Å²	130.9	67%	0.665	76%	0.761	S	S	*	*			trans	79	128.3	133.6	-67	173.1	0	0	0	124.3
587	N	27.6	Very low	32.6	Very low	126 Å²	126	131.5 Å²	131.5	67%	0.674	76%	0.759	S	S	*	*			trans	65.6	105.5	136.8	-64	-16.1	0	0	0	121.9
588	K	28.3	Very low	32.3	Very low	205 Å²	205	138 Å²	138	89%	0.891	76%	0.763	S	S	*	*				177.4	149.1	102.5	-94.3	154.7	-172.1	171.5	0	113.6
589	T	36.3	Very low	31.8	Very low	132 Å²	132	139.1 Å²	139.1	81%	0.81	76%	0.759	S	S	*	*			trans	-87.6	161.4	157.8	56.6	0	0	0	0	109.4
590	P	42.3	Very low	32	Very low	111 Å²	111	141 Å²	141	72%	0.721	76%	0.76	S	S	*	*				-152.6	162.2	92.5	39.9	-23	0	0	0	116.5
591	S	28.9	Very low	31.9	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	75%	0.751	S	S	*	*			trans	63	149.6	144.6	-69.6	0	0	0	0	120.8
592	S	29.6	Very low	32	Very low	98 Å²	98	138.4 Å²	138.4	69%	0.685	75%	0.749	S	S	*	*			cis	-169.5	170.5	-6	45.3	0	0	0	0	111.4
593	S	29.2	Very low	31.1	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	76%	0.758	S	S	*	*			trans	74.4	147.2	160.3	84.1	0	0	0	0	116.8
594	S	32.7	Very low	31.6	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	75%	0.753	S	S	*	*			cis	-159.5	175.9	-9.9	-120.4	0	0	0	0	113.7
595	L	31.3	Very low	32.3	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	76%	0.759	S	S	*	*			trans	-30.2	155.9	159.3	-66.1	134.7	0	0	0	115.3
596	S	34.7	Very low	32.6	Very low	88 Å²	88	141.6 Å²	141.6	62%	0.615	77%	0.769	S	S	*	*			cis	-164.8	152.1	28.8	49.6	0	0	0	0	115.6
597	Q	35.2	Very low	32.7	Very low	186 Å²	186	146.3 Å²	146.3	87%	0.869	78%	0.784	S	S	*	*			trans	63.4	162.6	147.4	-66.8	166.5	12.5	0	0	121
598	R	32.2	Very low	32.8	Very low	203 Å²	203	143.3 Å²	143.3	77%	0.766	78%	0.783	S	S	*	*			cis	-169.2	122.9	-43.5	178.8	173.2	-178.2	167.2	2.9	110.8
599	M	29.3	Very low	32.9	Very low	147 Å²	147	139.3 Å²	139.3	72%	0.724	78%	0.781	S	S	*	*			trans	65.6	148.9	163.7	-69.8	166.9	161.6	0	0	115.8
600	K	32.8	Very low	32.7	Very low	198 Å²	198	143.3 Å²	143.3	86%	0.861	79%	0.787	S	S	*	*			cis	68.2	136.5	44.5	-68.5	-173.5	178.1	-177.2	0	112.9
601	S	30.9	Very low	32.2	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	79%	0.788	S	S	*	*			cis	-177.2	158.4	-5.4	48.9	0	0	0	0	111.3
602	T	32.5	Very low	32.3	Very low	122 Å²	122	147.3 Å²	147.3	75%	0.748	79%	0.792	S	S	*	*			trans	62.1	134.1	151.9	-37.6	0	0	0	0	119.8
603	L	29.7	Very low	32.4	Very low	166 Å²	166	147.3 Å²	147.3	87%	0.869	79%	0.792	S	S	*	*				-171.3	152.5	127.7	-104.5	165.8	0	0	0	113.4
604	T	36.2	Very low	32.5	Very low	116 Å²	116	146.9 Å²	146.9	71%	0.712	80%	0.795	S	S	*	*			trans	-97.9	174.7	172.6	53.7	0	0	0	0	110.9
605	P	44	Very low	32.5	Very low	132 Å²	132	147.8 Å²	147.8	86%	0.857	80%	0.796	S	S	*	*				-136.3	168.4	117.9	37.6	-28.7	0	0	0	115.2
606	R	33.1	Very low	32.4	Very low	235 Å²	235	143.3 Å²	143.3	89%	0.887	79%	0.789	S	S	*	*			trans	-102	147.3	172.8	-83.3	173.5	150.6	-172.7	-4.7	111.1
607	F	31.2	Very low	32.3	Very low	226 Å²	226	148.3 Å²	148.3	99%	0.991	80%	0.8	S	S	*	*			trans	-175.6	153.2	136.7	-93.9	-69.3	0	0	0	107.1
608	G	28.3	Very low	32	Very low	63 Å²	63	144.9 Å²	144.9	65%	0.649	79%	0.792	S	S	*	*			cis	178.8	122	-7.2	0	0	0	0	0	111.4
609	S	31.5	Very low	32	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	79%	0.789	S	S	*	*			trans	3.4	135	169.9	-53.4	0	0	0	0	122.1
610	K	30.5	Very low	32.1	Very low	217 Å²	217	144 Å²	144	94%	0.943	80%	0.795	S	S	*	*				-158.1	161.1	115.7	-110	163.3	-171.3	175.3	0	112.9
611	S	31.9	Very low	32	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	79%	0.787	S	S	*	*			trans	-132.1	155.7	-160.6	52.7	0	0	0	0	113.2
612	K	32.3	Very low	32.2	Very low	201 Å²	201	142.1 Å²	142.1	87%	0.874	79%	0.794	S	S	*	*			trans	172	151.8	147.3	-96.9	171.9	178.6	-172.2	0	109.4
613	S	31.4	Very low	32.2	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	79%	0.793	S	S	*	*			cis	171.8	126.7	-48.1	48.5	0	0	0	0	108.7
614	A	30.6	Very low	32.3	Very low	102 Å²	102	146 Å²	146	84%	0.843	79%	0.794	S	S	*	*			trans	60.8	168.6	175.2	0	0	0	0	0	114.1
615	V	32.9	Very low	32.1	Very low	120 Å²	120	145.2 Å²	145.2	73%	0.727	79%	0.793	S	S	*	*			cis	-131.1	149.5	11.8	174.3	0	0	0	0	109.5	F617	V615-F617 HydrophobicContact CG1-CD2 3.76Å; V615-F617 HydrophobicContact CG1-CE2 3.92Å
616	G	29.9	Very low	31.6	Very low	67 Å²	67	144.3 Å²	144.3	69%	0.691	79%	0.789	S	S	*	*			trans	-110.1	150.1	165.9	0	0	0	0	0	111.4
617	F	31.4	Very low	32.6	Very low	193 Å²	193	138.8 Å²	138.8	85%	0.846	78%	0.784	S	S	*	*			trans	-144.2	151.9	170.1	-100.6	-74.2	0	0	0	112	V615	V615-F617 HydrophobicContact CG1-CD2 3.76Å; V615-F617 HydrophobicContact CG1-CE2 3.92Å
618	T	30.4	Very low	33	Very low	114 Å²	114	136.2 Å²	136.2	70%	0.699	78%	0.78	S	S	*	*			trans	-104.8	-178.1	179.9	47.3	0	0	0	0	111.8
619	H	30.7	Very low	33.7	Very low	152 Å²	152	141.1 Å²	141.1	70%	0.704	79%	0.79	S	S	*	*			trans	86.2	129.5	-175.2	-60.5	-81.1	0	0	0	114
620	Q	32.7	Very low	34.2	Very low	181 Å²	181	148.7 Å²	148.7	85%	0.846	81%	0.808	S	S	*	*			cis	99.2	134.7	37.3	-81.5	-175.1	-20.5	0	0	112.9
621	G	30.6	Very low	34.4	Very low	68 Å²	68	145.3 Å²	145.3	70%	0.701	80%	0.801	S	S	*	*			trans	113.1	108.4	-176.9	0	0	0	0	0	110.1
622	K	35.8	Very low	34.6	Very low	185 Å²	185	147.3 Å²	147.3	80%	0.804	80%	0.804	S	S	*	*			cis	81.5	131.6	46.2	-70.6	-164.5	172.5	-175.9	0	114.5
623	F	30.8	Very low	34.7	Very low	167 Å²	167	144.3 Å²	144.3	73%	0.732	80%	0.8	S	S	*	*			trans	68.8	150.9	177.9	-57.4	-76.1	0	0	0	114.6
624	F	32	Very low	34.9	Very low	203 Å²	203	147 Å²	147	89%	0.89	81%	0.807	S	S	*	*			cis	-120.1	170	16.6	-107.6	-90.9	0	0	0	115.7
625	S	33	Very low	35.2	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-99.6	169.3	-173.5	-50.2	0	0	0	0	114
626	S	33.8	Very low	35.3	Very low	113 Å²	113	151.8 Å²	151.8	79%	0.79	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.7	149.4	174.3	-43.2	0	0	0	0	114.4
627	P	52.2	Low	35.7	Very low	120 Å²	120	157.9 Å²	157.9	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.1	126.1	161.3	32.8	-30	0	0	0	111.1
628	L	40	Very low	36	Very low	171 Å²	171	155.2 Å²	155.2	90%	0.895	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-79.9	141.3	154.5	-82.6	160.1	0	0	0	108.5
629	L	44.6	Very low	36.5	Very low	166 Å²	166	158.6 Å²	158.6	87%	0.869	83%	0.826	S	S	*	*			trans	-124.4	159.7	163.4	-85.1	172.1	0	0	0	110.3
630	K	42	Very low	37	Very low	279 Å²	279	159.2 Å²	159.2	100%	1.213	84%	0.837	S	S	*	*			trans	-88.5	0	-165.3	-61.3	172.6	178.5	176.2	0	112.6

Retrieved 630 of 630 residues in 610.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).