A0A3Q0KN54_SCHMA Loading...

Putative cop9 signalosome complex subunit

AlphaFold DB , UniProt , Accession A0A3Q0KN54, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 593 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.9	Very low	35.5	Very low	245 Å²	245	155.7 Å²	155.7	100%	1.207	82%	0.816	S	S	*	*				0	107.6	0	-144.8	170.8	179.4	0	0	105.7	H3	M1-H3 PolarHBondContact O-N 3.36Å
2	L	37.4	Very low	35.1	Very low	163 Å²	163	152.3 Å²	152.3	85%	0.853	81%	0.806	S	S	*	*			trans	-75.6	109.4	-141.1	-65.1	157.9	0	0	0	112.4	L4	L2-L4 HydrophobicContact CB-CD1 4.26Å; L2-L4 PolarHBondContact O-N 3.47Å
3	H	34.9	Very low	34.6	Very low	168 Å²	168	148.4 Å²	148.4	78%	0.778	80%	0.795	S	S	*	*			trans	-75.2	93.3	165	-144.3	61	0	0	0	106.5	M1 D5	M1-H3 PolarHBondContact O-N 3.36Å; H3-D5 IonicContact CD2-OD1 2.75Å; H3-D5 IonicContact CD2-OD2 3.7Å; H3-D5 PolarHBondContact O-N 3.47Å
4	L	40.6	Very low	34.2	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	79%	0.794	S	S	*	*			trans	-86.7	90.6	171.1	-88.1	136	0	0	0	107.2	L2 P6	L2-L4 HydrophobicContact CB-CD1 4.26Å; L2-L4 PolarHBondContact O-N 3.47Å; L4-P6 WeakPolarHBondContact O-CD 3.23Å
5	D	38.1	Very low	33.7	Very low	105 Å²	105	143.1 Å²	143.1	56%	0.561	79%	0.786	S	S	*	*			trans	-67.6	118.6	164.2	-75.9	-44.5	0	0	0	109	H3 A7	H3-D5 IonicContact CD2-OD1 2.75Å; H3-D5 IonicContact CD2-OD2 3.7Å; H3-D5 PolarHBondContact O-N 3.47Å; D5-A7 PolarHBondContact O-N 3.35Å
6	P	35.1	Very low	33.4	Very low	133 Å²	133	141.3 Å²	141.3	86%	0.864	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	63.6	164.3	35.4	-26.7	0	0	0	107.9	L4	L4-P6 WeakPolarHBondContact O-CD 3.23Å
7	A	37.3	Very low	32.9	Very low	83 Å²	83	141.3 Å²	141.3	69%	0.686	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.5	13.1	177.6	0	0	0	0	0	113.5	D5	D5-A7 PolarHBondContact O-N 3.35Å
8	L	31.1	Very low	32.6	Very low	151 Å²	151	138.3 Å²	138.3	79%	0.791	78%	0.782	S	S	*	*			trans	-112.5	60.6	170.4	-69.9	173.9	0	0	0	110.2
9	F	33.8	Very low	32.2	Very low	190 Å²	190	136.6 Å²	136.6	83%	0.833	78%	0.779	S	S	*	*			trans	-109.3	90.9	142.9	-96.7	-88.8	0	0	0	105.1	D11	F9-D11 PolarHBondContact O-N 3.25Å
10	E	31.3	Very low	32	Very low	173 Å²	173	134.2 Å²	134.2	81%	0.808	77%	0.768	S	S	*	*			trans	-60.6	92.6	161.2	-158.8	165.4	-154.9	0	0	105.1	V12	E10-V12 PolarHBondContact O-N 3.34Å
11	D	30.3	Very low	31.9	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	77%	0.771	S	S	*	*			trans	-63.6	87.4	171.3	-86	-33.5	0	0	0	106.8	F9 P13	F9-D11 PolarHBondContact O-N 3.25Å; D11-P13 VanDerWaalsContact O-N 3.16Å
12	V	30.5	Very low	32	Very low	115 Å²	115	131 Å²	131	70%	0.697	74%	0.738	S	S	*	*			trans	-46.9	120.6	160.1	176.7	0	0	0	0	105.4	E10	E10-V12 PolarHBondContact O-N 3.34Å
13	P	28.9	Very low	32.4	Very low	101 Å²	101	129.3 Å²	129.3	66%	0.656	73%	0.726	S	S	*	*			trans	-53.8	133.3	177	24.3	-32.3	0	0	0	106.1	D11 S15	D11-P13 VanDerWaalsContact O-N 3.16Å; P13-S15 VanDerWaalsContact C-N 3.33Å; P13-S15 PolarHBondContact O-N 2.95Å
14	P	28.9	Very low	33.2	Very low	120 Å²	120	124.9 Å²	124.9	78%	0.779	71%	0.711	S	S	*	*			trans	-56.8	110.7	176.2	24.8	-30.9	0	0	0	104.7	S16	P14-S16 PolarHBondContact O-N 2.89Å
15	S	27.4	Very low	33.9	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	67%	0.674	S	S	*	*			trans	-49.5	116.6	173.5	43.8	0	0	0	0	104.6	P13 N17	P13-S15 VanDerWaalsContact C-N 3.33Å; P13-S15 PolarHBondContact O-N 2.95Å; S15-N17 PolarHBondContact O-N 2.96Å
16	S	27.9	Very low	34.5	Very low	113 Å²	113	118.9 Å²	118.9	79%	0.79	68%	0.68	S	S	*	*	S	Bend	trans	-70.8	68.6	-170.7	53.8	0	0	0	0	109.2	P14	P14-S16 PolarHBondContact O-N 2.89Å
17	N	25.1	Very low	35.5	Very low	142 Å²	142	117.4 Å²	117.4	76%	0.759	67%	0.665	S	S	*	*			trans	-134.8	29.1	173.7	-82.3	-9.4	0	0	0	109	S15 S19	S15-N17 PolarHBondContact O-N 2.96Å; N17-S19 PolarHBondContact O-N 2.9Å
18	A	26.7	Very low	36.4	Very low	88 Å²	88	121.6 Å²	121.6	73%	0.727	67%	0.67	S	S	*	*			trans	-72.5	89.6	164.5	0	0	0	0	0	107.6	T20	A18-T20 VanDerWaalsContact C-N 3.34Å; A18-T20 PolarHBondContact O-N 2.88Å
19	S	26.7	Very low	37.8	Very low	105 Å²	105	115 Å²	115	73%	0.734	64%	0.636	S	S	*	*			trans	-38.1	102.5	157	-42.4	0	0	0	0	107.4	N17 E21	N17-S19 PolarHBondContact O-N 2.9Å; S19-E21 PolarHBondContact O-N 3.28Å
20	T	28.2	Very low	39.2	Very low	89 Å²	89	115 Å²	115	55%	0.546	64%	0.639	S	S	.	*			trans	-72.3	87.3	172.7	-54.2	0	0	0	0	104.8	A18 Y22	A18-T20 VanDerWaalsContact C-N 3.34Å; A18-T20 PolarHBondContact O-N 2.88Å; T20-Y22 VanDerWaalsContact C-N 3.28Å; T20-Y22 HydrophobicContact CG2-CD1 3.63Å; T20-Y22 HydrophobicContact CG2-CE1 3.44Å; T20-Y22 VanDerWaalsContact CG2-CE1 3.44Å; T20-Y22 WeakPolarHBondContact O-CD2 3.38Å; T20-Y22 PolarHBondContact O-N 3.32Å
21	E	29.1	Very low	41	Very low	177 Å²	177	108.8 Å²	108.8	83%	0.827	61%	0.611	S	S	*	*			trans	-59.2	100.7	166.3	-81	-175.8	168.3	0	0	106.2	S19 E23	S19-E21 PolarHBondContact O-N 3.28Å; E21-E23 VanDerWaalsContact C-N 3.32Å; E21-E23 PolarHBondContact O-N 2.92Å
22	Y	42.3	Very low	43	Very low	136 Å²	136	106.5 Å²	106.5	53%	0.533	60%	0.598	S	S	.	*			trans	-71.4	93.5	176.3	-60.7	-59.1	0	0	0	107.2	T20 T24	T20-Y22 VanDerWaalsContact C-N 3.28Å; T20-Y22 HydrophobicContact CG2-CD1 3.63Å; T20-Y22 HydrophobicContact CG2-CE1 3.44Å; T20-Y22 VanDerWaalsContact CG2-CE1 3.44Å; T20-Y22 WeakPolarHBondContact O-CD2 3.38Å; T20-Y22 PolarHBondContact O-N 3.32Å; Y22-T24 PolarHBondContact O-N 3.18Å
23	E	47.4	Very low	45.2	Very low	127 Å²	127	101.4 Å²	101.4	59%	0.593	57%	0.567	S	S	*	*			trans	-48.7	114.8	167.2	-97.7	179.1	-169.8	0	0	108	E21 R465	E21-E23 VanDerWaalsContact C-N 3.32Å; E21-E23 PolarHBondContact O-N 2.92Å; E23-R465 PolarHBondContact O-NE 2.87Å; E23-R465 PolarHBondContact O-NH2 3.44Å; E23-R465 VanDerWaalsContact O-NH2 3.14Å; E23-R465 IonicContact OE2-CZ 3.63Å; E23-R465 IonicContact OE2-NH1 3.52Å; E23-R465 PolarHBondContact OE2-NH1 3.2Å; E23-R465 IonicContact OE2-NH2 3.86Å; E23-R465 PolarHBondContact OE2-NH2 3.34Å
24	T	49.9	Very low	47.2	Very low	74 Å²	74	98.5 Å²	98.5	45%	0.454	56%	0.555	S	S	.	*			trans	-71.8	144.5	177.8	49.1	0	0	0	0	109.6	Y22 D26	Y22-T24 PolarHBondContact O-N 3.18Å; T24-D26 WeakPolarHBondContact CB-OD1 3.45Å; T24-D26 PolarHBondContact OG1-OD1 3.35Å
25	V	55.8	Low	49.5	Very low	7 Å²	7	98 Å²	98	4%	0.042	55%	0.546	C	S	.	.			trans	-92.6	100.5	170.3	-176.5	0	0	0	0	106.3	D27 V29 R55 N462 R465	V25-D27 VanDerWaalsContact C-N 3.29Å; V25-V29 HydrophobicContact CG1-CG2 4.15Å; V25-R55 PolarHBondContact N-O 2.84Å; V25-N462 HydrophobicContact CG1-CB 4.23Å; V25-R465 HydrophobicContact CG2-CB 4.33Å; V25-R465 HydrophobicContact CG2-CG 3.85Å
26	D	51.6	Low	51.8	Low	127 Å²	127	96 Å²	96	68%	0.679	52%	0.524	S	S	*	.			trans	-82.1	-9.7	-178.5	-63.9	-19.7	0	0	0	112.5	T24	T24-D26 WeakPolarHBondContact CB-OD1 3.45Å; T24-D26 PolarHBondContact OG1-OD1 3.35Å
27	D	56.1	Low	54.1	Low	102 Å²	102	90.8 Å²	90.8	55%	0.545	49%	0.487	S	S	.	.	S	Bend	trans	-81.3	139.9	179.8	-66.1	-27.8	0	0	0	112.4	V25 V29	V25-D27 VanDerWaalsContact C-N 3.29Å; D27-V29 WeakPolarHBondContact O-CG2 3.35Å; D27-V29 PolarHBondContact O-N 2.91Å
28	E	55.2	Low	56.6	Low	171 Å²	171	87.4 Å²	87.4	80%	0.799	48%	0.475	S	S	*	.			trans	-59.7	104.1	175.5	-72.9	-174.9	165.9	0	0	111.6	Q30	E28-Q30 PolarHBondContact O-N 3.2Å
29	V	61.9	Low	59.1	Low	13 Å²	13	87.8 Å²	87.8	8%	0.079	46%	0.464	C	S	.	.			trans	-87	110.2	173.6	-177.4	0	0	0	0	109.4	V25 D27 I31 N462 V463 L466	V25-V29 HydrophobicContact CG1-CG2 4.15Å; D27-V29 WeakPolarHBondContact O-CG2 3.35Å; D27-V29 PolarHBondContact O-N 2.91Å; V29-I31 HydrophobicContact CG1-CB 4.21Å; V29-I31 HydrophobicContact CG1-CD1 3.26Å; V29-I31 HydrophobicContact CG1-CG1 3.46Å; V29-I31 VanDerWaalsContact CG1-CG1 3.46Å; V29-I31 PolarHBondContact O-N 2.89Å; V29-N462 HydrophobicContact CG2-CB 3.81Å; V29-V463 HydrophobicContact CG1-CG2 4.47Å; V29-L466 HydrophobicContact CB-CD1 4.27Å; V29-L466 HydrophobicContact CG1-CD1 3.85Å; V29-L466 HydrophobicContact CG2-CD1 4.27Å
30	Q	62.7	Low	61.5	Low	190 Å²	190	83 Å²	83	89%	0.888	43%	0.43	S	S	*	.			trans	-77.9	65.3	174.7	-63.5	-177.9	-4.1	0	0	111.3	E28	E28-Q30 PolarHBondContact O-N 3.2Å
31	I	69	Low	63.7	Low	42 Å²	42	83.4 Å²	83.4	22%	0.215	43%	0.426	C	S	.	.			trans	-102.7	128.3	170.9	-68.8	163	0	0	0	109	V29 L33 V463 L466	V29-I31 HydrophobicContact CG1-CB 4.21Å; V29-I31 HydrophobicContact CG1-CD1 3.26Å; V29-I31 HydrophobicContact CG1-CG1 3.46Å; V29-I31 VanDerWaalsContact CG1-CG1 3.46Å; V29-I31 PolarHBondContact O-N 2.89Å; I31-L33 PolarHBondContact O-N 3.03Å; I31-V463 HydrophobicContact CD1-CB 4.22Å; I31-V463 HydrophobicContact CD1-CG1 3.85Å; I31-V463 HydrophobicContact CD1-CG2 4.02Å; I31-V463 HydrophobicContact CG1-CG1 4.49Å; I31-V463 HydrophobicContact CG1-CG2 4.24Å; I31-L466 HydrophobicContact CD1-CD1 3.63Å
32	D	72	Confident	65.9	Low	100 Å²	100	76.4 Å²	76.4	54%	0.535	40%	0.401	S	S	.	.			trans	-73.9	95.4	164.4	-178.7	8.3	0	0	0	109.6	G34 N35 Y36	D32-G34 PolarHBondContact O-N 3.46Å; D32-G34 PolarHBondContact OD1-N 3.11Å; D32-N35 PolarHBondContact O-N 2.94Å; D32-N35 PolarHBondContact OD2-ND2 3.37Å; D32-Y36 PolarHBondContact O-N 2.91Å
33	L	76.1	Confident	67.7	Low	8 Å²	8	72.1 Å²	72.1	4%	0.042	38%	0.384	C	S	.	.	H	α-helix	trans	-61.3	-29	-175.7	-166.9	61.4	0	0	0	112	I31 I37 L49 I52 I62 A63 L66	I31-L33 PolarHBondContact O-N 3.03Å; L33-I37 HydrophobicContact CD1-CD1 3.65Å; L33-I37 HydrophobicContact CD1-CG1 4.17Å; L33-I37 HydrophobicContact CD2-CD1 4.29Å; L33-I37 HydrophobicContact CG-CD1 3.51Å; L33-I37 HydrophobicContact CG-CG1 4.39Å; L33-I37 VanDerWaalsContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CB 3.36Å; L33-I37 VanDerWaalsContact O-CD1 3.22Å; L33-I37 WeakPolarHBondContact O-CD1 3.38Å; L33-I37 WeakPolarHBondContact O-CG1 3.43Å; L33-I37 PolarHBondContact O-N 3.17Å; L33-L49 HydrophobicContact CD1-CD2 4.44Å; L33-L49 HydrophobicContact CD2-CD2 4.02Å; L33-L49 HydrophobicContact CG-CD2 4.35Å; L33-I52 HydrophobicContact CD1-CD1 3.8Å; L33-I52 HydrophobicContact CD1-CG2 4.4Å; L33-I62 HydrophobicContact CD2-CB 4.49Å; L33-I62 HydrophobicContact CD2-CG2 4.16Å; L33-A63 HydrophobicContact CD2-CB 3.73Å; L33-L66 HydrophobicContact CD2-CD1 4.12Å; L33-L66 HydrophobicContact CG-CD1 4.12Å
34	G	71.5	Confident	69.3	Low	39 Å²	39	66.2 Å²	66.2	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-67	-47	179.6	0	0	0	0	0	112.7	D32 S38	D32-G34 PolarHBondContact O-N 3.46Å; D32-G34 PolarHBondContact OD1-N 3.11Å; G34-S38 PolarHBondContact O-N 3.17Å
35	N	77.1	Confident	70.9	Confident	109 Å²	109	64.6 Å²	64.6	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-68.8	-42.7	178.2	-83.1	-28.9	0	0	0	112	D32 I37 S38	D32-N35 PolarHBondContact O-N 2.94Å; D32-N35 PolarHBondContact OD2-ND2 3.37Å; N35-I37 VanDerWaalsContact C-N 3.25Å; N35-I37 PolarHBondContact O-N 3.01Å; N35-S38 PolarHBondContact O-N 3.18Å; N35-S38 PolarHBondContact O-OG 2.87Å
36	Y	75.7	Confident	72.2	Confident	56 Å²	56	64.9 Å²	64.9	22%	0.22	34%	0.343	C	S	.	.	H	α-helix	trans	-55.5	-44.5	178.2	178.9	-109.9	0	0	0	111.9	D32 Y40 R48 I52	D32-Y36 PolarHBondContact O-N 2.91Å; Y36-Y40 HydrophobicContact CD1-CE2 4.27Å; Y36-Y40 HydrophobicContact CD2-CE2 4.37Å; Y36-Y40 AromaticContact CE1-CE2 3.85Å; Y36-Y40 HydrophobicContact CE1-CE2 3.85Å; Y36-Y40 AromaticContact CE2-CE2 3.96Å; Y36-Y40 HydrophobicContact CE2-CE2 3.96Å; Y36-Y40 AromaticContact CZ-CE2 3.68Å; Y36-Y40 AromaticContact CZ-CZ 3.98Å; Y36-Y40 WeakPolarHBondContact O-CD2 3.29Å; Y36-Y40 VanDerWaalsContact O-CE2 3.29Å; Y36-Y40 WeakPolarHBondContact O-CE2 3.48Å; Y36-Y40 PolarHBondContact OH-OH 2.79Å; Y36-R48 PolarHBondContact OH-NH1 3.04Å; Y36-I52 HydrophobicContact CD1-CD1 4.32Å; Y36-I52 HydrophobicContact CE1-CD1 4.04Å
37	I	77.1	Confident	73.8	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-78.9	-27.5	-172.4	-70.3	171	0	0	0	112.9	L33 N35 N39 Y40 Y45 L49 L66	L33-I37 HydrophobicContact CD1-CD1 3.65Å; L33-I37 HydrophobicContact CD1-CG1 4.17Å; L33-I37 HydrophobicContact CD2-CD1 4.29Å; L33-I37 HydrophobicContact CG-CD1 3.51Å; L33-I37 HydrophobicContact CG-CG1 4.39Å; L33-I37 VanDerWaalsContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CB 3.36Å; L33-I37 VanDerWaalsContact O-CD1 3.22Å; L33-I37 WeakPolarHBondContact O-CD1 3.38Å; L33-I37 WeakPolarHBondContact O-CG1 3.43Å; L33-I37 PolarHBondContact O-N 3.17Å; N35-I37 VanDerWaalsContact C-N 3.25Å; N35-I37 PolarHBondContact O-N 3.01Å; I37-N39 PolarHBondContact O-N 2.8Å; I37-Y40 PolarHBondContact O-N 3.39Å; I37-Y45 HydrophobicContact CB-CE2 4.38Å; I37-Y45 HydrophobicContact CG2-CD1 4.27Å; I37-Y45 HydrophobicContact CG2-CD2 3.41Å; I37-Y45 VanDerWaalsContact CG2-CD2 3.41Å; I37-Y45 HydrophobicContact CG2-CE1 3.81Å; I37-Y45 HydrophobicContact CG2-CE2 2.92Å; I37-Y45 HydrophobicContact CG2-CG 4.08Å; I37-Y45 WeakPolarHBondContact CG2-OH 3.49Å; I37-L49 HydrophobicContact CD1-CD1 3.9Å; I37-L49 HydrophobicContact CD1-CD2 3.13Å; I37-L49 HydrophobicContact CD1-CG 3.47Å; I37-L49 VanDerWaalsContact CD1-CG 3.47Å; I37-L49 HydrophobicContact CG1-CD2 4.35Å; I37-L49 HydrophobicContact CG1-CG 4.36Å; I37-L66 HydrophobicContact CD1-CD1 4Å
38	S	76.9	Confident	75.2	Confident	72 Å²	72	56 Å²	56	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-56.2	-24.8	-180	72.2	0	0	0	0	113.6	G34 N35	G34-S38 PolarHBondContact O-N 3.17Å; N35-S38 PolarHBondContact O-N 3.18Å; N35-S38 PolarHBondContact O-OG 2.87Å
39	N	78.4	Confident	76.7	Confident	95 Å²	95	47.9 Å²	47.9	51%	0.508	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.7	178.5	-61.7	-35	0	0	0	113.6	I37 T397	I37-N39 PolarHBondContact O-N 2.8Å; N39-T397 HydrophobicContact CB-CG2 3.59Å
40	Y	78.1	Confident	77.8	Confident	4 Å²	4	48.7 Å²	48.7	2%	0.016	26%	0.258	C	S	.	.			trans	-105	150.4	-178.6	-56.4	-82.5	0	0	0	111.3	Y36 I37 I44 Y45 R48 T397 D400	Y36-Y40 HydrophobicContact CD1-CE2 4.27Å; Y36-Y40 HydrophobicContact CD2-CE2 4.37Å; Y36-Y40 AromaticContact CE1-CE2 3.85Å; Y36-Y40 HydrophobicContact CE1-CE2 3.85Å; Y36-Y40 AromaticContact CE2-CE2 3.96Å; Y36-Y40 HydrophobicContact CE2-CE2 3.96Å; Y36-Y40 AromaticContact CZ-CE2 3.68Å; Y36-Y40 AromaticContact CZ-CZ 3.98Å; Y36-Y40 WeakPolarHBondContact O-CD2 3.29Å; Y36-Y40 VanDerWaalsContact O-CE2 3.29Å; Y36-Y40 WeakPolarHBondContact O-CE2 3.48Å; Y36-Y40 PolarHBondContact OH-OH 2.79Å; I37-Y40 PolarHBondContact O-N 3.39Å; Y40-I44 HydrophobicContact CD1-CG2 3.94Å; Y40-I44 HydrophobicContact CG-CG2 4.31Å; Y40-Y45 WeakPolarHBondContact O-CD2 3.34Å; Y40-R48 VanDerWaalsContact CZ-CZ 3.48Å; Y40-R48 PolarHBondContact OH-NH1 3.44Å; Y40-T397 HydrophobicContact CD1-CG2 3.86Å; Y40-T397 HydrophobicContact CD2-CG2 4.47Å; Y40-T397 HydrophobicContact CE1-CG2 3.33Å; Y40-T397 HydrophobicContact CE2-CG2 4.03Å; Y40-T397 HydrophobicContact CG-CG2 4.4Å; Y40-T397 VanDerWaalsContact CZ-CG2 3.42Å; Y40-T397 PolarHBondContact OH-OG1 2.98Å; Y40-D400 WeakPolarHBondContact CE1-OD2 3.42Å; Y40-D400 PolarHBondContact OH-OD1 3.43Å; Y40-D400 PolarHBondContact OH-OD2 3.18Å
41	Q	73.9	Confident	78.9	Confident	99 Å²	99	40.5 Å²	40.5	46%	0.463	22%	0.22	S	C	.	.			trans	-150.3	151.1	179.5	-70	170.9	-2	0	0	109.9	R394	Q41-R394 HydrophobicContact CB-CG 3.75Å
42	G	75.8	Confident	79.7	Confident	29 Å²	29	38.8 Å²	38.8	30%	0.299	21%	0.211	S	C	.	.	S	Bend	trans	90.3	-154.8	-177.7	0	0	0	0	0	113.7	I44 Y45 Y70	G42-I44 PolarHBondContact O-N 2.97Å; G42-Y45 WeakPolarHBondContact O-CB 3.34Å; G42-Y45 PolarHBondContact O-N 2.91Å; G42-Y70 VanDerWaalsContact C-OH 3.3Å; G42-Y70 WeakPolarHBondContact CA-OH 3.11Å; G42-Y70 PolarHBondContact N-OH 3.47Å; G42-Y70 WeakPolarHBondContact O-CE1 3.21Å; G42-Y70 PolarHBondContact O-OH 3.16Å
43	Y	78.8	Confident	80.3	Confident	47 Å²	47	34 Å²	34	18%	0.184	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-32	-177.2	-173	-102.1	0	0	0	113	Y45 Y46 Q47 L217 F250	Y43-Y45 VanDerWaalsContact C-N 3.29Å; Y43-Y45 PolarHBondContact O-N 3.44Å; Y43-Y46 PolarHBondContact O-N 2.94Å; Y43-Q47 PolarHBondContact O-N 2.86Å; Y43-Q47 VanDerWaalsContact O-N 3.13Å; Y43-L217 HydrophobicContact CD1-CD2 4.45Å; Y43-L217 HydrophobicContact CE1-CD1 4.17Å; Y43-L217 HydrophobicContact CE1-CD2 4.13Å; Y43-F250 HydrophobicContact CD1-CB 4.09Å; Y43-F250 AromaticContact CD1-CD1 3.85Å; Y43-F250 HydrophobicContact CD1-CD1 3.85Å; Y43-F250 AromaticContact CD1-CD2 3.93Å; Y43-F250 HydrophobicContact CD1-CD2 3.93Å; Y43-F250 HydrophobicContact CD1-CE1 4.25Å; Y43-F250 HydrophobicContact CD1-CE2 4.31Å; Y43-F250 AromaticContact CD1-CG 3.7Å; Y43-F250 HydrophobicContact CD1-CG 3.7Å; Y43-F250 HydrophobicContact CD1-CZ 4.47Å; Y43-F250 HydrophobicContact CE1-CB 4.09Å; Y43-F250 HydrophobicContact CE1-CG 4.22Å; Y43-F250 HydrophobicContact CG-CD2 4.48Å
44	I	81.4	Confident	80.7	Confident	3 Å²	3	37 Å²	37	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-67.6	-28.8	-178	-129.4	168.5	0	0	0	113.3	Y40 G42 Y46 Q47 R48 F250 R394 I395 F469	Y40-I44 HydrophobicContact CD1-CG2 3.94Å; Y40-I44 HydrophobicContact CG-CG2 4.31Å; G42-I44 PolarHBondContact O-N 2.97Å; I44-Y46 VanDerWaalsContact C-N 3.35Å; I44-Y46 PolarHBondContact O-N 3.01Å; I44-Q47 PolarHBondContact O-N 3.46Å; I44-R48 WeakPolarHBondContact O-CB 3.2Å; I44-R48 WeakPolarHBondContact O-CG 3.36Å; I44-R48 PolarHBondContact O-N 2.74Å; I44-F250 HydrophobicContact CB-CE1 4.03Å; I44-F250 HydrophobicContact CD1-CE1 3.88Å; I44-F250 HydrophobicContact CG1-CD1 4.45Å; I44-F250 HydrophobicContact CG1-CE1 3.83Å; I44-R394 WeakPolarHBondContact CG2-O 3.08Å; I44-I395 HydrophobicContact CD1-CB 3.84Å; I44-I395 HydrophobicContact CD1-CG1 4.26Å; I44-I395 HydrophobicContact CD1-CG2 3.32Å; I44-I395 WeakPolarHBondContact CD1-O 3.29Å; I44-F469 HydrophobicContact CD1-CZ 4.48Å
45	Y	83.3	Confident	81.1	Confident	39 Å²	39	35.7 Å²	35.7	15%	0.153	18%	0.182	C	C	.	.	H	α-helix	trans	-56.5	-52.4	176.2	-179.5	-70.9	0	0	0	110.2	I37 Y40 G42 Y43 L49 Y70	I37-Y45 HydrophobicContact CB-CE2 4.38Å; I37-Y45 HydrophobicContact CG2-CD1 4.27Å; I37-Y45 HydrophobicContact CG2-CD2 3.41Å; I37-Y45 VanDerWaalsContact CG2-CD2 3.41Å; I37-Y45 HydrophobicContact CG2-CE1 3.81Å; I37-Y45 HydrophobicContact CG2-CE2 2.92Å; I37-Y45 HydrophobicContact CG2-CG 4.08Å; I37-Y45 WeakPolarHBondContact CG2-OH 3.49Å; Y40-Y45 WeakPolarHBondContact O-CD2 3.34Å; G42-Y45 WeakPolarHBondContact O-CB 3.34Å; G42-Y45 PolarHBondContact O-N 2.91Å; Y43-Y45 VanDerWaalsContact C-N 3.29Å; Y43-Y45 PolarHBondContact O-N 3.44Å; Y45-L49 HydrophobicContact CD1-CD1 3.71Å; Y45-L49 HydrophobicContact CE1-CD1 3.28Å; Y45-L49 WeakPolarHBondContact O-CB 3.25Å; Y45-L49 PolarHBondContact O-N 3.17Å; Y45-Y70 AromaticContact CD1-CD1 3.41Å; Y45-Y70 HydrophobicContact CD1-CD1 3.41Å; Y45-Y70 VanDerWaalsContact CD1-CD1 3.41Å; Y45-Y70 AromaticContact CD1-CD2 3.59Å; Y45-Y70 HydrophobicContact CD1-CD2 3.59Å; Y45-Y70 AromaticContact CD1-CE1 3.85Å; Y45-Y70 HydrophobicContact CD1-CE1 3.85Å; Y45-Y70 HydrophobicContact CD1-CE2 4.02Å; Y45-Y70 AromaticContact CD1-CG 3.26Å; Y45-Y70 HydrophobicContact CD1-CG 3.26Å; Y45-Y70 AromaticContact CD2-CD2 4Å; Y45-Y70 HydrophobicContact CD2-CD2 4Å; Y45-Y70 AromaticContact CD2-CE2 3.93Å; Y45-Y70 HydrophobicContact CD2-CE2 3.93Å; Y45-Y70 AromaticContact CE1-CD1 3.93Å; Y45-Y70 HydrophobicContact CE1-CD1 3.93Å; Y45-Y70 AromaticContact CE1-CD2 3.56Å; Y45-Y70 HydrophobicContact CE1-CD2 3.56Å; Y45-Y70 HydrophobicContact CE1-CE2 4.37Å; Y45-Y70 AromaticContact CE1-CG 3.29Å; Y45-Y70 HydrophobicContact CE1-CG 3.29Å; Y45-Y70 AromaticContact CE2-CD2 3.87Å; Y45-Y70 HydrophobicContact CE2-CD2 3.87Å; Y45-Y70 HydrophobicContact CE2-CE2 4.19Å; Y45-Y70 HydrophobicContact CE2-CG 4.45Å; Y45-Y70 HydrophobicContact CG-CD1 4.03Å; Y45-Y70 AromaticContact CG-CD2 3.86Å; Y45-Y70 HydrophobicContact CG-CD2 3.86Å; Y45-Y70 AromaticContact CG-CE1 3.99Å; Y45-Y70 HydrophobicContact CG-CE1 3.99Å; Y45-Y70 AromaticContact CG-CE2 3.83Å; Y45-Y70 HydrophobicContact CG-CE2 3.83Å; Y45-Y70 AromaticContact CG-CG 3.95Å; Y45-Y70 HydrophobicContact CG-CG 3.95Å; Y45-Y70 AromaticContact CG-CZ 3.89Å; Y45-Y70 AromaticContact CZ-CD2 3.71Å; Y45-Y70 AromaticContact CZ-CG 3.94Å
46	Y	84	Confident	81.3	Confident	13 Å²	13	30.5 Å²	30.5	5%	0.051	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-46	177.5	164.2	-104.1	0	0	0	110.9	Y43 I44 R48 L49 F50 A67 V71 A80 I84	Y43-Y46 PolarHBondContact O-N 2.94Å; I44-Y46 VanDerWaalsContact C-N 3.35Å; I44-Y46 PolarHBondContact O-N 3.01Å; Y46-R48 PolarHBondContact O-N 3.24Å; Y46-L49 PolarHBondContact O-N 2.77Å; Y46-F50 HydrophobicContact CE2-CB 4.44Å; Y46-F50 HydrophobicContact CE2-CD2 4.18Å; Y46-F50 AromaticContact CZ-CD2 3.96Å; Y46-F50 VanDerWaalsContact O-CB 3.29Å; Y46-F50 WeakPolarHBondContact O-CB 3.43Å; Y46-F50 PolarHBondContact O-N 3.5Å; Y46-F50 WeakPolarHBondContact OH-CD2 3.36Å; Y46-A67 HydrophobicContact CD2-CB 4.34Å; Y46-V71 HydrophobicContact CD2-CG2 3.83Å; Y46-V71 HydrophobicContact CE2-CG2 4.35Å; Y46-V71 HydrophobicContact CG-CG2 4.42Å; Y46-A80 HydrophobicContact CD1-CB 4.16Å; Y46-A80 HydrophobicContact CD2-CB 4.32Å; Y46-A80 HydrophobicContact CE1-CB 3.66Å; Y46-A80 HydrophobicContact CE2-CB 3.84Å; Y46-A80 HydrophobicContact CG-CB 4.47Å; Y46-A80 VanDerWaalsContact CZ-CB 3.49Å; Y46-A80 PolarHBondContact OH-O 3.34Å; Y46-I84 HydrophobicContact CD2-CD1 4.33Å; Y46-I84 HydrophobicContact CE2-CD1 3.83Å; Y46-I84 HydrophobicContact CE2-CG1 3.82Å
47	Q	84.3	Confident	81.4	Confident	38 Å²	38	30.5 Å²	30.5	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-41.1	-176.9	-165.2	178.5	2.2	0	0	112.9	Y43 I44 F51 I468	Y43-Q47 PolarHBondContact O-N 2.86Å; Y43-Q47 VanDerWaalsContact O-N 3.13Å; I44-Q47 PolarHBondContact O-N 3.46Å; Q47-F51 WeakPolarHBondContact O-CB 3.39Å; Q47-F51 PolarHBondContact O-N 3.4Å; Q47-I468 HydrophobicContact CG-CD1 3.71Å
48	R	86.8	Confident	81.6	Confident	6 Å²	6	33.5 Å²	33.5	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-46.2	175.8	-75.8	-180	177.1	-92.5	2.9	111.5	Y36 Y40 I44 Y46 F50 F51 I52 I395 D400 D467 I468	Y36-R48 PolarHBondContact OH-NH1 3.04Å; Y40-R48 VanDerWaalsContact CZ-CZ 3.48Å; Y40-R48 PolarHBondContact OH-NH1 3.44Å; I44-R48 WeakPolarHBondContact O-CB 3.2Å; I44-R48 WeakPolarHBondContact O-CG 3.36Å; I44-R48 PolarHBondContact O-N 2.74Å; Y46-R48 PolarHBondContact O-N 3.24Å; R48-F50 VanDerWaalsContact C-N 3.32Å; R48-F50 PolarHBondContact O-N 3.42Å; R48-F51 WeakPolarHBondContact O-CB 3.24Å; R48-F51 PolarHBondContact O-N 3.19Å; R48-I52 VanDerWaalsContact O-CG1 3.29Å; R48-I52 WeakPolarHBondContact O-CG1 3.32Å; R48-I52 PolarHBondContact O-N 3.05Å; R48-I395 PolarHBondContact NH2-O 3.3Å; R48-D400 IonicContact CZ-OD2 3.85Å; R48-D400 IonicContact NH1-OD2 2.95Å; R48-D400 IonicContact NH2-OD2 2.95Å; R48-D400 PolarHBondContact NH2-OD2 2.87Å; R48-D467 IonicContact CZ-OD1 3.18Å; R48-D467 IonicContact NH1-OD1 2.76Å; R48-D467 PolarHBondContact NH1-OD1 3.25Å; R48-D467 IonicContact NH2-OD1 2.8Å; R48-I468 HydrophobicContact CG-CG2 4.42Å
49	L	85.7	Confident	81.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.6	-45	175.9	-90.6	174.1	0	0	0	112.7	L33 I37 Y45 Y46 F51 I52 A53 A63 L66 A67	L33-L49 HydrophobicContact CD1-CD2 4.44Å; L33-L49 HydrophobicContact CD2-CD2 4.02Å; L33-L49 HydrophobicContact CG-CD2 4.35Å; I37-L49 HydrophobicContact CD1-CD1 3.9Å; I37-L49 HydrophobicContact CD1-CD2 3.13Å; I37-L49 HydrophobicContact CD1-CG 3.47Å; I37-L49 VanDerWaalsContact CD1-CG 3.47Å; I37-L49 HydrophobicContact CG1-CD2 4.35Å; I37-L49 HydrophobicContact CG1-CG 4.36Å; Y45-L49 HydrophobicContact CD1-CD1 3.71Å; Y45-L49 HydrophobicContact CE1-CD1 3.28Å; Y45-L49 WeakPolarHBondContact O-CB 3.25Å; Y45-L49 PolarHBondContact O-N 3.17Å; Y46-L49 PolarHBondContact O-N 2.77Å; L49-F51 VanDerWaalsContact C-N 3.31Å; L49-F51 PolarHBondContact O-N 2.84Å; L49-I52 PolarHBondContact O-N 3.11Å; L49-A53 VanDerWaalsContact O-CB 3.29Å; L49-A53 WeakPolarHBondContact O-CB 3.19Å; L49-A53 PolarHBondContact O-N 3.24Å; L49-A63 HydrophobicContact CD2-CB 3.77Å; L49-A63 WeakPolarHBondContact CD2-O 3.43Å; L49-L66 HydrophobicContact CD1-CB 3.93Å; L49-L66 HydrophobicContact CD2-CB 4.28Å; L49-A67 HydrophobicContact CB-CB 4.12Å; L49-A67 HydrophobicContact CD1-CB 3.95Å
50	F	85.6	Confident	82	Confident	29 Å²	29	28.2 Å²	28.2	13%	0.127	15%	0.146	C	C	.	.	H	α-helix	trans	-62.3	-40.8	176.6	-168.6	-97.1	0	0	0	111.2	Y46 R48 A53 Q54 K83 M87	Y46-F50 HydrophobicContact CE2-CB 4.44Å; Y46-F50 HydrophobicContact CE2-CD2 4.18Å; Y46-F50 AromaticContact CZ-CD2 3.96Å; Y46-F50 VanDerWaalsContact O-CB 3.29Å; Y46-F50 WeakPolarHBondContact O-CB 3.43Å; Y46-F50 PolarHBondContact O-N 3.5Å; Y46-F50 WeakPolarHBondContact OH-CD2 3.36Å; R48-F50 VanDerWaalsContact C-N 3.32Å; R48-F50 PolarHBondContact O-N 3.42Å; F50-A53 WeakPolarHBondContact O-CB 3.47Å; F50-A53 PolarHBondContact O-N 2.94Å; F50-Q54 HydrophobicContact CE1-CG 4.5Å; F50-Q54 WeakPolarHBondContact O-CG 3.34Å; F50-Q54 PolarHBondContact O-N 3.38Å; F50-K83 HydrophobicContact CE2-CB 3.9Å; F50-K83 HydrophobicContact CZ-CB 4.22Å; F50-M87 HydrophobicContact CD1-SD 4.22Å; F50-M87 HydrophobicContact CD2-SD 3.47Å; F50-M87 WeakPolarHBondContact CD2-SD 3.28Å; F50-M87 HydrophobicContact CE1-SD 3.89Å; F50-M87 HydrophobicContact CE2-CG 3.68Å; F50-M87 HydrophobicContact CE2-SD 3.05Å; F50-M87 WeakPolarHBondContact CE2-SD 3.45Å; F50-M87 HydrophobicContact CG-SD 4.04Å; F50-M87 HydrophobicContact CZ-CG 3.84Å; F50-M87 HydrophobicContact CZ-SD 3.28Å; F50-M87 WeakPolarHBondContact CZ-SD 3Å
51	F	85.5	Confident	82.2	Confident	19 Å²	19	29 Å²	29	8%	0.083	15%	0.151	C	C	.	.	H	α-helix	trans	-65.5	-45.2	176.1	-173.4	-98.7	0	0	0	112.8	Q47 R48 L49 A53 Q54 R55 L466 D467 I468 S471	Q47-F51 WeakPolarHBondContact O-CB 3.39Å; Q47-F51 PolarHBondContact O-N 3.4Å; R48-F51 WeakPolarHBondContact O-CB 3.24Å; R48-F51 PolarHBondContact O-N 3.19Å; L49-F51 VanDerWaalsContact C-N 3.31Å; L49-F51 PolarHBondContact O-N 2.84Å; F51-A53 VanDerWaalsContact C-N 3.3Å; F51-A53 PolarHBondContact O-N 2.97Å; F51-Q54 PolarHBondContact O-N 3.38Å; F51-Q54 VanDerWaalsContact O-N 3.17Å; F51-R55 HydrophobicContact CD1-CG 4.44Å; F51-R55 HydrophobicContact CE1-CG 3.98Å; F51-R55 HydrophobicContact CE2-CG 4.42Å; F51-R55 HydrophobicContact CZ-CG 3.95Å; F51-R55 PolarHBondContact O-N 3.04Å; F51-R55 VanDerWaalsContact O-N 3.17Å; F51-L466 WeakPolarHBondContact CD1-O 3.38Å; F51-D467 WeakPolarHBondContact CE1-O 3.49Å; F51-I468 HydrophobicContact CD1-CB 4.5Å; F51-S471 VanDerWaalsContact CZ-OG 3.3Å; F51-S471 WeakPolarHBondContact CZ-OG 3.05Å
52	I	86.2	Confident	82.7	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-44.1	174.9	-67.1	167.3	0	0	0	110.1	L33 Y36 R48 L49 Q54 R55 C56 L466	L33-I52 HydrophobicContact CD1-CD1 3.8Å; L33-I52 HydrophobicContact CD1-CG2 4.4Å; Y36-I52 HydrophobicContact CD1-CD1 4.32Å; Y36-I52 HydrophobicContact CE1-CD1 4.04Å; R48-I52 VanDerWaalsContact O-CG1 3.29Å; R48-I52 WeakPolarHBondContact O-CG1 3.32Å; R48-I52 PolarHBondContact O-N 3.05Å; L49-I52 PolarHBondContact O-N 3.11Å; I52-Q54 VanDerWaalsContact C-N 3.28Å; I52-Q54 PolarHBondContact O-N 3.07Å; I52-R55 PolarHBondContact O-N 3.43Å; I52-C56 WeakPolarHBondContact O-CB 3.28Å; I52-C56 PolarHBondContact O-N 2.93Å; I52-L466 HydrophobicContact CG1-CB 4.36Å
53	A	84.5	Confident	83.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.4	-38.5	176.9	0	0	0	0	0	112.2	L49 F50 F51 R60 A63 L64 M87	L49-A53 VanDerWaalsContact O-CB 3.29Å; L49-A53 WeakPolarHBondContact O-CB 3.19Å; L49-A53 PolarHBondContact O-N 3.24Å; F50-A53 WeakPolarHBondContact O-CB 3.47Å; F50-A53 PolarHBondContact O-N 2.94Å; F51-A53 VanDerWaalsContact C-N 3.3Å; F51-A53 PolarHBondContact O-N 2.97Å; A53-R60 HydrophobicContact CB-CG 3.92Å; A53-R60 WeakPolarHBondContact O-CD 3.34Å; A53-R60 VanDerWaalsContact O-CG 3.29Å; A53-R60 WeakPolarHBondContact O-CG 3.35Å; A53-R60 PolarHBondContact O-NE 2.95Å; A53-A63 HydrophobicContact CB-CB 4.13Å; A53-L64 HydrophobicContact CB-CD2 3.89Å; A53-L64 HydrophobicContact CB-CG 4Å; A53-M87 HydrophobicContact CB-CE 3.94Å
54	Q	83.9	Confident	83.5	Confident	70 Å²	70	24.8 Å²	24.8	33%	0.327	13%	0.127	S	C	.	.	H	α-helix	trans	-68.3	-39.2	177.5	-73.3	-179.5	-16.9	0	0	112.8	F50 F51 I52 M87	F50-Q54 HydrophobicContact CE1-CG 4.5Å; F50-Q54 WeakPolarHBondContact O-CG 3.34Å; F50-Q54 PolarHBondContact O-N 3.38Å; F51-Q54 PolarHBondContact O-N 3.38Å; F51-Q54 VanDerWaalsContact O-N 3.17Å; I52-Q54 VanDerWaalsContact C-N 3.28Å; I52-Q54 PolarHBondContact O-N 3.07Å; Q54-M87 HydrophobicContact CB-CE 4.21Å; Q54-M87 HydrophobicContact CG-CE 3.36Å; Q54-M87 HydrophobicContact CG-SD 3.89Å
55	R	80.4	Confident	83.7	Confident	13 Å²	13	29.3 Å²	29.3	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-89.4	-32.3	-171.6	-64.1	-61.6	-170	139.3	9.9	114.5	V25 F51 I52 L466 D472	V25-R55 PolarHBondContact N-O 2.84Å; F51-R55 HydrophobicContact CD1-CG 4.44Å; F51-R55 HydrophobicContact CE1-CG 3.98Å; F51-R55 HydrophobicContact CE2-CG 4.42Å; F51-R55 HydrophobicContact CZ-CG 3.95Å; F51-R55 PolarHBondContact O-N 3.04Å; F51-R55 VanDerWaalsContact O-N 3.17Å; I52-R55 PolarHBondContact O-N 3.43Å; R55-L466 HydrophobicContact CB-CD2 4.13Å; R55-D472 IonicContact NH2-OD1 3.78Å
56	C	80.8	Confident	83.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.			trans	-115.1	104.6	-173.6	-169.1	0	0	0	0	110.5	I52 S58 L59 R60 L466	I52-C56 WeakPolarHBondContact O-CB 3.28Å; I52-C56 PolarHBondContact O-N 2.93Å; C56-S58 PolarHBondContact SG-OG 2.87Å; C56-L59 HydrophobicContact CB-CB 4.4Å; C56-R60 WeakPolarHBondContact O-CB 3.24Å; C56-R60 PolarHBondContact O-N 2.96Å; C56-L466 HydrophobicContact CB-CD2 3.74Å
57	P	78.7	Confident	83.9	Confident	55 Å²	55	29 Å²	29	36%	0.357	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-37.5	178.9	23.2	-30.6	0	0	0	113.1	R60	P57-R60 VanDerWaalsContact O-CB 3.3Å; P57-R60 WeakPolarHBondContact O-CB 3.24Å; P57-R60 PolarHBondContact O-N 3.39Å
58	S	79.8	Confident	83.9	Confident	68 Å²	68	27.8 Å²	27.8	48%	0.476	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-40.3	-176.7	54.2	0	0	0	0	113.3	C56	C56-S58 PolarHBondContact SG-OG 2.87Å
59	L	82.2	Confident	83.8	Confident	21 Å²	21	30.9 Å²	30.9	11%	0.11	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.3	178.5	-64.5	176.1	0	0	0	113.4	C56 V61 I62 A63	C56-L59 HydrophobicContact CB-CB 4.4Å; L59-V61 PolarHBondContact O-N 3.49Å; L59-I62 PolarHBondContact O-N 3.19Å; L59-A63 WeakPolarHBondContact O-CB 3.42Å; L59-A63 PolarHBondContact O-N 3.39Å
60	R	82.7	Confident	83.7	Confident	34 Å²	34	32.4 Å²	32.4	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-45	-171.3	-167.1	167.5	-32.8	159.9	-2.4	113.1	A53 C56 P57 I62 A63 L64 Q91	A53-R60 HydrophobicContact CB-CG 3.92Å; A53-R60 WeakPolarHBondContact O-CD 3.34Å; A53-R60 VanDerWaalsContact O-CG 3.29Å; A53-R60 WeakPolarHBondContact O-CG 3.35Å; A53-R60 PolarHBondContact O-NE 2.95Å; C56-R60 WeakPolarHBondContact O-CB 3.24Å; C56-R60 PolarHBondContact O-N 2.96Å; P57-R60 VanDerWaalsContact O-CB 3.3Å; P57-R60 WeakPolarHBondContact O-CB 3.24Å; P57-R60 PolarHBondContact O-N 3.39Å; R60-I62 PolarHBondContact O-N 2.96Å; R60-A63 PolarHBondContact O-N 3.33Å; R60-L64 HydrophobicContact CG-CD1 3.75Å; R60-L64 HydrophobicContact CG-CG 4.32Å; R60-L64 WeakPolarHBondContact O-CB 3.23Å; R60-L64 VanDerWaalsContact O-CG 3.24Å; R60-L64 WeakPolarHBondContact O-CG 3.33Å; R60-L64 PolarHBondContact O-N 3.49Å; R60-Q91 VanDerWaalsContact CD-CD 3.44Å; R60-Q91 HydrophobicContact CG-CG 4.48Å; R60-Q91 VanDerWaalsContact CG-NE2 3.3Å
61	V	82.7	Confident	83.7	Confident	21 Å²	21	31 Å²	31	13%	0.127	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-44.5	-178.4	179.7	0	0	0	0	111.3	L59 R65 E160 A161	L59-V61 PolarHBondContact O-N 3.49Å; V61-R65 WeakPolarHBondContact O-CG 3.33Å; V61-R65 PolarHBondContact O-N 2.89Å; V61-R65 VanDerWaalsContact O-N 3.07Å; V61-E160 HydrophobicContact CG1-CB 4.46Å; V61-E160 HydrophobicContact CG2-CB 4.05Å; V61-A161 HydrophobicContact CG1-CB 4.06Å
62	I	84.7	Confident	83.6	Confident	86 Å²	86	33.3 Å²	33.3	44%	0.441	17%	0.167	S	C	.	.	H	α-helix	trans	-67.2	-44.3	179.5	-57.2	174.3	0	0	0	109.8	L33 L59 R60 L64 R65 L66	L33-I62 HydrophobicContact CD2-CB 4.49Å; L33-I62 HydrophobicContact CD2-CG2 4.16Å; L59-I62 PolarHBondContact O-N 3.19Å; R60-I62 PolarHBondContact O-N 2.96Å; I62-L64 PolarHBondContact O-N 3.37Å; I62-R65 PolarHBondContact O-N 3.44Å; I62-L66 HydrophobicContact CG2-CD1 4.34Å; I62-L66 WeakPolarHBondContact O-CG 3.5Å; I62-L66 PolarHBondContact O-N 2.82Å
63	A	85.6	Confident	83.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-45.8	178	0	0	0	0	0	112.2	L33 L49 A53 L59 R60 L66 A67	L33-A63 HydrophobicContact CD2-CB 3.73Å; L49-A63 HydrophobicContact CD2-CB 3.77Å; L49-A63 WeakPolarHBondContact CD2-O 3.43Å; A53-A63 HydrophobicContact CB-CB 4.13Å; L59-A63 WeakPolarHBondContact O-CB 3.42Å; L59-A63 PolarHBondContact O-N 3.39Å; R60-A63 PolarHBondContact O-N 3.33Å; A63-L66 PolarHBondContact O-N 2.86Å; A63-A67 WeakPolarHBondContact O-CB 3.38Å; A63-A67 PolarHBondContact O-N 3.4Å
64	L	85	Confident	82.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.5	-34.6	-180	-67.2	171.8	0	0	0	112.5	A53 R60 I62 A67 H68 I84 M87 L88	A53-L64 HydrophobicContact CB-CD2 3.89Å; A53-L64 HydrophobicContact CB-CG 4Å; R60-L64 HydrophobicContact CG-CD1 3.75Å; R60-L64 HydrophobicContact CG-CG 4.32Å; R60-L64 WeakPolarHBondContact O-CB 3.23Å; R60-L64 VanDerWaalsContact O-CG 3.24Å; R60-L64 WeakPolarHBondContact O-CG 3.33Å; R60-L64 PolarHBondContact O-N 3.49Å; I62-L64 PolarHBondContact O-N 3.37Å; L64-A67 PolarHBondContact O-N 2.96Å; L64-H68 VanDerWaalsContact O-CB 3.3Å; L64-H68 WeakPolarHBondContact O-CB 3.3Å; L64-H68 PolarHBondContact O-N 2.77Å; L64-I84 HydrophobicContact CB-CG2 4.41Å; L64-I84 HydrophobicContact CD2-CG2 4.13Å; L64-M87 HydrophobicContact CD1-CB 4.49Å; L64-M87 HydrophobicContact CD2-CB 4.42Å; L64-M87 HydrophobicContact CD2-SD 4.48Å; L64-L88 HydrophobicContact CB-CD2 4.22Å; L64-L88 HydrophobicContact CD1-CD2 3.45Å; L64-L88 VanDerWaalsContact CD1-CD2 3.45Å; L64-L88 HydrophobicContact CD1-CG 3.89Å; L64-L88 HydrophobicContact CG-CD2 4.47Å
65	R	85.7	Confident	82.5	Confident	99 Å²	99	42.1 Å²	42.1	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-61.6	-48.4	171.5	-75.5	177.5	-179.9	168.3	8.1	111.7	V61 I62 A67 H68 D69 E160 A161 L163	V61-R65 WeakPolarHBondContact O-CG 3.33Å; V61-R65 PolarHBondContact O-N 2.89Å; V61-R65 VanDerWaalsContact O-N 3.07Å; I62-R65 PolarHBondContact O-N 3.44Å; R65-A67 VanDerWaalsContact C-N 3.3Å; R65-A67 PolarHBondContact O-N 2.86Å; R65-H68 PolarHBondContact O-N 3.17Å; R65-D69 PolarHBondContact O-N 3.04Å; R65-E160 PolarHBondContact NH2-O 3Å; R65-A161 HydrophobicContact CG-CB 4.17Å; R65-A161 PolarHBondContact NE-O 3.06Å; R65-L163 HydrophobicContact CG-CD1 4.34Å
66	L	85.4	Confident	82.2	Confident	46 Å²	46	43.1 Å²	43.1	24%	0.241	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-36.2	176.9	-69.2	176.9	0	0	0	112.2	L33 I37 L49 I62 A63 Y70	L33-L66 HydrophobicContact CD2-CD1 4.12Å; L33-L66 HydrophobicContact CG-CD1 4.12Å; I37-L66 HydrophobicContact CD1-CD1 4Å; L49-L66 HydrophobicContact CD1-CB 3.93Å; L49-L66 HydrophobicContact CD2-CB 4.28Å; I62-L66 HydrophobicContact CG2-CD1 4.34Å; I62-L66 WeakPolarHBondContact O-CG 3.5Å; I62-L66 PolarHBondContact O-N 2.82Å; A63-L66 PolarHBondContact O-N 2.86Å; L66-Y70 WeakPolarHBondContact O-CB 3.29Å; L66-Y70 PolarHBondContact O-N 3.14Å
67	A	85.4	Confident	82.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-45.2	177.1	0	0	0	0	0	111	Y46 L49 A63 L64 R65 Y70 V71 I84	Y46-A67 HydrophobicContact CD2-CB 4.34Å; L49-A67 HydrophobicContact CB-CB 4.12Å; L49-A67 HydrophobicContact CD1-CB 3.95Å; A63-A67 WeakPolarHBondContact O-CB 3.38Å; A63-A67 PolarHBondContact O-N 3.4Å; L64-A67 PolarHBondContact O-N 2.96Å; R65-A67 VanDerWaalsContact C-N 3.3Å; R65-A67 PolarHBondContact O-N 2.86Å; A67-Y70 PolarHBondContact O-N 3.17Å; A67-V71 WeakPolarHBondContact O-CB 3.36Å; A67-V71 VanDerWaalsContact O-CG2 3.27Å; A67-V71 WeakPolarHBondContact O-CG2 3.47Å; A67-V71 PolarHBondContact O-N 3.43Å; A67-I84 HydrophobicContact CB-CD1 3.93Å; A67-I84 HydrophobicContact CB-CG1 4.44Å
68	H	84.9	Confident	82.1	Confident	11 Å²	11	42 Å²	42	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-46.4	176.3	167	-85.7	0	0	0	111.7	L64 R65 Y70 V71 K72 Y81 L163	L64-H68 VanDerWaalsContact O-CB 3.3Å; L64-H68 WeakPolarHBondContact O-CB 3.3Å; L64-H68 PolarHBondContact O-N 2.77Å; R65-H68 PolarHBondContact O-N 3.17Å; H68-Y70 VanDerWaalsContact C-N 3.32Å; H68-Y70 PolarHBondContact O-N 3.27Å; H68-V71 PolarHBondContact O-N 3.11Å; H68-K72 VanDerWaalsContact CE1-CD 3.49Å; H68-K72 WeakPolarHBondContact CE1-CD 3.23Å; H68-K72 PolarHBondContact CE1-NZ 3.16Å; H68-K72 VanDerWaalsContact CE1-NZ 3.31Å; H68-K72 WeakPolarHBondContact NE2-CE 3.36Å; H68-K72 PolarHBondContact NE2-NZ 3.17Å; H68-K72 PolarHBondContact O-N 2.91Å; H68-Y81 AromaticContact CD2-CE2 3.7Å; H68-Y81 AromaticContact NE2-CE2 3.89Å; H68-L163 HydrophobicContact CB-CD1 3.85Å
69	D	85	Confident	82.2	Confident	72 Å²	72	41.6 Å²	41.6	39%	0.385	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-38.5	179.7	-74.4	-0.8	0	0	0	112.1	R65 K73	R65-D69 PolarHBondContact O-N 3.04Å; D69-K73 WeakPolarHBondContact O-CB 3.42Å; D69-K73 WeakPolarHBondContact O-CD 3.24Å; D69-K73 VanDerWaalsContact O-CG 3.22Å; D69-K73 WeakPolarHBondContact O-CG 3.37Å; D69-K73 PolarHBondContact O-N 3.36Å; D69-K73 VanDerWaalsContact O-N 3.11Å
70	Y	83.9	Confident	82.1	Confident	31 Å²	31	40.7 Å²	40.7	12%	0.122	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-44.8	175.7	-177.8	-99.6	0	0	0	112.3	G42 Y45 L66 A67 H68 K72 K73 S74 T75	G42-Y70 VanDerWaalsContact C-OH 3.3Å; G42-Y70 WeakPolarHBondContact CA-OH 3.11Å; G42-Y70 PolarHBondContact N-OH 3.47Å; G42-Y70 WeakPolarHBondContact O-CE1 3.21Å; G42-Y70 PolarHBondContact O-OH 3.16Å; Y45-Y70 AromaticContact CD1-CD1 3.41Å; Y45-Y70 HydrophobicContact CD1-CD1 3.41Å; Y45-Y70 VanDerWaalsContact CD1-CD1 3.41Å; Y45-Y70 AromaticContact CD1-CD2 3.59Å; Y45-Y70 HydrophobicContact CD1-CD2 3.59Å; Y45-Y70 AromaticContact CD1-CE1 3.85Å; Y45-Y70 HydrophobicContact CD1-CE1 3.85Å; Y45-Y70 HydrophobicContact CD1-CE2 4.02Å; Y45-Y70 AromaticContact CD1-CG 3.26Å; Y45-Y70 HydrophobicContact CD1-CG 3.26Å; Y45-Y70 AromaticContact CD2-CD2 4Å; Y45-Y70 HydrophobicContact CD2-CD2 4Å; Y45-Y70 AromaticContact CD2-CE2 3.93Å; Y45-Y70 HydrophobicContact CD2-CE2 3.93Å; Y45-Y70 AromaticContact CE1-CD1 3.93Å; Y45-Y70 HydrophobicContact CE1-CD1 3.93Å; Y45-Y70 AromaticContact CE1-CD2 3.56Å; Y45-Y70 HydrophobicContact CE1-CD2 3.56Å; Y45-Y70 HydrophobicContact CE1-CE2 4.37Å; Y45-Y70 AromaticContact CE1-CG 3.29Å; Y45-Y70 HydrophobicContact CE1-CG 3.29Å; Y45-Y70 AromaticContact CE2-CD2 3.87Å; Y45-Y70 HydrophobicContact CE2-CD2 3.87Å; Y45-Y70 HydrophobicContact CE2-CE2 4.19Å; Y45-Y70 HydrophobicContact CE2-CG 4.45Å; Y45-Y70 HydrophobicContact CG-CD1 4.03Å; Y45-Y70 AromaticContact CG-CD2 3.86Å; Y45-Y70 HydrophobicContact CG-CD2 3.86Å; Y45-Y70 AromaticContact CG-CE1 3.99Å; Y45-Y70 HydrophobicContact CG-CE1 3.99Å; Y45-Y70 AromaticContact CG-CE2 3.83Å; Y45-Y70 HydrophobicContact CG-CE2 3.83Å; Y45-Y70 AromaticContact CG-CG 3.95Å; Y45-Y70 HydrophobicContact CG-CG 3.95Å; Y45-Y70 AromaticContact CG-CZ 3.89Å; Y45-Y70 AromaticContact CZ-CD2 3.71Å; Y45-Y70 AromaticContact CZ-CG 3.94Å; L66-Y70 WeakPolarHBondContact O-CB 3.29Å; L66-Y70 PolarHBondContact O-N 3.14Å; A67-Y70 PolarHBondContact O-N 3.17Å; H68-Y70 VanDerWaalsContact C-N 3.32Å; H68-Y70 PolarHBondContact O-N 3.27Å; Y70-K72 VanDerWaalsContact C-N 3.27Å; Y70-K72 PolarHBondContact O-N 3.05Å; Y70-K73 PolarHBondContact O-N 3.49Å; Y70-S74 PolarHBondContact O-N 2.9Å; Y70-T75 HydrophobicContact CD1-CG2 4.32Å; Y70-T75 HydrophobicContact CE1-CG2 3.85Å
71	V	83.7	Confident	82.1	Confident	1 Å²	1	39 Å²	39	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-41.6	178.7	167.1	0	0	0	0	110.5	Y46 A67 H68 T75 A80 Y81 I84 W169	Y46-V71 HydrophobicContact CD2-CG2 3.83Å; Y46-V71 HydrophobicContact CE2-CG2 4.35Å; Y46-V71 HydrophobicContact CG-CG2 4.42Å; A67-V71 WeakPolarHBondContact O-CB 3.36Å; A67-V71 VanDerWaalsContact O-CG2 3.27Å; A67-V71 WeakPolarHBondContact O-CG2 3.47Å; A67-V71 PolarHBondContact O-N 3.43Å; H68-V71 PolarHBondContact O-N 3.11Å; V71-T75 VanDerWaalsContact CA-OG1 3.22Å; V71-T75 WeakPolarHBondContact CA-OG1 3.3Å; V71-T75 PolarHBondContact O-N 2.78Å; V71-T75 PolarHBondContact O-OG1 2.89Å; V71-A80 HydrophobicContact CG2-CB 4.26Å; V71-Y81 HydrophobicContact CG1-CD2 4.3Å; V71-I84 HydrophobicContact CG2-CD1 4Å; V71-W169 HydrophobicContact CG1-CH2 4.07Å
72	K	83.3	Confident	82	Confident	66 Å²	66	40.3 Å²	40.3	29%	0.287	21%	0.206	S	C	.	.	H	α-helix	trans	-67.8	-34.8	176.6	-79.9	-168.7	169.5	164.2	0	114.5	H68 Y70 W169	H68-K72 VanDerWaalsContact CE1-CD 3.49Å; H68-K72 WeakPolarHBondContact CE1-CD 3.23Å; H68-K72 PolarHBondContact CE1-NZ 3.16Å; H68-K72 VanDerWaalsContact CE1-NZ 3.31Å; H68-K72 WeakPolarHBondContact NE2-CE 3.36Å; H68-K72 PolarHBondContact NE2-NZ 3.17Å; H68-K72 PolarHBondContact O-N 2.91Å; Y70-K72 VanDerWaalsContact C-N 3.27Å; Y70-K72 PolarHBondContact O-N 3.05Å; K72-W169 HydrophobicContact CB-CZ2 4.25Å; K72-W169 HydrophobicContact CG-CD2 4.26Å; K72-W169 HydrophobicContact CG-CH2 4.21Å; K72-W169 HydrophobicContact CG-CZ2 3.92Å; K72-W169 HydrophobicContact CG-CZ3 4.49Å
73	K	82.9	Confident	81.8	Confident	169 Å²	169	38.9 Å²	38.9	74%	0.735	20%	0.196	S	C	*	.	H	α-helix	trans	-84.6	-38	-176.1	-74.7	173	-176.6	172	0	113.5	D69 Y70	D69-K73 WeakPolarHBondContact O-CB 3.42Å; D69-K73 WeakPolarHBondContact O-CD 3.24Å; D69-K73 VanDerWaalsContact O-CG 3.22Å; D69-K73 WeakPolarHBondContact O-CG 3.37Å; D69-K73 PolarHBondContact O-N 3.36Å; D69-K73 VanDerWaalsContact O-N 3.11Å; Y70-K73 PolarHBondContact O-N 3.49Å
74	S	73.6	Confident	81.6	Confident	70 Å²	70	38.9 Å²	38.9	49%	0.49	20%	0.196	S	C	.	.	H	α-helix	trans	-127.1	-13.6	-159.6	-61.4	0	0	0	0	115.2	Y70	Y70-S74 PolarHBondContact O-N 2.9Å
75	T	75.2	Confident	81.3	Confident	22 Å²	22	39.3 Å²	39.3	14%	0.135	20%	0.199	C	C	.	.			trans	-122.9	156	-176.8	68	0	0	0	0	112	Y70 V71	Y70-T75 HydrophobicContact CD1-CG2 4.32Å; Y70-T75 HydrophobicContact CE1-CG2 3.85Å; V71-T75 VanDerWaalsContact CA-OG1 3.22Å; V71-T75 WeakPolarHBondContact CA-OG1 3.3Å; V71-T75 PolarHBondContact O-N 2.78Å; V71-T75 PolarHBondContact O-OG1 2.89Å
76	L	75.5	Confident	80.9	Confident	33 Å²	33	37.5 Å²	37.5	17%	0.173	20%	0.196	C	C	.	.			trans	-104.7	15.9	174.5	-64.6	167.6	0	0	0	111.2	S78 T173 L180 L210 Q213 L214	L76-S78 PolarHBondContact O-N 3.21Å; L76-T173 HydrophobicContact CB-CG2 4.23Å; L76-T173 HydrophobicContact CD2-CG2 3.95Å; L76-L180 HydrophobicContact CD1-CD1 3.76Å; L76-L210 HydrophobicContact CD1-CD1 4.04Å; L76-Q213 PolarHBondContact N-O 2.8Å; L76-L214 HydrophobicContact CB-CD2 3.84Å
77	D	78.8	Confident	80.4	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.059	19%	0.185	C	C	.	.			trans	-85.1	101.2	-172.3	-172.4	-3.8	0	0	0	111.6	S79 A80 Y81 Q213	D77-S79 VanDerWaalsContact C-N 3.3Å; D77-S79 VanDerWaalsContact OD1-CA 3.32Å; D77-S79 WeakPolarHBondContact OD1-CA 3.29Å; D77-S79 WeakPolarHBondContact OD1-CB 3.44Å; D77-S79 PolarHBondContact OD1-N 3.41Å; D77-A80 HydrophobicContact CB-CB 3.97Å; D77-A80 PolarHBondContact OD1-N 3.2Å; D77-A80 VanDerWaalsContact OD2-CB 3.22Å; D77-A80 WeakPolarHBondContact OD2-CB 3.32Å; D77-Y81 PolarHBondContact O-N 2.97Å; D77-Q213 PolarHBondContact N-O 3.38Å
78	S	78.3	Confident	80	Confident	21 Å²	21	35.5 Å²	35.5	15%	0.147	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-29.5	171.4	-55.4	0	0	0	0	112.5	L76 Y81 N82	L76-S78 PolarHBondContact O-N 3.21Å; S78-Y81 PolarHBondContact O-N 3.32Å; S78-N82 VanDerWaalsContact O-CG 3.3Å; S78-N82 PolarHBondContact O-N 2.91Å; S78-N82 VanDerWaalsContact O-N 3.11Å; S78-N82 PolarHBondContact O-ND2 3.31Å
79	S	81.6	Confident	79.3	Confident	60 Å²	60	35.1 Å²	35.1	42%	0.42	18%	0.184	S	C	.	.	H	α-helix	trans	-69.6	-44.7	-179.6	-169.8	0	0	0	0	111.3	D77 Y81 N82 K83	D77-S79 VanDerWaalsContact C-N 3.3Å; D77-S79 VanDerWaalsContact OD1-CA 3.32Å; D77-S79 WeakPolarHBondContact OD1-CA 3.29Å; D77-S79 WeakPolarHBondContact OD1-CB 3.44Å; D77-S79 PolarHBondContact OD1-N 3.41Å; S79-Y81 VanDerWaalsContact C-N 3.31Å; S79-Y81 PolarHBondContact O-N 3.36Å; S79-N82 PolarHBondContact O-N 3.43Å; S79-K83 VanDerWaalsContact O-CG 3.3Å; S79-K83 WeakPolarHBondContact O-CG 3.47Å; S79-K83 PolarHBondContact O-N 3.15Å
80	A	80.2	Confident	78.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-58.6	-43.3	174.3	0	0	0	0	0	112	Y46 V71 D77 N82 K83 I84	Y46-A80 HydrophobicContact CD1-CB 4.16Å; Y46-A80 HydrophobicContact CD2-CB 4.32Å; Y46-A80 HydrophobicContact CE1-CB 3.66Å; Y46-A80 HydrophobicContact CE2-CB 3.84Å; Y46-A80 HydrophobicContact CG-CB 4.47Å; Y46-A80 VanDerWaalsContact CZ-CB 3.49Å; Y46-A80 PolarHBondContact OH-O 3.34Å; V71-A80 HydrophobicContact CG2-CB 4.26Å; D77-A80 HydrophobicContact CB-CB 3.97Å; D77-A80 PolarHBondContact OD1-N 3.2Å; D77-A80 VanDerWaalsContact OD2-CB 3.22Å; D77-A80 WeakPolarHBondContact OD2-CB 3.32Å; A80-N82 PolarHBondContact O-N 2.6Å; A80-K83 PolarHBondContact O-N 2.96Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 2.88Å
81	Y	82.4	Confident	77.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57	-49.4	175.8	-172.6	-104.3	0	0	0	111.5	H68 V71 D77 S78 S79 K83 I84 F85 Y165 D166 W169	H68-Y81 AromaticContact CD2-CE2 3.7Å; H68-Y81 AromaticContact NE2-CE2 3.89Å; V71-Y81 HydrophobicContact CG1-CD2 4.3Å; D77-Y81 PolarHBondContact O-N 2.97Å; S78-Y81 PolarHBondContact O-N 3.32Å; S79-Y81 VanDerWaalsContact C-N 3.31Å; S79-Y81 PolarHBondContact O-N 3.36Å; Y81-K83 VanDerWaalsContact C-N 3.33Å; Y81-K83 PolarHBondContact O-N 2.96Å; Y81-I84 WeakPolarHBondContact O-CB 3.37Å; Y81-I84 PolarHBondContact O-N 3.37Å; Y81-F85 HydrophobicContact CD1-CD2 4.24Å; Y81-F85 HydrophobicContact CD1-CE2 4.11Å; Y81-F85 HydrophobicContact CD2-CE2 4.05Å; Y81-F85 HydrophobicContact CE1-CD2 4.04Å; Y81-F85 AromaticContact CE1-CE2 3.59Å; Y81-F85 HydrophobicContact CE1-CE2 3.59Å; Y81-F85 HydrophobicContact CE1-CZ 4.48Å; Y81-F85 HydrophobicContact CE2-CD2 4.45Å; Y81-F85 AromaticContact CE2-CE2 3.51Å; Y81-F85 HydrophobicContact CE2-CE2 3.51Å; Y81-F85 HydrophobicContact CE2-CZ 4.28Å; Y81-F85 HydrophobicContact CG-CE2 4.33Å; Y81-F85 AromaticContact CZ-CE2 3.27Å; Y81-F85 AromaticContact CZ-CZ 3.92Å; Y81-F85 WeakPolarHBondContact O-CD2 3.34Å; Y81-F85 PolarHBondContact O-N 2.85Å; Y81-Y165 HydrophobicContact CD1-CD2 4.4Å; Y81-Y165 AromaticContact CD1-CE2 3.88Å; Y81-Y165 HydrophobicContact CD1-CE2 3.88Å; Y81-Y165 AromaticContact CE1-CD2 3.68Å; Y81-Y165 HydrophobicContact CE1-CD2 3.68Å; Y81-Y165 AromaticContact CE1-CE2 3.52Å; Y81-Y165 HydrophobicContact CE1-CE2 3.52Å; Y81-Y165 HydrophobicContact CE1-CG 4.41Å; Y81-D166 PolarHBondContact OH-N 3.28Å; Y81-W169 HydrophobicContact CD1-CE3 4.5Å; Y81-W169 HydrophobicContact CD1-CZ3 4.23Å; Y81-W169 HydrophobicContact CD2-CE3 4.15Å; Y81-W169 HydrophobicContact CD2-CH2 4.38Å; Y81-W169 AromaticContact CD2-CZ3 3.58Å; Y81-W169 HydrophobicContact CD2-CZ3 3.58Å; Y81-W169 HydrophobicContact CE1-CE3 4.39Å; Y81-W169 HydrophobicContact CE2-CE3 4.04Å; Y81-W169 AromaticContact CE2-CZ3 3.94Å; Y81-W169 HydrophobicContact CE2-CZ3 3.94Å; Y81-W169 HydrophobicContact CG-CE3 4.36Å; Y81-W169 AromaticContact CG-CZ3 3.72Å; Y81-W169 HydrophobicContact CG-CZ3 3.72Å
82	N	80.9	Confident	76.7	Confident	47 Å²	47	34.9 Å²	34.9	25%	0.251	18%	0.184	S	C	.	.	H	α-helix	trans	-63.8	-38.2	178.7	-67.1	-19.9	0	0	0	112.5	S78 S79 A80 I84 F85 L86 Y165 E170	S78-N82 VanDerWaalsContact O-CG 3.3Å; S78-N82 PolarHBondContact O-N 2.91Å; S78-N82 VanDerWaalsContact O-N 3.11Å; S78-N82 PolarHBondContact O-ND2 3.31Å; S79-N82 PolarHBondContact O-N 3.43Å; A80-N82 PolarHBondContact O-N 2.6Å; N82-I84 VanDerWaalsContact C-N 3.33Å; N82-I84 PolarHBondContact O-N 2.89Å; N82-F85 PolarHBondContact O-N 3.45Å; N82-L86 VanDerWaalsContact O-CG 3.32Å; N82-L86 WeakPolarHBondContact O-CG 3.44Å; N82-L86 PolarHBondContact O-N 3.22Å; N82-Y165 WeakPolarHBondContact OD1-CE2 3.31Å; N82-Y165 PolarHBondContact OD1-OH 3.14Å; N82-E170 PolarHBondContact ND2-OE1 2.91Å; N82-E170 PolarHBondContact OD1-OE1 3.45Å
83	K	81	Confident	75.4	Confident	56 Å²	56	34 Å²	34	24%	0.243	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-38.3	175.7	-73.1	174.8	-174.5	-175.6	0	112.6	F50 S79 A80 Y81 L86 M87	F50-K83 HydrophobicContact CE2-CB 3.9Å; F50-K83 HydrophobicContact CZ-CB 4.22Å; S79-K83 VanDerWaalsContact O-CG 3.3Å; S79-K83 WeakPolarHBondContact O-CG 3.47Å; S79-K83 PolarHBondContact O-N 3.15Å; A80-K83 PolarHBondContact O-N 2.96Å; Y81-K83 VanDerWaalsContact C-N 3.33Å; Y81-K83 PolarHBondContact O-N 2.96Å; K83-L86 PolarHBondContact O-N 3.44Å; K83-M87 PolarHBondContact O-N 2.97Å
84	I	81	Confident	74	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-47.5	176.3	-67.8	166	0	0	0	110.7	Y46 L64 A67 V71 A80 Y81 N82 M87 L88	Y46-I84 HydrophobicContact CD2-CD1 4.33Å; Y46-I84 HydrophobicContact CE2-CD1 3.83Å; Y46-I84 HydrophobicContact CE2-CG1 3.82Å; L64-I84 HydrophobicContact CB-CG2 4.41Å; L64-I84 HydrophobicContact CD2-CG2 4.13Å; A67-I84 HydrophobicContact CB-CD1 3.93Å; A67-I84 HydrophobicContact CB-CG1 4.44Å; V71-I84 HydrophobicContact CG2-CD1 4Å; A80-I84 WeakPolarHBondContact O-CG1 3.49Å; A80-I84 PolarHBondContact O-N 2.88Å; Y81-I84 WeakPolarHBondContact O-CB 3.37Å; Y81-I84 PolarHBondContact O-N 3.37Å; N82-I84 VanDerWaalsContact C-N 3.33Å; N82-I84 PolarHBondContact O-N 2.89Å; I84-M87 PolarHBondContact O-N 3.37Å; I84-L88 HydrophobicContact CG2-CD1 4.38Å; I84-L88 WeakPolarHBondContact O-CG 3.49Å; I84-L88 PolarHBondContact O-N 3.21Å
85	F	78.6	Confident	72.9	Confident	10 Å²	10	31.9 Å²	31.9	4%	0.044	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-34.3	179.4	-75.8	-84.9	0	0	0	112.9	Y81 N82 M87 L88 A89 L163 Y165	Y81-F85 HydrophobicContact CD1-CD2 4.24Å; Y81-F85 HydrophobicContact CD1-CE2 4.11Å; Y81-F85 HydrophobicContact CD2-CE2 4.05Å; Y81-F85 HydrophobicContact CE1-CD2 4.04Å; Y81-F85 AromaticContact CE1-CE2 3.59Å; Y81-F85 HydrophobicContact CE1-CE2 3.59Å; Y81-F85 HydrophobicContact CE1-CZ 4.48Å; Y81-F85 HydrophobicContact CE2-CD2 4.45Å; Y81-F85 AromaticContact CE2-CE2 3.51Å; Y81-F85 HydrophobicContact CE2-CE2 3.51Å; Y81-F85 HydrophobicContact CE2-CZ 4.28Å; Y81-F85 HydrophobicContact CG-CE2 4.33Å; Y81-F85 AromaticContact CZ-CE2 3.27Å; Y81-F85 AromaticContact CZ-CZ 3.92Å; Y81-F85 WeakPolarHBondContact O-CD2 3.34Å; Y81-F85 PolarHBondContact O-N 2.85Å; N82-F85 PolarHBondContact O-N 3.45Å; F85-M87 VanDerWaalsContact C-N 3.34Å; F85-L88 HydrophobicContact CD1-CD1 4.21Å; F85-L88 HydrophobicContact CE1-CD1 4.49Å; F85-L88 PolarHBondContact O-N 2.89Å; F85-A89 PolarHBondContact O-N 2.95Å; F85-L163 HydrophobicContact CE1-CB 4.23Å; F85-L163 HydrophobicContact CZ-CB 4.36Å; F85-Y165 HydrophobicContact CB-CD2 4.34Å; F85-Y165 HydrophobicContact CD1-CD2 4.06Å; F85-Y165 AromaticContact CD2-CD2 3.55Å; F85-Y165 HydrophobicContact CD2-CD2 3.55Å; F85-Y165 HydrophobicContact CD2-CE2 4.04Å; F85-Y165 HydrophobicContact CE1-CD2 4.24Å; F85-Y165 AromaticContact CE2-CD2 3.81Å; F85-Y165 HydrophobicContact CE2-CD2 3.81Å; F85-Y165 AromaticContact CG-CD2 3.7Å; F85-Y165 HydrophobicContact CG-CD2 3.7Å; F85-Y165 HydrophobicContact CG-CE2 4.38Å; F85-Y165 HydrophobicContact CZ-CD2 4.13Å
86	L	78	Confident	71.6	Confident	60 Å²	60	34.7 Å²	34.7	31%	0.314	19%	0.191	S	C	.	.	H	α-helix	trans	-62	-42.3	172.2	-72.6	171.4	0	0	0	111.5	N82 K83 A89 E90 L151	N82-L86 VanDerWaalsContact O-CG 3.32Å; N82-L86 WeakPolarHBondContact O-CG 3.44Å; N82-L86 PolarHBondContact O-N 3.22Å; K83-L86 PolarHBondContact O-N 3.44Å; L86-A89 WeakPolarHBondContact O-CB 3.47Å; L86-A89 PolarHBondContact O-N 3.46Å; L86-E90 PolarHBondContact O-N 3.41Å; L86-L151 HydrophobicContact CD2-CD1 4.03Å
87	M	75.1	Confident	69.8	Low	3 Å²	3	34.6 Å²	34.6	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-36.7	174.5	-81.4	-163.2	71	0	0	113.3	F50 A53 Q54 L64 K83 I84 F85 A89 E90 Q91	F50-M87 HydrophobicContact CD1-SD 4.22Å; F50-M87 HydrophobicContact CD2-SD 3.47Å; F50-M87 WeakPolarHBondContact CD2-SD 3.28Å; F50-M87 HydrophobicContact CE1-SD 3.89Å; F50-M87 HydrophobicContact CE2-CG 3.68Å; F50-M87 HydrophobicContact CE2-SD 3.05Å; F50-M87 WeakPolarHBondContact CE2-SD 3.45Å; F50-M87 HydrophobicContact CG-SD 4.04Å; F50-M87 HydrophobicContact CZ-CG 3.84Å; F50-M87 HydrophobicContact CZ-SD 3.28Å; F50-M87 WeakPolarHBondContact CZ-SD 3Å; A53-M87 HydrophobicContact CB-CE 3.94Å; Q54-M87 HydrophobicContact CB-CE 4.21Å; Q54-M87 HydrophobicContact CG-CE 3.36Å; Q54-M87 HydrophobicContact CG-SD 3.89Å; L64-M87 HydrophobicContact CD1-CB 4.49Å; L64-M87 HydrophobicContact CD2-CB 4.42Å; L64-M87 HydrophobicContact CD2-SD 4.48Å; K83-M87 PolarHBondContact O-N 2.97Å; I84-M87 PolarHBondContact O-N 3.37Å; F85-M87 VanDerWaalsContact C-N 3.34Å; M87-A89 VanDerWaalsContact C-N 3.28Å; M87-A89 PolarHBondContact O-N 3.3Å; M87-E90 WeakPolarHBondContact O-CB 3.47Å; M87-E90 PolarHBondContact O-N 3.49Å; M87-Q91 PolarHBondContact O-N 2.98Å
88	L	75.7	Confident	67.8	Low	2 Å²	2	40.7 Å²	40.7	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-37.9	172.9	-71.7	170.5	0	0	0	111.2	L64 I84 F85 E90 Q91 T92 V154 A161 L163	L64-L88 HydrophobicContact CB-CD2 4.22Å; L64-L88 HydrophobicContact CD1-CD2 3.45Å; L64-L88 VanDerWaalsContact CD1-CD2 3.45Å; L64-L88 HydrophobicContact CD1-CG 3.89Å; L64-L88 HydrophobicContact CG-CD2 4.47Å; I84-L88 HydrophobicContact CG2-CD1 4.38Å; I84-L88 WeakPolarHBondContact O-CG 3.49Å; I84-L88 PolarHBondContact O-N 3.21Å; F85-L88 HydrophobicContact CD1-CD1 4.21Å; F85-L88 HydrophobicContact CE1-CD1 4.49Å; F85-L88 PolarHBondContact O-N 2.89Å; L88-E90 VanDerWaalsContact C-N 3.32Å; L88-E90 PolarHBondContact O-N 3.17Å; L88-Q91 WeakPolarHBondContact O-CB 3.48Å; L88-Q91 PolarHBondContact O-N 3.28Å; L88-T92 PolarHBondContact O-N 3.4Å; L88-V154 HydrophobicContact CB-CG1 3.88Å; L88-A161 HydrophobicContact CD1-CB 4.48Å; L88-A161 HydrophobicContact CD2-CB 3.88Å; L88-L163 HydrophobicContact CD1-CD1 4.17Å
89	A	71.6	Confident	66.4	Low	3 Å²	3	44.4 Å²	44.4	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-29.4	177.4	0	0	0	0	0	113.4	F85 L86 M87 Q91 T92 N93 V154	F85-A89 PolarHBondContact O-N 2.95Å; L86-A89 WeakPolarHBondContact O-CB 3.47Å; L86-A89 PolarHBondContact O-N 3.46Å; M87-A89 VanDerWaalsContact C-N 3.28Å; M87-A89 PolarHBondContact O-N 3.3Å; A89-Q91 VanDerWaalsContact C-N 3.33Å; A89-T92 PolarHBondContact O-OG1 3.48Å; A89-N93 PolarHBondContact O-N 2.97Å; A89-V154 HydrophobicContact CB-CB 4.38Å; A89-V154 HydrophobicContact CB-CG1 4.17Å; A89-V154 HydrophobicContact CB-CG2 4.08Å
90	E	72.2	Confident	64.4	Low	35 Å²	35	44.1 Å²	44.1	16%	0.164	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-36.7	171.9	-70.5	179.9	145.4	0	0	112.4	L86 M87 L88 T92 N93 F94 F114 L118	L86-E90 PolarHBondContact O-N 3.41Å; M87-E90 WeakPolarHBondContact O-CB 3.47Å; M87-E90 PolarHBondContact O-N 3.49Å; L88-E90 VanDerWaalsContact C-N 3.32Å; L88-E90 PolarHBondContact O-N 3.17Å; E90-T92 PolarHBondContact O-N 3.24Å; E90-N93 WeakPolarHBondContact O-CB 3.33Å; E90-N93 PolarHBondContact O-N 3.12Å; E90-F94 PolarHBondContact O-N 3.33Å; E90-F114 HydrophobicContact CG-CD1 3.61Å; E90-F114 HydrophobicContact CG-CE1 3.06Å; E90-F114 HydrophobicContact CG-CZ 3.69Å; E90-F114 WeakPolarHBondContact OE1-CD1 3.29Å; E90-F114 WeakPolarHBondContact OE1-CE1 3.38Å; E90-L118 WeakPolarHBondContact OE1-CD1 3.49Å
91	Q	64.9	Low	62.2	Low	31 Å²	31	49.3 Å²	49.3	15%	0.145	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-44.7	178.9	-64.3	-170.3	-77.8	0	0	111.8	R60 M87 L88 A89 N93 F94 S95	R60-Q91 VanDerWaalsContact CD-CD 3.44Å; R60-Q91 HydrophobicContact CG-CG 4.48Å; R60-Q91 VanDerWaalsContact CG-NE2 3.3Å; M87-Q91 PolarHBondContact O-N 2.98Å; L88-Q91 WeakPolarHBondContact O-CB 3.48Å; L88-Q91 PolarHBondContact O-N 3.28Å; A89-Q91 VanDerWaalsContact C-N 3.33Å; Q91-N93 PolarHBondContact O-N 2.88Å; Q91-F94 WeakPolarHBondContact O-CB 3.48Å; Q91-F94 PolarHBondContact O-N 3.34Å; Q91-S95 PolarHBondContact O-N 3.48Å
92	T	60.2	Low	59.8	Low	32 Å²	32	52.9 Å²	52.9	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-28.5	179.7	47.6	0	0	0	0	112.4	L88 A89 E90 S95 V96 I150 V154	L88-T92 PolarHBondContact O-N 3.4Å; A89-T92 PolarHBondContact O-OG1 3.48Å; E90-T92 PolarHBondContact O-N 3.24Å; T92-S95 PolarHBondContact O-OG 3.1Å; T92-V96 WeakPolarHBondContact O-CG2 3.47Å; T92-V96 PolarHBondContact O-N 3.38Å; T92-I150 WeakPolarHBondContact OG1-CG2 3.42Å; T92-V154 HydrophobicContact CG2-CG2 3.91Å; T92-V154 WeakPolarHBondContact OG1-CG2 3.37Å
93	N	56.6	Low	57.9	Low	49 Å²	49	54 Å²	54	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-68.3	-35.5	172.2	-85.5	-31.5	0	0	0	112.2	A89 E90 Q91 A97 I150	A89-N93 PolarHBondContact O-N 2.97Å; E90-N93 WeakPolarHBondContact O-CB 3.33Å; E90-N93 PolarHBondContact O-N 3.12Å; Q91-N93 PolarHBondContact O-N 2.88Å; N93-A97 WeakPolarHBondContact O-CB 3.27Å; N93-A97 PolarHBondContact O-N 3.38Å; N93-A97 VanDerWaalsContact O-N 3.17Å; N93-I150 WeakPolarHBondContact OD1-CD1 3.39Å
94	F	51.7	Low	56.1	Low	121 Å²	121	59 Å²	59	53%	0.531	35%	0.354	S	S	.	.	H	α-helix	trans	-68.2	-42.2	177.3	-100.6	-89.5	0	0	0	112.2	E90 Q91 V96 A97 D98	E90-F94 PolarHBondContact O-N 3.33Å; Q91-F94 WeakPolarHBondContact O-CB 3.48Å; Q91-F94 PolarHBondContact O-N 3.34Å; F94-V96 VanDerWaalsContact C-N 3.34Å; F94-V96 PolarHBondContact O-N 3.21Å; F94-A97 PolarHBondContact O-N 3.24Å; F94-D98 PolarHBondContact O-N 3.37Å
95	S	51.1	Low	54.3	Low	72 Å²	72	64.1 Å²	64.1	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-32.1	179	59	0	0	0	0	113.7	Q91 T92	Q91-S95 PolarHBondContact O-N 3.48Å; T92-S95 PolarHBondContact O-OG 3.1Å
96	V	47.5	Very low	52.5	Low	82 Å²	82	66.2 Å²	66.2	50%	0.497	40%	0.402	S	S	.	.	H	α-helix	trans	-78	-29.6	177.4	177.4	0	0	0	0	111.3	T92 F94 D98 S99	T92-V96 WeakPolarHBondContact O-CG2 3.47Å; T92-V96 PolarHBondContact O-N 3.38Å; F94-V96 VanDerWaalsContact C-N 3.34Å; F94-V96 PolarHBondContact O-N 3.21Å; V96-D98 PolarHBondContact O-N 3.01Å; V96-S99 PolarHBondContact O-N 2.94Å; V96-S99 PolarHBondContact O-OG 3.49Å
97	A	39.5	Very low	50.5	Low	30 Å²	30	67.4 Å²	67.4	25%	0.248	40%	0.402	C	S	.	.	H	α-helix	trans	-68	-33	178.6	0	0	0	0	0	112.9	N93 F94 S99 S100 R107	N93-A97 WeakPolarHBondContact O-CB 3.27Å; N93-A97 PolarHBondContact O-N 3.38Å; N93-A97 VanDerWaalsContact O-N 3.17Å; F94-A97 PolarHBondContact O-N 3.24Å; A97-S99 PolarHBondContact O-N 2.8Å; A97-S100 PolarHBondContact O-N 3.24Å; A97-R107 PolarHBondContact O-NH2 3.38Å
98	D	36.8	Very low	48.9	Very low	140 Å²	140	74 Å²	74	75%	0.749	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.5	178.6	-75.6	-19.8	0	0	0	113.6	F94 V96	F94-D98 PolarHBondContact O-N 3.37Å; V96-D98 PolarHBondContact O-N 3.01Å
99	S	47.5	Very low	47.1	Very low	98 Å²	98	80.6 Å²	80.6	69%	0.685	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-8	-179	40	0	0	0	0	114.6	V96 A97	V96-S99 PolarHBondContact O-N 2.94Å; V96-S99 PolarHBondContact O-OG 3.49Å; A97-S99 PolarHBondContact O-N 2.8Å
100	S	39.1	Very low	45.5	Very low	55 Å²	55	86.6 Å²	86.6	39%	0.385	49%	0.491	S	S	.	.			trans	-125.8	105.3	178.6	61.1	0	0	0	0	112.4	A97 S102 R107	A97-S100 PolarHBondContact O-N 3.24Å; S100-S102 PolarHBondContact O-N 3.18Å; S100-R107 PolarHBondContact O-NH2 2.91Å
101	A	34.4	Very low	43.8	Very low	110 Å²	110	89.4 Å²	89.4	91%	0.909	50%	0.504	S	S	*	.			trans	-78.1	49.8	-179.1	0	0	0	0	0	114
102	S	33.2	Very low	42.5	Very low	75 Å²	75	90.7 Å²	90.7	52%	0.524	52%	0.517	S	S	.	.			trans	-120.4	117.8	-179.9	44	0	0	0	0	113.2	S100	S100-S102 PolarHBondContact O-N 3.18Å
103	S	41.2	Very low	41.4	Very low	69 Å²	69	91.3 Å²	91.3	48%	0.483	53%	0.526	S	S	.	.			trans	55	95.4	164.2	50.1	0	0	0	0	118.1	T105 S106 R107	S103-T105 PolarHBondContact O-N 3.47Å; S103-S106 PolarHBondContact O-N 3.21Å; S103-S106 VanDerWaalsContact O-N 3.16Å; S103-R107 PolarHBondContact O-N 2.86Å
104	E	41.8	Very low	40.3	Very low	161 Å²	161	91.1 Å²	91.1	75%	0.752	52%	0.522	S	S	*	.	H	α-helix	trans	-53.7	-31.6	172.2	-77.4	167.2	141.9	0	0	114	S106 R107 Q108	E104-S106 PolarHBondContact O-N 2.99Å; E104-R107 WeakPolarHBondContact O-CB 3.31Å; E104-R107 PolarHBondContact O-N 3.5Å; E104-Q108 PolarHBondContact O-N 2.81Å
105	T	43.2	Very low	39.5	Very low	109 Å²	109	88.4 Å²	88.4	67%	0.669	52%	0.519	S	S	*	.	H	α-helix	trans	-69.6	-34.4	-179.2	-27.4	0	0	0	0	112.2	S103 Q109	S103-T105 PolarHBondContact O-N 3.47Å; T105-Q109 PolarHBondContact O-N 3.48Å
106	S	40.7	Very low	38.5	Very low	54 Å²	54	90.6 Å²	90.6	38%	0.378	52%	0.522	S	S	.	.	H	α-helix	trans	-74.9	-29.5	174.5	-57.1	0	0	0	0	112	S103 E104 Q109 Q110	S103-S106 PolarHBondContact O-N 3.21Å; S103-S106 VanDerWaalsContact O-N 3.16Å; E104-S106 PolarHBondContact O-N 2.99Å; S106-Q109 PolarHBondContact O-N 2.83Å; S106-Q110 WeakPolarHBondContact O-CB 3.41Å; S106-Q110 WeakPolarHBondContact O-CG 3.29Å; S106-Q110 PolarHBondContact O-N 3.43Å
107	R	35.6	Very low	37.9	Very low	84 Å²	84	90.8 Å²	90.8	32%	0.317	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-48.1	175	-69	-177.5	174.7	-165.6	-5.3	111.7	A97 S100 S103 E104 Q109 Q110 Q111	A97-R107 PolarHBondContact O-NH2 3.38Å; S100-R107 PolarHBondContact O-NH2 2.91Å; S103-R107 PolarHBondContact O-N 2.86Å; E104-R107 WeakPolarHBondContact O-CB 3.31Å; E104-R107 PolarHBondContact O-N 3.5Å; R107-Q109 VanDerWaalsContact C-N 3.33Å; R107-Q109 PolarHBondContact O-N 3Å; R107-Q110 PolarHBondContact O-N 2.86Å; R107-Q111 VanDerWaalsContact O-CB 3.26Å; R107-Q111 WeakPolarHBondContact O-CB 3.45Å; R107-Q111 WeakPolarHBondContact O-CG 3.23Å; R107-Q111 PolarHBondContact O-N 2.89Å
108	Q	41.7	Very low	37.7	Very low	142 Å²	142	91.9 Å²	91.9	66%	0.664	52%	0.516	S	S	*	.	H	α-helix	trans	-64.1	-37.2	177.5	-84.7	176.4	-13.6	0	0	112.4	E104 S112	E104-Q108 PolarHBondContact O-N 2.81Å; Q108-S112 WeakPolarHBondContact O-CB 3.43Å; Q108-S112 PolarHBondContact O-N 3.12Å; Q108-S112 PolarHBondContact O-OG 3.02Å
109	Q	39.2	Very low	37.5	Very low	141 Å²	141	90.3 Å²	90.3	66%	0.659	51%	0.506	S	S	*	.	H	α-helix	trans	-72.1	-39	180	-141.6	167.7	17.5	0	0	112.2	T105 S106 R107 S112 A113	T105-Q109 PolarHBondContact O-N 3.48Å; S106-Q109 PolarHBondContact O-N 2.83Å; R107-Q109 VanDerWaalsContact C-N 3.33Å; R107-Q109 PolarHBondContact O-N 3Å; Q109-S112 PolarHBondContact O-OG 3.1Å; Q109-A113 WeakPolarHBondContact O-CB 3.49Å; Q109-A113 PolarHBondContact O-N 2.82Å
110	Q	37.2	Very low	36.8	Very low	128 Å²	128	89.1 Å²	89.1	60%	0.598	50%	0.495	S	S	*	.	H	α-helix	trans	-71	-40.9	175.1	-73.6	179.1	-1	0	0	112.7	S106 R107 A113 F114	S106-Q110 WeakPolarHBondContact O-CB 3.41Å; S106-Q110 WeakPolarHBondContact O-CG 3.29Å; S106-Q110 PolarHBondContact O-N 3.43Å; R107-Q110 PolarHBondContact O-N 2.86Å; Q110-A113 PolarHBondContact O-N 3.37Å; Q110-F114 PolarHBondContact O-N 2.83Å; Q110-F114 VanDerWaalsContact O-N 3.11Å
111	Q	37.2	Very low	36.6	Very low	94 Å²	94	90.8 Å²	90.8	44%	0.439	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-42.2	174.2	-73.1	171.2	-8.1	0	0	111.3	R107 A113 F114 S115	R107-Q111 VanDerWaalsContact O-CB 3.26Å; R107-Q111 WeakPolarHBondContact O-CB 3.45Å; R107-Q111 WeakPolarHBondContact O-CG 3.23Å; R107-Q111 PolarHBondContact O-N 2.89Å; Q111-A113 VanDerWaalsContact C-N 3.34Å; Q111-A113 PolarHBondContact O-N 3.38Å; Q111-F114 PolarHBondContact O-N 3.27Å; Q111-S115 WeakPolarHBondContact O-CB 3.35Å; Q111-S115 PolarHBondContact O-N 2.79Å
112	S	36.1	Very low	36.6	Very low	59 Å²	59	91.5 Å²	91.5	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-38.5	175.7	75.3	0	0	0	0	111.9	Q108 Q109 M116	Q108-S112 WeakPolarHBondContact O-CB 3.43Å; Q108-S112 PolarHBondContact O-N 3.12Å; Q108-S112 PolarHBondContact O-OG 3.02Å; Q109-S112 PolarHBondContact O-OG 3.1Å; S112-M116 WeakPolarHBondContact O-CB 3.4Å; S112-M116 WeakPolarHBondContact O-CG 3.17Å; S112-M116 PolarHBondContact O-N 3.14Å
113	A	37.2	Very low	36.5	Very low	45 Å²	45	95.3 Å²	95.3	37%	0.372	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-35.2	179.5	0	0	0	0	0	112.9	Q109 Q110 Q111 R117	Q109-A113 WeakPolarHBondContact O-CB 3.49Å; Q109-A113 PolarHBondContact O-N 2.82Å; Q110-A113 PolarHBondContact O-N 3.37Å; Q111-A113 VanDerWaalsContact C-N 3.34Å; Q111-A113 PolarHBondContact O-N 3.38Å; A113-R117 WeakPolarHBondContact O-CG 3.44Å; A113-R117 PolarHBondContact O-N 3.31Å
114	F	35	Very low	35.8	Very low	44 Å²	44	98.6 Å²	98.6	19%	0.193	51%	0.509	C	S	.	.	H	α-helix	trans	-76.8	-45.3	176.8	-158.1	-78.4	0	0	0	111.5	E90 Q110 Q111 M116 R117 L118	E90-F114 HydrophobicContact CG-CD1 3.61Å; E90-F114 HydrophobicContact CG-CE1 3.06Å; E90-F114 HydrophobicContact CG-CZ 3.69Å; E90-F114 WeakPolarHBondContact OE1-CD1 3.29Å; E90-F114 WeakPolarHBondContact OE1-CE1 3.38Å; Q110-F114 PolarHBondContact O-N 2.83Å; Q110-F114 VanDerWaalsContact O-N 3.11Å; Q111-F114 PolarHBondContact O-N 3.27Å; F114-M116 VanDerWaalsContact C-N 3.34Å; F114-M116 PolarHBondContact O-N 3.47Å; F114-R117 PolarHBondContact O-N 3.43Å; F114-L118 PolarHBondContact O-N 3.38Å
115	S	34.4	Very low	35.1	Very low	65 Å²	65	95.4 Å²	95.4	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-37.2	172.8	-87.6	0	0	0	0	113.1	Q111 R117 L118 I119	Q111-S115 WeakPolarHBondContact O-CB 3.35Å; Q111-S115 PolarHBondContact O-N 2.79Å; S115-R117 VanDerWaalsContact C-N 3.26Å; S115-R117 PolarHBondContact O-N 3.36Å; S115-L118 WeakPolarHBondContact O-CB 3.46Å; S115-L118 PolarHBondContact O-N 2.88Å; S115-I119 PolarHBondContact O-N 2.81Å
116	M	30.9	Very low	34.3	Very low	118 Å²	118	95.2 Å²	95.2	58%	0.581	50%	0.499	S	S	*	.	H	α-helix	trans	-62.8	-33	176.4	-81.5	-79.1	-82.4	0	0	112	S112 F114 I119 T120	S112-M116 WeakPolarHBondContact O-CB 3.4Å; S112-M116 WeakPolarHBondContact O-CG 3.17Å; S112-M116 PolarHBondContact O-N 3.14Å; F114-M116 VanDerWaalsContact C-N 3.34Å; F114-M116 PolarHBondContact O-N 3.47Å; M116-I119 PolarHBondContact O-N 2.8Å; M116-T120 WeakPolarHBondContact O-CG2 3.33Å; M116-T120 PolarHBondContact O-N 3.46Å; M116-T120 VanDerWaalsContact O-N 3.12Å
117	R	34.8	Very low	33.6	Very low	85 Å²	85	96.2 Å²	96.2	32%	0.321	52%	0.517	S	S	.	.	H	α-helix	trans	-74.1	-27	179.4	-74	178.6	-174.7	164.5	10.2	113.6	A113 F114 S115 I119 T120 N121 S142	A113-R117 WeakPolarHBondContact O-CG 3.44Å; A113-R117 PolarHBondContact O-N 3.31Å; F114-R117 PolarHBondContact O-N 3.43Å; S115-R117 VanDerWaalsContact C-N 3.26Å; S115-R117 PolarHBondContact O-N 3.36Å; R117-I119 VanDerWaalsContact C-N 3.28Å; R117-T120 WeakPolarHBondContact CA-OG1 2.8Å; R117-T120 PolarHBondContact O-OG1 2.98Å; R117-N121 PolarHBondContact O-N 2.91Å; R117-S142 PolarHBondContact NH1-O 2.91Å; R117-S142 VanDerWaalsContact NH2-CB 3.32Å; R117-S142 PolarHBondContact NH2-O 3.12Å; R117-S142 PolarHBondContact NH2-OG 3.43Å
118	L	34	Very low	33.1	Very low	54 Å²	54	99.1 Å²	99.1	28%	0.283	54%	0.538	S	S	.	.	H	α-helix	trans	-65.7	-32.9	170.6	-82.1	161.6	0	0	0	111.9	E90 F114 S115	E90-L118 WeakPolarHBondContact OE1-CD1 3.49Å; F114-L118 PolarHBondContact O-N 3.38Å; S115-L118 WeakPolarHBondContact O-CB 3.46Å; S115-L118 PolarHBondContact O-N 2.88Å
119	I	34	Very low	32.3	Very low	106 Å²	106	97.6 Å²	97.6	54%	0.544	54%	0.543	S	S	.	.	H	α-helix	trans	-79.8	-39.7	-178.8	-60.2	168.9	0	0	0	110.9	S115 M116 R117 N121 N122	S115-I119 PolarHBondContact O-N 2.81Å; M116-I119 PolarHBondContact O-N 2.8Å; R117-I119 VanDerWaalsContact C-N 3.28Å; I119-N121 VanDerWaalsContact C-N 3.31Å; I119-N121 PolarHBondContact O-N 3.47Å; I119-N122 PolarHBondContact O-N 3Å
120	T	32.7	Very low	31.8	Very low	74 Å²	74	95.2 Å²	95.2	45%	0.454	54%	0.535	S	S	.	.	H	α-helix	trans	-67.3	-29.3	179.7	55	0	0	0	0	113.3	M116 R117 N122 H123	M116-T120 WeakPolarHBondContact O-CG2 3.33Å; M116-T120 PolarHBondContact O-N 3.46Å; M116-T120 VanDerWaalsContact O-N 3.12Å; R117-T120 WeakPolarHBondContact CA-OG1 2.8Å; R117-T120 PolarHBondContact O-OG1 2.98Å; T120-N122 PolarHBondContact O-N 2.93Å; T120-H123 PolarHBondContact O-N 3.08Å
121	N	33.7	Very low	31.2	Very low	89 Å²	89	94.1 Å²	94.1	48%	0.476	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-16.3	-179.8	-78.3	-15.7	0	0	0	114.4	R117 I119	R117-N121 PolarHBondContact O-N 2.91Å; I119-N121 VanDerWaalsContact C-N 3.31Å; I119-N121 PolarHBondContact O-N 3.47Å
122	N	35.4	Very low	30.8	Very low	125 Å²	125	92.5 Å²	92.5	67%	0.668	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.2	171.3	-83.4	-14.6	0	0	0	112.9	I119 T120	I119-N122 PolarHBondContact O-N 3Å; T120-N122 PolarHBondContact O-N 2.93Å
123	H	29.6	Very low	30.6	Very low	156 Å²	156	95.1 Å²	95.1	72%	0.722	56%	0.556	S	S	*	*			trans	-112.1	4.5	-175.6	-101	-65.5	0	0	0	115	T120 S125	T120-H123 PolarHBondContact O-N 3.08Å; H123-S125 PolarHBondContact O-N 3.44Å
124	L	27.6	Very low	30.3	Very low	138 Å²	138	97.4 Å²	97.4	72%	0.723	57%	0.569	S	S	*	*			trans	-75.7	74.8	167.7	-76.7	162.7	0	0	0	109.8
125	S	27.6	Very low	30.1	Very low	94 Å²	94	99 Å²	99	66%	0.657	58%	0.577	S	S	*	*			trans	-45	135	157.2	50.8	0	0	0	0	111.2	H123	H123-S125 PolarHBondContact O-N 3.44Å
126	D	25.1	Very low	30	Very low	105 Å²	105	102.4 Å²	102.4	56%	0.561	59%	0.59	S	S	*	*	S	Bend	trans	42.8	102.6	143.3	-70.1	-15.4	0	0	0	116.5	K222	D126-K222 IonicContact OD1-NZ 3.57Å; D126-K222 PolarHBondContact OD1-NZ 3.47Å; D126-K222 IonicContact OD2-NZ 2.75Å; D126-K222 PolarHBondContact OD2-NZ 3.48Å
127	G	25.8	Very low	29.9	Very low	74 Å²	74	99.3 Å²	99.3	76%	0.763	59%	0.588	S	S	*	*			trans	135.6	11.6	144.6	0	0	0	0	0	120.8
128	L	26.2	Very low	29.9	Very low	145 Å²	145	100.8 Å²	100.8	76%	0.759	60%	0.601	S	S	*	*			trans	-118.6	95	173.1	-71.8	169.8	0	0	0	111.6	L130	L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 HydrophobicContact CB-CD1 3.79Å; L128-L130 PolarHBondContact O-N 3.21Å
129	S	24.4	Very low	29.9	Very low	110 Å²	110	103.7 Å²	103.7	77%	0.769	62%	0.616	S	S	*	*			trans	-59.8	92.3	158.4	51.4	0	0	0	0	109.1	S131	S129-S131 PolarHBondContact O-N 3.04Å
130	L	28.4	Very low	29.8	Very low	92 Å²	92	99.7 Å²	99.7	48%	0.482	60%	0.601	S	S	.	*			trans	-79.5	87.5	175.6	-108.3	72.5	0	0	0	110.5	L128 E135	L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 HydrophobicContact CB-CD1 3.79Å; L128-L130 PolarHBondContact O-N 3.21Å; L130-E135 WeakPolarHBondContact CD1-OE2 3.38Å; L130-E135 HydrophobicContact CD2-CB 3.81Å; L130-E135 WeakPolarHBondContact CD2-OE2 3.34Å; L130-E135 HydrophobicContact CG-CB 4.4Å; L130-E135 WeakPolarHBondContact CG-OE2 3.36Å
131	S	25.5	Very low	29.9	Very low	105 Å²	105	101 Å²	101	73%	0.734	61%	0.613	S	S	*	*			trans	-96.5	64.9	165.2	51.4	0	0	0	0	109.9	S129	S129-S131 PolarHBondContact O-N 3.04Å
132	S	27.5	Very low	30.2	Very low	59 Å²	59	100.4 Å²	100.4	41%	0.413	62%	0.616	S	S	.	*	S	Bend	trans	-179	148.9	152	57.4	0	0	0	0	112.5	S134	S132-S134 PolarHBondContact O-N 3.33Å; S132-S134 VanDerWaalsContact O-N 3.09Å
133	P	31.9	Very low	30.7	Very low	115 Å²	115	96 Å²	96	75%	0.747	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-67.2	-0.9	175.7	-17.1	30.9	0	0	0	115.1
134	S	31.2	Very low	31.9	Very low	93 Å²	93	92.3 Å²	92.3	65%	0.65	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-84.1	-13.6	-168.9	-57.1	0	0	0	0	114.1	S132 G137	S132-S134 PolarHBondContact O-N 3.33Å; S132-S134 VanDerWaalsContact O-N 3.09Å; S134-G137 PolarHBondContact O-N 3.46Å
135	E	31.6	Very low	32.8	Very low	78 Å²	78	92.4 Å²	92.4	36%	0.364	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-90.5	-8.6	-178.7	-68.2	-171.3	-178.3	0	0	114.3	L130 G137 I138	L130-E135 WeakPolarHBondContact CD1-OE2 3.38Å; L130-E135 HydrophobicContact CD2-CB 3.81Å; L130-E135 WeakPolarHBondContact CD2-OE2 3.34Å; L130-E135 HydrophobicContact CG-CB 4.4Å; L130-E135 WeakPolarHBondContact CG-OE2 3.36Å; E135-G137 PolarHBondContact O-N 3.25Å; E135-I138 HydrophobicContact CB-CD1 4.43Å; E135-I138 HydrophobicContact CG-CD1 4.1Å; E135-I138 PolarHBondContact O-N 3.45Å
136	L	32.1	Very low	33.8	Very low	136 Å²	136	90.8 Å²	90.8	71%	0.712	57%	0.57	S	S	*	*	H	α-helix	trans	-59.6	-21.4	161	-95.2	147	0	0	0	112.1	I138 G140	L136-I138 VanDerWaalsContact C-N 3.33Å; L136-G140 PolarHBondContact O-N 2.62Å
137	G	29.1	Very low	35.2	Very low	52 Å²	52	87 Å²	87	54%	0.536	55%	0.552	S	S	.	*	H	α-helix	trans	-70.7	-23.3	172.5	0	0	0	0	0	114.3	S134 E135 G140	S134-G137 PolarHBondContact O-N 3.46Å; E135-G137 PolarHBondContact O-N 3.25Å; G137-G140 PolarHBondContact O-N 2.84Å
138	I	35.2	Very low	36.5	Very low	117 Å²	117	88.2 Å²	88.2	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-84.5	-28.9	-176.7	-55.8	178	0	0	0	110.9	E135 L136 G140 S141	E135-I138 HydrophobicContact CB-CD1 4.43Å; E135-I138 HydrophobicContact CG-CD1 4.1Å; E135-I138 PolarHBondContact O-N 3.45Å; L136-I138 VanDerWaalsContact C-N 3.33Å; I138-G140 PolarHBondContact O-N 3.3Å; I138-S141 PolarHBondContact O-OG 3.43Å
139	L	33.7	Very low	38	Very low	114 Å²	114	85.6 Å²	85.6	60%	0.597	52%	0.52	S	S	*	.	H	α-helix	trans	-70.8	-20.3	165.4	-74.1	164.2	0	0	0	112.3	L143	L139-L143 VanDerWaalsContact O-CD1 3.26Å; L139-L143 WeakPolarHBondContact O-CD1 3.12Å
140	G	31.2	Very low	39.7	Very low	23 Å²	23	82 Å²	82	24%	0.237	49%	0.492	C	S	.	.	H	α-helix	trans	-68.9	-37.1	179.2	0	0	0	0	0	114	L136 G137 I138 S142 R148	L136-G140 PolarHBondContact O-N 2.62Å; G137-G140 PolarHBondContact O-N 2.84Å; I138-G140 PolarHBondContact O-N 3.3Å; G140-S142 VanDerWaalsContact C-N 3.28Å; G140-S142 PolarHBondContact O-N 3.49Å; G140-R148 PolarHBondContact O-NE 3.34Å; G140-R148 PolarHBondContact O-NH2 2.9Å
141	S	35.8	Very low	41.3	Very low	100 Å²	100	79.7 Å²	79.7	70%	0.699	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-11	-167.4	61	0	0	0	0	115.5	I138	I138-S141 PolarHBondContact O-OG 3.43Å
142	S	39.9	Very low	43	Very low	77 Å²	77	78 Å²	78	54%	0.538	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	0	-173.4	-158.5	0	0	0	0	114.6	R117 G140	R117-S142 PolarHBondContact NH1-O 2.91Å; R117-S142 VanDerWaalsContact NH2-CB 3.32Å; R117-S142 PolarHBondContact NH2-O 3.12Å; R117-S142 PolarHBondContact NH2-OG 3.43Å; G140-S142 VanDerWaalsContact C-N 3.28Å; G140-S142 PolarHBondContact O-N 3.49Å
143	L	45.4	Very low	44.6	Very low	34 Å²	34	78.5 Å²	78.5	18%	0.178	46%	0.463	C	S	.	.	S	Bend	trans	-90.2	134.3	170.6	-85.7	84.1	0	0	0	110.2	L139 R148 L151	L139-L143 VanDerWaalsContact O-CD1 3.26Å; L139-L143 WeakPolarHBondContact O-CD1 3.12Å; L143-R148 HydrophobicContact CB-CG 3.89Å; L143-R148 PolarHBondContact O-NH2 3.3Å; L143-L151 HydrophobicContact CD2-CD1 4.41Å
144	T	54	Low	46	Very low	77 Å²	77	73.1 Å²	73.1	47%	0.472	43%	0.428	S	S	.	.			trans	-54.9	146.3	166	49.4	0	0	0	0	109.2	A146 S147 R148	T144-A146 PolarHBondContact O-N 3.41Å; T144-S147 PolarHBondContact O-N 2.94Å; T144-S147 PolarHBondContact OG1-OG 3.49Å; T144-R148 PolarHBondContact O-N 2.63Å; T144-R148 VanDerWaalsContact O-N 3.11Å
145	E	47.5	Very low	47.4	Very low	141 Å²	141	71.7 Å²	71.7	66%	0.659	41%	0.412	S	S	*	.	H	α-helix	trans	-56.8	-33.9	-177.6	-162.8	165.5	-164.3	0	0	112	R148 N149	E145-R148 PolarHBondContact O-N 3.32Å; E145-N149 PolarHBondContact O-N 3.5Å
146	A	48.5	Very low	48.6	Very low	60 Å²	60	71.2 Å²	71.2	50%	0.496	42%	0.417	S	S	.	.	H	α-helix	trans	-58.4	-47.2	170.8	0	0	0	0	0	112.9	T144 R148 N149 I150	T144-A146 PolarHBondContact O-N 3.41Å; A146-R148 VanDerWaalsContact C-N 3.31Å; A146-R148 PolarHBondContact O-N 2.85Å; A146-N149 PolarHBondContact O-N 3.06Å; A146-I150 VanDerWaalsContact O-CG1 3.24Å; A146-I150 WeakPolarHBondContact O-CG1 3.24Å; A146-I150 PolarHBondContact O-N 3.34Å
147	S	54	Low	50	Low	26 Å²	26	65.4 Å²	65.4	18%	0.182	39%	0.39	C	S	.	.	H	α-helix	trans	-68.8	-29.2	178.9	-59	0	0	0	0	112.6	T144 L151	T144-S147 PolarHBondContact O-N 2.94Å; T144-S147 PolarHBondContact OG1-OG 3.49Å; S147-L151 VanDerWaalsContact O-CB 3.31Å; S147-L151 WeakPolarHBondContact O-CB 3.29Å; S147-L151 PolarHBondContact O-N 2.8Å; S147-L151 VanDerWaalsContact O-N 3.11Å
148	R	54.4	Low	51.4	Low	98 Å²	98	70.1 Å²	70.1	37%	0.37	40%	0.396	S	S	.	.	H	α-helix	trans	-68.8	-44.2	170.5	-66.9	-162.4	-151	99.3	3.8	111.5	G140 L143 T144 E145 A146 I150 L151 T152	G140-R148 PolarHBondContact O-NE 3.34Å; G140-R148 PolarHBondContact O-NH2 2.9Å; L143-R148 HydrophobicContact CB-CG 3.89Å; L143-R148 PolarHBondContact O-NH2 3.3Å; T144-R148 PolarHBondContact O-N 2.63Å; T144-R148 VanDerWaalsContact O-N 3.11Å; E145-R148 PolarHBondContact O-N 3.32Å; A146-R148 VanDerWaalsContact C-N 3.31Å; A146-R148 PolarHBondContact O-N 2.85Å; R148-I150 VanDerWaalsContact C-N 3.33Å; R148-I150 PolarHBondContact O-N 3.38Å; R148-L151 PolarHBondContact O-N 3.47Å; R148-T152 WeakPolarHBondContact O-CG2 3.33Å; R148-T152 PolarHBondContact O-N 3.47Å; R148-T152 PolarHBondContact O-OG1 3.32Å
149	N	57.7	Low	52.5	Low	91 Å²	91	65 Å²	65	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-40.9	179.3	-70.8	-12.4	0	0	0	111.8	E145 A146 T152 D153	E145-N149 PolarHBondContact O-N 3.5Å; A146-N149 PolarHBondContact O-N 3.06Å; N149-T152 VanDerWaalsContact C-OG1 3.31Å; N149-T152 VanDerWaalsContact CA-OG1 3.28Å; N149-T152 WeakPolarHBondContact CA-OG1 3.43Å; N149-T152 PolarHBondContact O-N 2.98Å; N149-T152 PolarHBondContact O-OG1 3.08Å; N149-D153 PolarHBondContact O-N 3.2Å
150	I	59.6	Low	53.7	Low	33 Å²	33	66.4 Å²	66.4	17%	0.169	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-43.9	176.6	-68	168.6	0	0	0	110.6	T92 N93 A146 R148 T152 D153 V154	T92-I150 WeakPolarHBondContact OG1-CG2 3.42Å; N93-I150 WeakPolarHBondContact OD1-CD1 3.39Å; A146-I150 VanDerWaalsContact O-CG1 3.24Å; A146-I150 WeakPolarHBondContact O-CG1 3.24Å; A146-I150 PolarHBondContact O-N 3.34Å; R148-I150 VanDerWaalsContact C-N 3.33Å; R148-I150 PolarHBondContact O-N 3.38Å; I150-T152 VanDerWaalsContact C-N 3.3Å; I150-T152 PolarHBondContact O-N 3.13Å; I150-D153 PolarHBondContact O-N 2.82Å; I150-V154 HydrophobicContact CG2-CG2 4.33Å; I150-V154 WeakPolarHBondContact O-CB 3.37Å; I150-V154 WeakPolarHBondContact O-CG2 3.33Å; I150-V154 PolarHBondContact O-N 3.36Å
151	L	60.9	Low	55.1	Low	45 Å²	45	65.5 Å²	65.5	24%	0.236	36%	0.364	C	S	.	.	H	α-helix	trans	-62.3	-37.6	174.6	-159.8	156.7	0	0	0	111.2	L86 L143 S147 R148 V154 M155	L86-L151 HydrophobicContact CD2-CD1 4.03Å; L143-L151 HydrophobicContact CD2-CD1 4.41Å; S147-L151 VanDerWaalsContact O-CB 3.31Å; S147-L151 WeakPolarHBondContact O-CB 3.29Å; S147-L151 PolarHBondContact O-N 2.8Å; S147-L151 VanDerWaalsContact O-N 3.11Å; R148-L151 PolarHBondContact O-N 3.47Å; L151-V154 PolarHBondContact O-N 3.41Å; L151-M155 HydrophobicContact CD2-CE 3.37Å; L151-M155 HydrophobicContact CD2-CG 3.91Å; L151-M155 HydrophobicContact CD2-SD 3.44Å; L151-M155 WeakPolarHBondContact CD2-SD 3.23Å; L151-M155 WeakPolarHBondContact O-CB 3.47Å; L151-M155 WeakPolarHBondContact O-CG 3.48Å; L151-M155 PolarHBondContact O-N 2.77Å
152	T	62.3	Low	56.6	Low	69 Å²	69	66.7 Å²	66.7	42%	0.423	36%	0.362	S	S	.	.	H	α-helix	trans	-68.6	-39.8	174.7	56.1	0	0	0	0	113.7	R148 N149 I150 V154 M155 S156	R148-T152 WeakPolarHBondContact O-CG2 3.33Å; R148-T152 PolarHBondContact O-N 3.47Å; R148-T152 PolarHBondContact O-OG1 3.32Å; N149-T152 VanDerWaalsContact C-OG1 3.31Å; N149-T152 VanDerWaalsContact CA-OG1 3.28Å; N149-T152 WeakPolarHBondContact CA-OG1 3.43Å; N149-T152 PolarHBondContact O-N 2.98Å; N149-T152 PolarHBondContact O-OG1 3.08Å; I150-T152 VanDerWaalsContact C-N 3.3Å; I150-T152 PolarHBondContact O-N 3.13Å; T152-V154 VanDerWaalsContact C-N 3.29Å; T152-V154 PolarHBondContact O-N 3.1Å; T152-M155 HydrophobicContact CG2-CE 3.84Å; T152-M155 PolarHBondContact O-N 2.84Å; T152-S156 WeakPolarHBondContact O-CB 3.33Å; T152-S156 PolarHBondContact O-N 2.99Å; T152-S156 PolarHBondContact O-OG 2.63Å
153	D	60.8	Low	58	Low	70 Å²	70	63.9 Å²	63.9	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-39.4	174.7	-89.1	-29.7	0	0	0	110.6	N149 I150 S156 G157 K158	N149-D153 PolarHBondContact O-N 3.2Å; I150-D153 PolarHBondContact O-N 2.82Å; D153-S156 WeakPolarHBondContact CA-OG 3.48Å; D153-S156 PolarHBondContact O-N 3.22Å; D153-S156 PolarHBondContact O-OG 3.49Å; D153-G157 PolarHBondContact O-N 2.99Å; D153-K158 PolarHBondContact O-N 3.23Å; D153-K158 IonicContact OD1-NZ 3.78Å; D153-K158 PolarHBondContact OD1-NZ 3.03Å
154	V	60.1	Low	59.3	Low	2 Å²	2	66.5 Å²	66.5	1%	0.012	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-41.6	176.3	171.4	0	0	0	0	111.8	L88 A89 T92 I150 L151 T152 S156 G157 N159	L88-V154 HydrophobicContact CB-CG1 3.88Å; A89-V154 HydrophobicContact CB-CB 4.38Å; A89-V154 HydrophobicContact CB-CG1 4.17Å; A89-V154 HydrophobicContact CB-CG2 4.08Å; T92-V154 HydrophobicContact CG2-CG2 3.91Å; T92-V154 WeakPolarHBondContact OG1-CG2 3.37Å; I150-V154 HydrophobicContact CG2-CG2 4.33Å; I150-V154 WeakPolarHBondContact O-CB 3.37Å; I150-V154 WeakPolarHBondContact O-CG2 3.33Å; I150-V154 PolarHBondContact O-N 3.36Å; L151-V154 PolarHBondContact O-N 3.41Å; T152-V154 VanDerWaalsContact C-N 3.29Å; T152-V154 PolarHBondContact O-N 3.1Å; V154-S156 VanDerWaalsContact C-N 3.28Å; V154-S156 PolarHBondContact O-N 3.22Å; V154-G157 PolarHBondContact O-N 3.44Å; V154-N159 WeakPolarHBondContact CA-ND2 3.35Å; V154-N159 WeakPolarHBondContact CA-OD1 3.12Å; V154-N159 WeakPolarHBondContact CB-OD1 3.36Å; V154-N159 WeakPolarHBondContact CG1-ND2 3.43Å; V154-N159 VanDerWaalsContact CG2-OD1 3.24Å; V154-N159 WeakPolarHBondContact CG2-OD1 3.19Å; V154-N159 PolarHBondContact O-ND2 3.44Å
155	M	61	Low	60.3	Low	63 Å²	63	65.3 Å²	65.3	31%	0.31	35%	0.345	S	S	.	.	H	α-helix	trans	-66.2	-31.3	174.2	-73.5	-175.8	-56.8	0	0	112.5	L151 T152 G157 Y165	L151-M155 HydrophobicContact CD2-CE 3.37Å; L151-M155 HydrophobicContact CD2-CG 3.91Å; L151-M155 HydrophobicContact CD2-SD 3.44Å; L151-M155 WeakPolarHBondContact CD2-SD 3.23Å; L151-M155 WeakPolarHBondContact O-CB 3.47Å; L151-M155 WeakPolarHBondContact O-CG 3.48Å; L151-M155 PolarHBondContact O-N 2.77Å; T152-M155 HydrophobicContact CG2-CE 3.84Å; T152-M155 PolarHBondContact O-N 2.84Å; M155-G157 VanDerWaalsContact C-N 3.25Å; M155-G157 PolarHBondContact O-N 2.91Å; M155-Y165 HydrophobicContact CG-CG 4.2Å; M155-Y165 PolarHBondContact O-N 2.93Å
156	S	58	Low	61.9	Low	67 Å²	67	61.5 Å²	61.5	47%	0.469	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-5.6	-178.7	77.5	0	0	0	0	114.8	T152 D153 V154	T152-S156 WeakPolarHBondContact O-CB 3.33Å; T152-S156 PolarHBondContact O-N 2.99Å; T152-S156 PolarHBondContact O-OG 2.63Å; D153-S156 WeakPolarHBondContact CA-OG 3.48Å; D153-S156 PolarHBondContact O-N 3.22Å; D153-S156 PolarHBondContact O-OG 3.49Å; V154-S156 VanDerWaalsContact C-N 3.28Å; V154-S156 PolarHBondContact O-N 3.22Å
157	G	61.4	Low	63.4	Low	15 Å²	15	61.4 Å²	61.4	16%	0.155	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	94	7.6	177.4	0	0	0	0	0	115.4	D153 V154 M155 N159	D153-G157 PolarHBondContact O-N 2.99Å; V154-G157 PolarHBondContact O-N 3.44Å; M155-G157 VanDerWaalsContact C-N 3.25Å; M155-G157 PolarHBondContact O-N 2.91Å; G157-N159 PolarHBondContact O-N 3.36Å
158	K	57.4	Low	64.8	Low	150 Å²	150	68.7 Å²	68.7	65%	0.652	36%	0.357	S	S	*	.			trans	-81.5	51	174.3	-61.3	-177.8	-165.1	157.4	0	112	D153	D153-K158 PolarHBondContact O-N 3.23Å; D153-K158 IonicContact OD1-NZ 3.78Å; D153-K158 PolarHBondContact OD1-NZ 3.03Å
159	N	58.6	Low	66.3	Low	9 Å²	9	66.4 Å²	66.4	5%	0.048	35%	0.348	C	S	.	.	S	Bend	trans	-118.1	153	-179.5	-61.8	-30.7	0	0	0	110.5	V154 G157 A161 N162	V154-N159 WeakPolarHBondContact CA-ND2 3.35Å; V154-N159 WeakPolarHBondContact CA-OD1 3.12Å; V154-N159 WeakPolarHBondContact CB-OD1 3.36Å; V154-N159 WeakPolarHBondContact CG1-ND2 3.43Å; V154-N159 VanDerWaalsContact CG2-OD1 3.24Å; V154-N159 WeakPolarHBondContact CG2-OD1 3.19Å; V154-N159 PolarHBondContact O-ND2 3.44Å; G157-N159 PolarHBondContact O-N 3.36Å; N159-A161 PolarHBondContact O-N 3.39Å; N159-N162 PolarHBondContact O-N 2.89Å; N159-N162 PolarHBondContact O-OD1 3.38Å
160	E	60.3	Low	67.5	Low	144 Å²	144	63.8 Å²	63.8	67%	0.673	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-25.8	170.7	-62	-174.1	163.1	0	0	112.4	V61 R65	V61-E160 HydrophobicContact CG1-CB 4.46Å; V61-E160 HydrophobicContact CG2-CB 4.05Å; R65-E160 PolarHBondContact NH2-O 3Å
161	A	60.3	Low	68.6	Low	4 Å²	4	65 Å²	65	3%	0.033	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.3	175.9	0	0	0	0	0	114.9	V61 R65 L88 N159 L163	V61-A161 HydrophobicContact CG1-CB 4.06Å; R65-A161 HydrophobicContact CG-CB 4.17Å; R65-A161 PolarHBondContact NE-O 3.06Å; L88-A161 HydrophobicContact CD1-CB 4.48Å; L88-A161 HydrophobicContact CD2-CB 3.88Å; N159-A161 PolarHBondContact O-N 3.39Å; A161-L163 HydrophobicContact CB-CB 4.47Å; A161-L163 HydrophobicContact CB-CD1 3.95Å; A161-L163 HydrophobicContact CB-CG 3.93Å; A161-L163 PolarHBondContact O-N 3.31Å
162	N	66.1	Low	69.9	Low	125 Å²	125	65.3 Å²	65.3	67%	0.668	34%	0.344	S	S	*	.			trans	51.1	32.8	-172.2	-69.6	-21.5	0	0	0	113.9	N159	N159-N162 PolarHBondContact O-N 2.89Å; N159-N162 PolarHBondContact O-OD1 3.38Å
163	L	68.7	Low	71	Confident	18 Å²	18	62.3 Å²	62.3	9%	0.094	33%	0.326	C	S	.	.			trans	-97.3	124.2	179.3	-65.2	175.7	0	0	0	110.2	R65 H68 F85 L88 A161	R65-L163 HydrophobicContact CG-CD1 4.34Å; H68-L163 HydrophobicContact CB-CD1 3.85Å; F85-L163 HydrophobicContact CE1-CB 4.23Å; F85-L163 HydrophobicContact CZ-CB 4.36Å; L88-L163 HydrophobicContact CD1-CD1 4.17Å; A161-L163 HydrophobicContact CB-CB 4.47Å; A161-L163 HydrophobicContact CB-CD1 3.95Å; A161-L163 HydrophobicContact CB-CG 3.93Å; A161-L163 PolarHBondContact O-N 3.31Å
164	V	72.8	Confident	72.2	Confident	89 Å²	89	63.7 Å²	63.7	54%	0.539	33%	0.326	S	S	.	.			trans	-95.6	134	175.2	179.3	0	0	0	0	109.4	D166	V164-D166 PolarHBondContact O-N 3.47Å; V164-D166 VanDerWaalsContact O-N 3.14Å
165	Y	75.5	Confident	73.6	Confident	52 Å²	52	71 Å²	71	20%	0.204	35%	0.353	C	S	.	.			trans	-71.4	106.8	176.1	-173.2	-91.9	0	0	0	111.1	Y81 N82 F85 M155 A167 E170	Y81-Y165 HydrophobicContact CD1-CD2 4.4Å; Y81-Y165 AromaticContact CD1-CE2 3.88Å; Y81-Y165 HydrophobicContact CD1-CE2 3.88Å; Y81-Y165 AromaticContact CE1-CD2 3.68Å; Y81-Y165 HydrophobicContact CE1-CD2 3.68Å; Y81-Y165 AromaticContact CE1-CE2 3.52Å; Y81-Y165 HydrophobicContact CE1-CE2 3.52Å; Y81-Y165 HydrophobicContact CE1-CG 4.41Å; N82-Y165 WeakPolarHBondContact OD1-CE2 3.31Å; N82-Y165 PolarHBondContact OD1-OH 3.14Å; F85-Y165 HydrophobicContact CB-CD2 4.34Å; F85-Y165 HydrophobicContact CD1-CD2 4.06Å; F85-Y165 AromaticContact CD2-CD2 3.55Å; F85-Y165 HydrophobicContact CD2-CD2 3.55Å; F85-Y165 HydrophobicContact CD2-CE2 4.04Å; F85-Y165 HydrophobicContact CE1-CD2 4.24Å; F85-Y165 AromaticContact CE2-CD2 3.81Å; F85-Y165 HydrophobicContact CE2-CD2 3.81Å; F85-Y165 AromaticContact CG-CD2 3.7Å; F85-Y165 HydrophobicContact CG-CD2 3.7Å; F85-Y165 HydrophobicContact CG-CE2 4.38Å; F85-Y165 HydrophobicContact CZ-CD2 4.13Å; M155-Y165 HydrophobicContact CG-CG 4.2Å; M155-Y165 PolarHBondContact O-N 2.93Å; Y165-A167 HydrophobicContact CD1-CB 4.14Å; Y165-A167 HydrophobicContact CE1-CB 3.89Å; Y165-A167 PolarHBondContact O-N 3.42Å; Y165-E170 VanDerWaalsContact OH-CD 3.22Å; Y165-E170 PolarHBondContact OH-OE2 2.94Å
166	D	81.1	Confident	74.9	Confident	62 Å²	62	73.2 Å²	73.2	33%	0.332	36%	0.361	S	S	.	.			trans	-87.2	90.5	174.7	-169.1	-11	0	0	0	112.7	Y81 V164 K168 W169 E170	Y81-D166 PolarHBondContact OH-N 3.28Å; V164-D166 PolarHBondContact O-N 3.47Å; V164-D166 VanDerWaalsContact O-N 3.14Å; D166-K168 VanDerWaalsContact C-N 3.25Å; D166-K168 PolarHBondContact O-N 3.37Å; D166-K168 WeakPolarHBondContact OD1-CA 3.24Å; D166-K168 WeakPolarHBondContact OD1-CB 3.28Å; D166-K168 PolarHBondContact OD1-N 3.35Å; D166-W169 HydrophobicContact CB-CB 3.89Å; D166-W169 VanDerWaalsContact CG-CB 3.4Å; D166-W169 PolarHBondContact O-N 3.48Å; D166-W169 PolarHBondContact OD1-N 3.18Å; D166-W169 WeakPolarHBondContact OD2-CB 3.43Å; D166-E170 PolarHBondContact O-N 3.42Å; D166-E170 VanDerWaalsContact O-N 3.14Å
167	A	80.6	Confident	76.4	Confident	57 Å²	57	70.1 Å²	70.1	47%	0.471	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-26.5	174.9	0	0	0	0	0	113.3	Y165 E171	Y165-A167 HydrophobicContact CD1-CB 4.14Å; Y165-A167 HydrophobicContact CE1-CB 3.89Å; Y165-A167 PolarHBondContact O-N 3.42Å; A167-E171 WeakPolarHBondContact O-CB 3.35Å; A167-E171 PolarHBondContact O-N 3.45Å; A167-E171 VanDerWaalsContact O-N 3.15Å
168	K	84	Confident	77.7	Confident	179 Å²	179	72.4 Å²	72.4	78%	0.778	35%	0.351	S	S	*	.	H	α-helix	trans	-72.6	-40.2	177.9	-66.1	-179.7	178.8	176.6	0	110.4	D166 S172	D166-K168 VanDerWaalsContact C-N 3.25Å; D166-K168 PolarHBondContact O-N 3.37Å; D166-K168 WeakPolarHBondContact OD1-CA 3.24Å; D166-K168 WeakPolarHBondContact OD1-CB 3.28Å; D166-K168 PolarHBondContact OD1-N 3.35Å; K168-S172 VanDerWaalsContact O-CB 3.26Å; K168-S172 WeakPolarHBondContact O-CB 3.4Å; K168-S172 PolarHBondContact O-N 2.76Å
169	W	85.5	Confident	79.4	Confident	50 Å²	50	70.5 Å²	70.5	19%	0.189	35%	0.345	C	S	.	.	H	α-helix	trans	-63.7	-47.2	174.3	179.4	87.2	0	0	0	111.2	V71 K72 Y81 D166 E171 S172 T173	V71-W169 HydrophobicContact CG1-CH2 4.07Å; K72-W169 HydrophobicContact CB-CZ2 4.25Å; K72-W169 HydrophobicContact CG-CD2 4.26Å; K72-W169 HydrophobicContact CG-CH2 4.21Å; K72-W169 HydrophobicContact CG-CZ2 3.92Å; K72-W169 HydrophobicContact CG-CZ3 4.49Å; Y81-W169 HydrophobicContact CD1-CE3 4.5Å; Y81-W169 HydrophobicContact CD1-CZ3 4.23Å; Y81-W169 HydrophobicContact CD2-CE3 4.15Å; Y81-W169 HydrophobicContact CD2-CH2 4.38Å; Y81-W169 AromaticContact CD2-CZ3 3.58Å; Y81-W169 HydrophobicContact CD2-CZ3 3.58Å; Y81-W169 HydrophobicContact CE1-CE3 4.39Å; Y81-W169 HydrophobicContact CE2-CE3 4.04Å; Y81-W169 AromaticContact CE2-CZ3 3.94Å; Y81-W169 HydrophobicContact CE2-CZ3 3.94Å; Y81-W169 HydrophobicContact CG-CE3 4.36Å; Y81-W169 AromaticContact CG-CZ3 3.72Å; Y81-W169 HydrophobicContact CG-CZ3 3.72Å; D166-W169 HydrophobicContact CB-CB 3.89Å; D166-W169 VanDerWaalsContact CG-CB 3.4Å; D166-W169 PolarHBondContact O-N 3.48Å; D166-W169 PolarHBondContact OD1-N 3.18Å; D166-W169 WeakPolarHBondContact OD2-CB 3.43Å; W169-E171 PolarHBondContact O-N 3.24Å; W169-S172 PolarHBondContact O-N 3.23Å; W169-T173 VanDerWaalsContact CE2-OG1 3.27Å; W169-T173 HydrophobicContact CH2-CG2 4.23Å; W169-T173 HydrophobicContact CZ2-CG2 4.21Å; W169-T173 WeakPolarHBondContact CZ2-OG1 3.33Å; W169-T173 WeakPolarHBondContact O-CB 3.41Å; W169-T173 PolarHBondContact O-N 3.49Å; W169-T173 PolarHBondContact O-OG1 2.89Å
170	E	82.7	Confident	80.9	Confident	37 Å²	37	72.8 Å²	72.8	17%	0.173	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-49.7	178.8	-172.7	-164.4	-176.2	0	0	111.6	N82 Y165 D166 S172 T173 R174	N82-E170 PolarHBondContact ND2-OE1 2.91Å; N82-E170 PolarHBondContact OD1-OE1 3.45Å; Y165-E170 VanDerWaalsContact OH-CD 3.22Å; Y165-E170 PolarHBondContact OH-OE2 2.94Å; D166-E170 PolarHBondContact O-N 3.42Å; D166-E170 VanDerWaalsContact O-N 3.14Å; E170-S172 PolarHBondContact O-N 2.93Å; E170-T173 PolarHBondContact O-N 3.27Å; E170-R174 VanDerWaalsContact O-CB 3.31Å; E170-R174 WeakPolarHBondContact O-CB 3.25Å; E170-R174 PolarHBondContact O-N 3.26Å
171	E	83.2	Confident	82.4	Confident	59 Å²	59	67.5 Å²	67.5	28%	0.276	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-38	179.8	177.4	60.1	-168.8	0	0	112.2	A167 W169 R174 R175	A167-E171 WeakPolarHBondContact O-CB 3.35Å; A167-E171 PolarHBondContact O-N 3.45Å; A167-E171 VanDerWaalsContact O-N 3.15Å; W169-E171 PolarHBondContact O-N 3.24Å; E171-R174 IonicContact OE1-CZ 2.72Å; E171-R174 IonicContact OE1-NH2 3.23Å; E171-R174 PolarHBondContact OE1-NH2 3.13Å; E171-R174 IonicContact OE2-CZ 2.82Å; E171-R174 VanDerWaalsContact OE2-CZ 3.23Å; E171-R174 IonicContact OE2-NE 2.89Å; E171-R174 PolarHBondContact OE2-NE 3.07Å; E171-R174 IonicContact OE2-NH2 2.8Å; E171-R174 PolarHBondContact OE2-NH2 3.29Å; E171-R175 VanDerWaalsContact O-CG 3.29Å; E171-R175 WeakPolarHBondContact O-CG 3.21Å; E171-R175 PolarHBondContact O-N 3.44Å; E171-R175 IonicContact OE1-CZ 2.93Å; E171-R175 IonicContact OE1-NE 3.43Å; E171-R175 PolarHBondContact OE1-NE 3.38Å; E171-R175 IonicContact OE1-NH2 2.71Å; E171-R175 PolarHBondContact OE1-NH2 3.26Å
172	S	86.9	Confident	83.9	Confident	51 Å²	51	73.3 Å²	73.3	36%	0.357	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-44.4	174.7	-172.9	0	0	0	0	111.7	K168 W169 E170 R175 K176	K168-S172 VanDerWaalsContact O-CB 3.26Å; K168-S172 WeakPolarHBondContact O-CB 3.4Å; K168-S172 PolarHBondContact O-N 2.76Å; W169-S172 PolarHBondContact O-N 3.23Å; E170-S172 PolarHBondContact O-N 2.93Å; S172-R175 PolarHBondContact O-N 3.38Å; S172-K176 VanDerWaalsContact O-CG 3.31Å; S172-K176 WeakPolarHBondContact O-CG 3.49Å; S172-K176 PolarHBondContact O-N 3.28Å
173	T	86	Confident	85.3	Confident	5 Å²	5	72 Å²	72	3%	0.031	35%	0.35	C	S	.	.	H	α-helix	trans	-65.3	-43.4	178.3	-64.8	0	0	0	0	111.2	L76 W169 E170 R175 K176 G177	L76-T173 HydrophobicContact CB-CG2 4.23Å; L76-T173 HydrophobicContact CD2-CG2 3.95Å; W169-T173 VanDerWaalsContact CE2-OG1 3.27Å; W169-T173 HydrophobicContact CH2-CG2 4.23Å; W169-T173 HydrophobicContact CZ2-CG2 4.21Å; W169-T173 WeakPolarHBondContact CZ2-OG1 3.33Å; W169-T173 WeakPolarHBondContact O-CB 3.41Å; W169-T173 PolarHBondContact O-N 3.49Å; W169-T173 PolarHBondContact O-OG1 2.89Å; E170-T173 PolarHBondContact O-N 3.27Å; T173-R175 PolarHBondContact O-N 2.81Å; T173-K176 PolarHBondContact O-N 3.16Å; T173-G177 PolarHBondContact O-N 3.35Å
174	R	86.8	Confident	86.4	Confident	100 Å²	100	72.7 Å²	72.7	38%	0.377	35%	0.353	S	S	.	.	H	α-helix	trans	-59.3	-45.9	175	-170.6	-172.4	67.7	74.9	-0.7	111.7	E170 E171 G177 V178	E170-R174 VanDerWaalsContact O-CB 3.31Å; E170-R174 WeakPolarHBondContact O-CB 3.25Å; E170-R174 PolarHBondContact O-N 3.26Å; E171-R174 IonicContact OE1-CZ 2.72Å; E171-R174 IonicContact OE1-NH2 3.23Å; E171-R174 PolarHBondContact OE1-NH2 3.13Å; E171-R174 IonicContact OE2-CZ 2.82Å; E171-R174 VanDerWaalsContact OE2-CZ 3.23Å; E171-R174 IonicContact OE2-NE 2.89Å; E171-R174 PolarHBondContact OE2-NE 3.07Å; E171-R174 IonicContact OE2-NH2 2.8Å; E171-R174 PolarHBondContact OE2-NH2 3.29Å; R174-G177 PolarHBondContact O-N 3.2Å; R174-V178 WeakPolarHBondContact O-CG2 3.5Å; R174-V178 PolarHBondContact O-N 3.27Å
175	R	89	Confident	87.3	Confident	156 Å²	156	71.3 Å²	71.3	59%	0.589	34%	0.343	S	S	*	.	H	α-helix	trans	-61.9	-43.1	175.8	-73.6	177.8	-165.7	171.3	5.6	112.2	E171 S172 T173 G177 V178 M179	E171-R175 VanDerWaalsContact O-CG 3.29Å; E171-R175 WeakPolarHBondContact O-CG 3.21Å; E171-R175 PolarHBondContact O-N 3.44Å; E171-R175 IonicContact OE1-CZ 2.93Å; E171-R175 IonicContact OE1-NE 3.43Å; E171-R175 PolarHBondContact OE1-NE 3.38Å; E171-R175 IonicContact OE1-NH2 2.71Å; E171-R175 PolarHBondContact OE1-NH2 3.26Å; S172-R175 PolarHBondContact O-N 3.38Å; T173-R175 PolarHBondContact O-N 2.81Å; R175-G177 VanDerWaalsContact C-N 3.34Å; R175-V178 PolarHBondContact O-N 3.35Å; R175-M179 WeakPolarHBondContact O-CB 3.44Å; R175-M179 PolarHBondContact O-N 3.15Å
176	K	89	Confident	88.2	Confident	109 Å²	109	72.4 Å²	72.4	47%	0.474	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-43.4	174.8	-72.5	171.7	-176.3	176.3	0	111.6	S172 T173 M179 L180	S172-K176 VanDerWaalsContact O-CG 3.31Å; S172-K176 WeakPolarHBondContact O-CG 3.49Å; S172-K176 PolarHBondContact O-N 3.28Å; T173-K176 PolarHBondContact O-N 3.16Å; K176-M179 PolarHBondContact O-N 3.38Å; K176-L180 WeakPolarHBondContact O-CB 3.28Å; K176-L180 WeakPolarHBondContact O-CG 3.46Å; K176-L180 PolarHBondContact O-N 3.19Å
177	G	87.9	Confident	88.8	Confident	2 Å²	2	73 Å²	73	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-45.6	176.9	0	0	0	0	0	113	T173 R174 R175 L180 L181	T173-G177 PolarHBondContact O-N 3.35Å; R174-G177 PolarHBondContact O-N 3.2Å; R175-G177 VanDerWaalsContact C-N 3.34Å; G177-L180 PolarHBondContact O-N 2.91Å; G177-L181 WeakPolarHBondContact O-CG 3.42Å; G177-L181 PolarHBondContact O-N 3.11Å
178	V	90.2	Very high	89.2	Confident	63 Å²	63	70.6 Å²	70.6	38%	0.382	34%	0.335	S	S	.	.	H	α-helix	trans	-65.4	-45.6	176.5	175.2	0	0	0	0	111.6	R174 R175 L180 L181 E182	R174-V178 WeakPolarHBondContact O-CG2 3.5Å; R174-V178 PolarHBondContact O-N 3.27Å; R175-V178 PolarHBondContact O-N 3.35Å; V178-L180 VanDerWaalsContact C-N 3.32Å; V178-L180 PolarHBondContact O-N 3Å; V178-L181 WeakPolarHBondContact O-CB 3.28Å; V178-L181 PolarHBondContact O-N 2.88Å; V178-E182 HydrophobicContact CG1-CG 4.44Å; V178-E182 WeakPolarHBondContact O-CG 3.5Å; V178-E182 PolarHBondContact O-N 3.29Å
179	M	91.6	Very high	89.6	Confident	110 Å²	110	67.9 Å²	67.9	54%	0.542	32%	0.323	S	S	.	.	H	α-helix	trans	-59.2	-42.3	178.1	-176.2	-167	76.1	0	0	112.1	R175 K176 E182 Q183	R175-M179 WeakPolarHBondContact O-CB 3.44Å; R175-M179 PolarHBondContact O-N 3.15Å; K176-M179 PolarHBondContact O-N 3.38Å; M179-E182 PolarHBondContact O-N 3.5Å; M179-Q183 WeakPolarHBondContact O-CB 3.22Å; M179-Q183 PolarHBondContact O-N 3.01Å
180	L	91.1	Very high	90	Very high	56 Å²	56	69.9 Å²	69.9	29%	0.293	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-39.4	176.8	-74.2	166.5	0	0	0	112.2	L76 K176 G177 V178 Q183 L184 L210	L76-L180 HydrophobicContact CD1-CD1 3.76Å; K176-L180 WeakPolarHBondContact O-CB 3.28Å; K176-L180 WeakPolarHBondContact O-CG 3.46Å; K176-L180 PolarHBondContact O-N 3.19Å; G177-L180 PolarHBondContact O-N 2.91Å; V178-L180 VanDerWaalsContact C-N 3.32Å; V178-L180 PolarHBondContact O-N 3Å; L180-Q183 PolarHBondContact O-N 3.37Å; L180-L184 PolarHBondContact O-N 2.88Å; L180-L210 HydrophobicContact CB-CD1 4.29Å; L180-L210 HydrophobicContact CB-CD2 3.84Å; L180-L210 HydrophobicContact CD1-CD1 4.41Å
181	L	91.4	Very high	90.4	Very high	34 Å²	34	70.7 Å²	70.7	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-44.8	173.9	-79	169.9	0	0	0	111.6	G177 V178 Q183 L184 D185 L207 L210 Y211 L214	G177-L181 WeakPolarHBondContact O-CG 3.42Å; G177-L181 PolarHBondContact O-N 3.11Å; V178-L181 WeakPolarHBondContact O-CB 3.28Å; V178-L181 PolarHBondContact O-N 2.88Å; L181-Q183 VanDerWaalsContact C-N 3.35Å; L181-L184 PolarHBondContact O-N 3.15Å; L181-D185 VanDerWaalsContact O-CB 3.3Å; L181-D185 WeakPolarHBondContact O-CB 3.39Å; L181-D185 PolarHBondContact O-N 2.92Å; L181-L207 HydrophobicContact CD2-CD1 3.85Å; L181-L210 HydrophobicContact CB-CD2 4.41Å; L181-L210 HydrophobicContact CD2-CD2 3.73Å; L181-L210 HydrophobicContact CD2-CG 4.28Å; L181-L210 HydrophobicContact CG-CD2 3.83Å; L181-Y211 HydrophobicContact CD1-CE1 4.36Å; L181-Y211 HydrophobicContact CD2-CD1 4.15Å; L181-Y211 HydrophobicContact CD2-CE1 3.65Å; L181-Y211 HydrophobicContact CD2-CE2 4.25Å; L181-L214 HydrophobicContact CD1-CD1 3.5Å; L181-L214 VanDerWaalsContact CD1-CD1 3.5Å; L181-L214 HydrophobicContact CD2-CD1 3.99Å; L181-L214 HydrophobicContact CG-CD1 3.74Å
182	E	92.8	Very high	90.8	Very high	125 Å²	125	72.3 Å²	72.3	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-63.8	-40.2	177.5	-72.5	176.6	174.6	0	0	111.9	V178 M179 T186	V178-E182 HydrophobicContact CG1-CG 4.44Å; V178-E182 WeakPolarHBondContact O-CG 3.5Å; V178-E182 PolarHBondContact O-N 3.29Å; M179-E182 PolarHBondContact O-N 3.5Å; E182-T186 WeakPolarHBondContact O-CB 3.38Å; E182-T186 PolarHBondContact O-N 3.35Å; E182-T186 PolarHBondContact O-OG1 3.42Å
183	Q	94.2	Very high	91	Very high	99 Å²	99	73.5 Å²	73.5	46%	0.463	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-53	175.8	-176.4	-177.9	-20.6	0	0	111.3	M179 L180 L181 D185 T186 E187	M179-Q183 WeakPolarHBondContact O-CB 3.22Å; M179-Q183 PolarHBondContact O-N 3.01Å; L180-Q183 PolarHBondContact O-N 3.37Å; L181-Q183 VanDerWaalsContact C-N 3.35Å; Q183-D185 VanDerWaalsContact C-N 3.33Å; Q183-D185 PolarHBondContact O-N 3.44Å; Q183-T186 WeakPolarHBondContact O-CB 3.29Å; Q183-T186 PolarHBondContact O-N 3.37Å; Q183-T186 VanDerWaalsContact O-N 3.16Å; Q183-E187 PolarHBondContact NE2-OE1 3.31Å; Q183-E187 WeakPolarHBondContact O-CG 3.34Å; Q183-E187 PolarHBondContact O-N 3.18Å
184	L	92.1	Very high	91.3	Very high	32 Å²	32	78.4 Å²	78.4	17%	0.168	39%	0.387	C	S	.	.	H	α-helix	trans	-64.6	-35.5	-180	-72.5	-178.5	0	0	0	112.4	L180 L181 T186 E187 L188 L207 L210	L180-L184 PolarHBondContact O-N 2.88Å; L181-L184 PolarHBondContact O-N 3.15Å; L184-T186 VanDerWaalsContact C-N 3.32Å; L184-E187 PolarHBondContact O-N 2.75Å; L184-L188 VanDerWaalsContact O-CB 3.31Å; L184-L188 WeakPolarHBondContact O-CB 3.43Å; L184-L188 PolarHBondContact O-N 3.27Å; L184-L207 HydrophobicContact CB-CD1 4.22Å; L184-L210 HydrophobicContact CD1-CB 4.02Å; L184-L210 HydrophobicContact CD1-CD2 3.64Å; L184-L210 HydrophobicContact CD1-CG 4.44Å
185	D	92.8	Very high	91.3	Very high	60 Å²	60	78.2 Å²	78.2	32%	0.321	40%	0.401	S	S	.	.	H	α-helix	trans	-66.8	-35.8	175.2	-171.7	58.1	0	0	0	111.7	L181 Q183 L188 K189	L181-D185 VanDerWaalsContact O-CB 3.3Å; L181-D185 WeakPolarHBondContact O-CB 3.39Å; L181-D185 PolarHBondContact O-N 2.92Å; Q183-D185 VanDerWaalsContact C-N 3.33Å; Q183-D185 PolarHBondContact O-N 3.44Å; D185-L188 PolarHBondContact O-N 3.4Å; D185-K189 WeakPolarHBondContact O-CB 3.29Å; D185-K189 WeakPolarHBondContact O-CD 3.32Å; D185-K189 VanDerWaalsContact O-CG 3.28Å; D185-K189 WeakPolarHBondContact O-CG 3.43Å; D185-K189 PolarHBondContact O-N 3.36Å; D185-K189 WeakPolarHBondContact OD2-CE 3.15Å; D185-K189 IonicContact OD2-NZ 3.25Å; D185-K189 PolarHBondContact OD2-NZ 3.15Å
186	T	93.3	Very high	91.3	Very high	75 Å²	75	74.8 Å²	74.8	46%	0.46	39%	0.393	S	S	.	.	H	α-helix	trans	-66.7	-44.6	173.7	-56.2	0	0	0	0	111.4	E182 Q183 L184 K189 N190	E182-T186 WeakPolarHBondContact O-CB 3.38Å; E182-T186 PolarHBondContact O-N 3.35Å; E182-T186 PolarHBondContact O-OG1 3.42Å; Q183-T186 WeakPolarHBondContact O-CB 3.29Å; Q183-T186 PolarHBondContact O-N 3.37Å; Q183-T186 VanDerWaalsContact O-N 3.16Å; L184-T186 VanDerWaalsContact C-N 3.32Å; T186-K189 PolarHBondContact O-N 3.14Å; T186-N190 VanDerWaalsContact O-CG 3.28Å; T186-N190 PolarHBondContact O-N 3.15Å; T186-N190 PolarHBondContact O-ND2 3.4Å
187	E	93	Very high	91.4	Very high	74 Å²	74	75.3 Å²	75.3	35%	0.346	40%	0.395	S	S	.	.	H	α-helix	trans	-60.9	-44	174.3	-71	175.4	-167.1	0	0	111.5	Q183 L184 K189 N190 H191	Q183-E187 PolarHBondContact NE2-OE1 3.31Å; Q183-E187 WeakPolarHBondContact O-CG 3.34Å; Q183-E187 PolarHBondContact O-N 3.18Å; L184-E187 PolarHBondContact O-N 2.75Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 3.49Å; E187-N190 WeakPolarHBondContact O-CB 3.43Å; E187-N190 PolarHBondContact O-N 2.94Å; E187-N190 VanDerWaalsContact O-N 3.15Å; E187-H191 PolarHBondContact O-CD2 2.92Å; E187-H191 VanDerWaalsContact O-CG 3.31Å; E187-H191 PolarHBondContact O-N 3.43Å
188	L	90.7	Very high	91.4	Very high	7 Å²	7	78.9 Å²	78.9	4%	0.037	41%	0.412	C	S	.	.	H	α-helix	trans	-62.3	-40.1	176.5	-172.4	70.6	0	0	0	111.9	L184 D185 H191 K192 I200 L207	L184-L188 VanDerWaalsContact O-CB 3.31Å; L184-L188 WeakPolarHBondContact O-CB 3.43Å; L184-L188 PolarHBondContact O-N 3.27Å; D185-L188 PolarHBondContact O-N 3.4Å; L188-H191 PolarHBondContact O-N 2.91Å; L188-K192 HydrophobicContact CG-CD 4.41Å; L188-K192 WeakPolarHBondContact O-CB 3.24Å; L188-K192 VanDerWaalsContact O-CG 3.27Å; L188-K192 WeakPolarHBondContact O-CG 3.43Å; L188-K192 PolarHBondContact O-N 3.38Å; L188-I200 HydrophobicContact CD1-CG2 4.22Å; L188-L207 HydrophobicContact CD2-CD2 4.37Å
189	K	92.2	Very high	91.5	Very high	121 Å²	121	77.6 Å²	77.6	53%	0.526	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-42.1	173.5	-77.1	164.4	176.1	158.8	0	111.6	D185 T186 E187 K192 A193	D185-K189 WeakPolarHBondContact O-CB 3.29Å; D185-K189 WeakPolarHBondContact O-CD 3.32Å; D185-K189 VanDerWaalsContact O-CG 3.28Å; D185-K189 WeakPolarHBondContact O-CG 3.43Å; D185-K189 PolarHBondContact O-N 3.36Å; D185-K189 WeakPolarHBondContact OD2-CE 3.15Å; D185-K189 IonicContact OD2-NZ 3.25Å; D185-K189 PolarHBondContact OD2-NZ 3.15Å; T186-K189 PolarHBondContact O-N 3.14Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 3.49Å; K189-K192 PolarHBondContact O-N 3.4Å; K189-A193 PolarHBondContact O-N 2.97Å
190	N	93.1	Very high	91.5	Very high	92 Å²	92	72.7 Å²	72.7	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-43.4	175.4	-68.9	-22.3	0	0	0	111.8	T186 E187 K192 A193 N194	T186-N190 VanDerWaalsContact O-CG 3.28Å; T186-N190 PolarHBondContact O-N 3.15Å; T186-N190 PolarHBondContact O-ND2 3.4Å; E187-N190 WeakPolarHBondContact O-CB 3.43Å; E187-N190 PolarHBondContact O-N 2.94Å; E187-N190 VanDerWaalsContact O-N 3.15Å; N190-K192 VanDerWaalsContact C-N 3.33Å; N190-K192 PolarHBondContact O-N 3.45Å; N190-A193 WeakPolarHBondContact O-CB 3.32Å; N190-A193 PolarHBondContact O-N 2.88Å; N190-N194 PolarHBondContact O-N 3.28Å; N190-N194 PolarHBondContact O-ND2 3.15Å
191	H	90.8	Very high	91.6	Very high	55 Å²	55	70.9 Å²	70.9	26%	0.255	37%	0.37	S	S	.	.	H	α-helix	trans	-64.7	-37.4	175.9	-65.6	-41.9	0	0	0	112.7	E187 L188 N194 S195 I200	E187-H191 PolarHBondContact O-CD2 2.92Å; E187-H191 VanDerWaalsContact O-CG 3.31Å; E187-H191 PolarHBondContact O-N 3.43Å; L188-H191 PolarHBondContact O-N 2.91Å; H191-N194 PolarHBondContact O-N 2.96Å; H191-S195 PolarHBondContact O-N 3.41Å; H191-S195 VanDerWaalsContact O-N 3.11Å; H191-I200 HydrophobicContact CB-CG1 4Å
192	K	91.6	Very high	91.5	Very high	92 Å²	92	75.6 Å²	75.6	40%	0.4	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-40.9	172.9	-75.8	173.7	178.5	175.3	0	111.9	L188 K189 N190 N194 S195 I200	L188-K192 HydrophobicContact CG-CD 4.41Å; L188-K192 WeakPolarHBondContact O-CB 3.24Å; L188-K192 VanDerWaalsContact O-CG 3.27Å; L188-K192 WeakPolarHBondContact O-CG 3.43Å; L188-K192 PolarHBondContact O-N 3.38Å; K189-K192 PolarHBondContact O-N 3.4Å; N190-K192 VanDerWaalsContact C-N 3.33Å; N190-K192 PolarHBondContact O-N 3.45Å; K192-N194 VanDerWaalsContact C-N 3.33Å; K192-N194 PolarHBondContact O-N 3.49Å; K192-S195 PolarHBondContact O-N 3.4Å; K192-I200 HydrophobicContact CG-CD1 4.15Å; K192-I200 HydrophobicContact CG-CG1 4.11Å; K192-I200 HydrophobicContact CG-CG2 4.31Å
193	A	92.3	Very high	91.5	Very high	77 Å²	77	70.1 Å²	70.1	64%	0.636	36%	0.363	S	S	*	.	H	α-helix	trans	-62.4	-40.1	174.8	0	0	0	0	0	112.1	K189 N190 S195	K189-A193 PolarHBondContact O-N 2.97Å; N190-A193 WeakPolarHBondContact O-CB 3.32Å; N190-A193 PolarHBondContact O-N 2.88Å; A193-S195 VanDerWaalsContact C-N 3.25Å; A193-S195 PolarHBondContact O-N 3.38Å
194	N	92	Very high	91.4	Very high	108 Å²	108	65.7 Å²	65.7	58%	0.578	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-8.5	177.6	-65.8	-20	0	0	0	113.9	N190 H191 K192 I196	N190-N194 PolarHBondContact O-N 3.28Å; N190-N194 PolarHBondContact O-ND2 3.15Å; H191-N194 PolarHBondContact O-N 2.96Å; K192-N194 VanDerWaalsContact C-N 3.33Å; K192-N194 PolarHBondContact O-N 3.49Å; N194-I196 VanDerWaalsContact C-N 3.25Å; N194-I196 HydrophobicContact CB-CD1 4.12Å; N194-I196 HydrophobicContact CB-CG1 4.11Å; N194-I196 PolarHBondContact O-N 3.04Å
195	S	87.2	Confident	91.4	Very high	96 Å²	96	64.6 Å²	64.6	67%	0.671	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	31.5	178.6	-60.6	0	0	0	0	115.1	H191 K192 A193	H191-S195 PolarHBondContact O-N 3.41Å; H191-S195 VanDerWaalsContact O-N 3.11Å; K192-S195 PolarHBondContact O-N 3.4Å; A193-S195 VanDerWaalsContact C-N 3.25Å; A193-S195 PolarHBondContact O-N 3.38Å
196	I	89	Confident	91.3	Very high	83 Å²	83	65 Å²	65	43%	0.426	34%	0.339	S	S	.	.			trans	-93	106.8	178.7	-54.4	173.6	0	0	0	109.5	N194 E198 S199 I200	N194-I196 VanDerWaalsContact C-N 3.25Å; N194-I196 HydrophobicContact CB-CD1 4.12Å; N194-I196 HydrophobicContact CB-CG1 4.11Å; N194-I196 PolarHBondContact O-N 3.04Å; I196-E198 PolarHBondContact O-N 2.93Å; I196-S199 WeakPolarHBondContact CG2-OG 3.28Å; I196-S199 PolarHBondContact O-N 3.33Å; I196-I200 VanDerWaalsContact O-CG1 3.31Å; I196-I200 WeakPolarHBondContact O-CG1 3.4Å; I196-I200 PolarHBondContact O-N 2.88Å
197	K	89.9	Confident	91.3	Very high	120 Å²	120	61.9 Å²	61.9	52%	0.522	32%	0.32	S	S	.	.	H	α-helix	trans	-55.1	-46.5	-176.7	-68.2	-171.1	178	-172.2	0	113.5	S199 I200 R201 T232	K197-S199 PolarHBondContact O-N 3.41Å; K197-I200 PolarHBondContact O-N 2.89Å; K197-R201 WeakPolarHBondContact O-CB 3.3Å; K197-R201 PolarHBondContact O-N 2.99Å; K197-T232 HydrophobicContact CD-CG2 4.06Å
198	E	88.9	Confident	91.1	Very high	78 Å²	78	58.4 Å²	58.4	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-63.9	-40.8	-178.5	-179.9	56.1	-157.3	0	0	112.2	I196 R201 R202 Q236	I196-E198 PolarHBondContact O-N 2.93Å; E198-R201 PolarHBondContact O-N 2.91Å; E198-R201 IonicContact OE1-CZ 3.02Å; E198-R201 IonicContact OE1-NE 2.83Å; E198-R201 IonicContact OE1-NH2 2.66Å; E198-R201 PolarHBondContact OE1-NH2 3.26Å; E198-R201 IonicContact OE2-CZ 2.91Å; E198-R201 IonicContact OE2-NE 2.81Å; E198-R201 PolarHBondContact OE2-NE 3.42Å; E198-R201 IonicContact OE2-NH2 3.16Å; E198-R202 WeakPolarHBondContact O-CG 3.26Å; E198-R202 PolarHBondContact O-N 2.91Å; E198-R202 WeakPolarHBondContact OE1-CG 3.46Å; E198-Q236 PolarHBondContact OE2-NE2 3.12Å
199	S	91.9	Very high	91	Very high	35 Å²	35	61 Å²	61	25%	0.245	32%	0.318	C	S	.	.	H	α-helix	trans	-68.2	-38.3	177.6	-53.8	0	0	0	0	112.2	I196 K197 R201 G203	I196-S199 WeakPolarHBondContact CG2-OG 3.28Å; I196-S199 PolarHBondContact O-N 3.33Å; K197-S199 PolarHBondContact O-N 3.41Å; S199-R201 VanDerWaalsContact C-N 3.34Å; S199-G203 PolarHBondContact O-N 2.97Å
200	I	91.9	Very high	90.9	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-40.7	175.3	-61.5	164	0	0	0	110.5	L188 H191 K192 I196 K197 S204 Y230	L188-I200 HydrophobicContact CD1-CG2 4.22Å; H191-I200 HydrophobicContact CB-CG1 4Å; K192-I200 HydrophobicContact CG-CD1 4.15Å; K192-I200 HydrophobicContact CG-CG1 4.11Å; K192-I200 HydrophobicContact CG-CG2 4.31Å; I196-I200 VanDerWaalsContact O-CG1 3.31Å; I196-I200 WeakPolarHBondContact O-CG1 3.4Å; I196-I200 PolarHBondContact O-N 2.88Å; K197-I200 PolarHBondContact O-N 2.89Å; I200-S204 WeakPolarHBondContact O-CB 3.12Å; I200-S204 PolarHBondContact O-N 3.28Å; I200-S204 PolarHBondContact O-OG 2.85Å; I200-Y230 HydrophobicContact CB-CD1 4.22Å; I200-Y230 HydrophobicContact CB-CD2 4.48Å; I200-Y230 HydrophobicContact CB-CE1 4.36Å; I200-Y230 HydrophobicContact CB-CG 4.28Å; I200-Y230 HydrophobicContact CD1-CD1 4.21Å; I200-Y230 HydrophobicContact CD1-CE1 3.91Å; I200-Y230 HydrophobicContact CG2-CD1 4Å; I200-Y230 HydrophobicContact CG2-CD2 3.68Å; I200-Y230 HydrophobicContact CG2-CE1 3.82Å; I200-Y230 HydrophobicContact CG2-CE2 3.47Å; I200-Y230 VanDerWaalsContact CG2-CE2 3.47Å; I200-Y230 HydrophobicContact CG2-CG 3.93Å
201	R	92.5	Very high	90.8	Very high	17 Å²	17	53.6 Å²	53.6	6%	0.064	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-52.6	177	-168.1	-163.7	68.2	70.1	5.2	111.1	K197 E198 S199 G203 S204 D205	K197-R201 WeakPolarHBondContact O-CB 3.3Å; K197-R201 PolarHBondContact O-N 2.99Å; E198-R201 PolarHBondContact O-N 2.91Å; E198-R201 IonicContact OE1-CZ 3.02Å; E198-R201 IonicContact OE1-NE 2.83Å; E198-R201 IonicContact OE1-NH2 2.66Å; E198-R201 PolarHBondContact OE1-NH2 3.26Å; E198-R201 IonicContact OE2-CZ 2.91Å; E198-R201 IonicContact OE2-NE 2.81Å; E198-R201 PolarHBondContact OE2-NE 3.42Å; E198-R201 IonicContact OE2-NH2 3.16Å; S199-R201 VanDerWaalsContact C-N 3.34Å; R201-G203 PolarHBondContact O-N 3.49Å; R201-S204 PolarHBondContact O-N 3.35Å; R201-S204 VanDerWaalsContact O-N 3.17Å; R201-D205 IonicContact CZ-OD2 2.8Å; R201-D205 IonicContact NH1-OD2 3.75Å; R201-D205 PolarHBondContact NH1-OD2 3.45Å; R201-D205 PolarHBondContact O-N 3.04Å
202	R	90.1	Very high	90.6	Very high	133 Å²	133	51.7 Å²	51.7	50%	0.502	27%	0.272	S	S	.	.	H	α-helix	trans	-57.9	-48.8	176.7	-71.3	-66.7	-65.2	-169.2	-5.5	111.9	E198 S204 D205 D206	E198-R202 WeakPolarHBondContact O-CG 3.26Å; E198-R202 PolarHBondContact O-N 2.91Å; E198-R202 WeakPolarHBondContact OE1-CG 3.46Å; R202-S204 PolarHBondContact O-N 2.92Å; R202-D205 PolarHBondContact O-N 2.89Å; R202-D205 VanDerWaalsContact O-N 3.09Å; R202-D206 PolarHBondContact O-N 2.96Å
203	G	92.4	Very high	90.3	Very high	10 Å²	10	51.7 Å²	51.7	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-31.5	177.7	0	0	0	0	0	113.5	S199 R201 L207	S199-G203 PolarHBondContact O-N 2.97Å; R201-G203 PolarHBondContact O-N 3.49Å; G203-L207 VanDerWaalsContact O-CB 3.3Å; G203-L207 WeakPolarHBondContact O-CB 3.37Å; G203-L207 PolarHBondContact O-N 3.41Å
204	S	92	Very high	89.9	Confident	7 Å²	7	49.2 Å²	49.2	5%	0.049	25%	0.249	C	C	.	.	H	α-helix	trans	-72.9	-37.2	174.6	-57.5	0	0	0	0	112.5	I200 R201 R202 G208	I200-S204 WeakPolarHBondContact O-CB 3.12Å; I200-S204 PolarHBondContact O-N 3.28Å; I200-S204 PolarHBondContact O-OG 2.85Å; R201-S204 PolarHBondContact O-N 3.35Å; R201-S204 VanDerWaalsContact O-N 3.17Å; R202-S204 PolarHBondContact O-N 2.92Å; S204-G208 PolarHBondContact O-N 2.86Å
205	D	91	Very high	89.4	Confident	9 Å²	9	45 Å²	45	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-44.4	174.6	-67.3	-20.8	0	0	0	110.7	R201 R202 L207 G208 D209 F224 S227	R201-D205 IonicContact CZ-OD2 2.8Å; R201-D205 IonicContact NH1-OD2 3.75Å; R201-D205 PolarHBondContact NH1-OD2 3.45Å; R201-D205 PolarHBondContact O-N 3.04Å; R202-D205 PolarHBondContact O-N 2.89Å; R202-D205 VanDerWaalsContact O-N 3.09Å; D205-L207 VanDerWaalsContact C-N 3.33Å; D205-L207 PolarHBondContact O-N 3.37Å; D205-G208 CarbonylContact O-C 3.38Å; D205-G208 WeakPolarHBondContact O-CA 3.2Å; D205-G208 PolarHBondContact O-N 2.89Å; D205-G208 VanDerWaalsContact O-N 3.08Å; D205-D209 PolarHBondContact O-N 3.03Å; D205-F224 HydrophobicContact CB-CE1 4.49Å; D205-S227 PolarHBondContact OD1-OG 3.42Å
206	D	91.9	Very high	89.4	Confident	67 Å²	67	44.5 Å²	44.5	36%	0.358	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-40.6	177.9	-63.3	-28.2	0	0	0	111.2	R202 D209 L210	R202-D206 PolarHBondContact O-N 2.96Å; D206-D209 PolarHBondContact O-N 2.71Å; D206-L210 PolarHBondContact O-N 3.43Å
207	L	92.1	Very high	89.4	Confident	11 Å²	11	41.6 Å²	41.6	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-40.4	172.8	-175.4	67.1	0	0	0	111.6	L181 L184 L188 G203 D205 L210 Y211	L181-L207 HydrophobicContact CD2-CD1 3.85Å; L184-L207 HydrophobicContact CB-CD1 4.22Å; L188-L207 HydrophobicContact CD2-CD2 4.37Å; G203-L207 VanDerWaalsContact O-CB 3.3Å; G203-L207 WeakPolarHBondContact O-CB 3.37Å; G203-L207 PolarHBondContact O-N 3.41Å; D205-L207 VanDerWaalsContact C-N 3.33Å; D205-L207 PolarHBondContact O-N 3.37Å; L207-L210 PolarHBondContact O-N 3.46Å; L207-Y211 HydrophobicContact CD1-CD2 4.31Å; L207-Y211 HydrophobicContact CD1-CE2 3.83Å; L207-Y211 HydrophobicContact CD2-CE2 3.99Å; L207-Y211 HydrophobicContact CG-CD2 3.93Å; L207-Y211 HydrophobicContact CG-CE2 3.61Å; L207-Y211 WeakPolarHBondContact O-CD2 3.31Å; L207-Y211 PolarHBondContact O-N 2.85Å
208	G	90.4	Very high	89.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-42.8	174.6	0	0	0	0	0	112.6	S204 D205 Y211 L212 F224	S204-G208 PolarHBondContact O-N 2.86Å; D205-G208 CarbonylContact O-C 3.38Å; D205-G208 WeakPolarHBondContact O-CA 3.2Å; D205-G208 PolarHBondContact O-N 2.89Å; D205-G208 VanDerWaalsContact O-N 3.08Å; G208-Y211 PolarHBondContact O-N 3.48Å; G208-L212 WeakPolarHBondContact O-CG 3.3Å; G208-L212 PolarHBondContact O-N 3.31Å; G208-F224 VanDerWaalsContact C-CZ 3.44Å
209	D	88.7	Confident	89.4	Confident	63 Å²	63	36.9 Å²	36.9	34%	0.337	19%	0.191	S	C	.	.	H	α-helix	trans	-66	-38.5	175.9	-79.8	-23.5	0	0	0	112.1	D205 D206 L212 Q213	D205-D209 PolarHBondContact O-N 3.03Å; D206-D209 PolarHBondContact O-N 2.71Å; D209-L212 WeakPolarHBondContact O-CB 3.41Å; D209-L212 PolarHBondContact O-N 3Å; D209-Q213 WeakPolarHBondContact O-CG 3.19Å; D209-Q213 PolarHBondContact O-N 3.3Å
210	L	88.8	Confident	89.3	Confident	11 Å²	11	35.2 Å²	35.2	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-43	172.8	-177.3	63.1	0	0	0	111.5	L76 L180 L181 L184 D206 L207 L212 Q213 L214	L76-L210 HydrophobicContact CD1-CD1 4.04Å; L180-L210 HydrophobicContact CB-CD1 4.29Å; L180-L210 HydrophobicContact CB-CD2 3.84Å; L180-L210 HydrophobicContact CD1-CD1 4.41Å; L181-L210 HydrophobicContact CB-CD2 4.41Å; L181-L210 HydrophobicContact CD2-CD2 3.73Å; L181-L210 HydrophobicContact CD2-CG 4.28Å; L181-L210 HydrophobicContact CG-CD2 3.83Å; L184-L210 HydrophobicContact CD1-CB 4.02Å; L184-L210 HydrophobicContact CD1-CD2 3.64Å; L184-L210 HydrophobicContact CD1-CG 4.44Å; D206-L210 PolarHBondContact O-N 3.43Å; L207-L210 PolarHBondContact O-N 3.46Å; L210-L212 VanDerWaalsContact C-N 3.26Å; L210-L212 PolarHBondContact O-N 3.45Å; L210-Q213 WeakPolarHBondContact O-CB 3.36Å; L210-Q213 PolarHBondContact O-N 3.24Å; L210-L214 HydrophobicContact CG-CD1 4.14Å; L210-L214 WeakPolarHBondContact O-CG 3.48Å; L210-L214 PolarHBondContact O-N 2.86Å
211	Y	90.4	Very high	89.2	Confident	45 Å²	45	36.2 Å²	36.2	18%	0.176	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-33.9	174.9	-80.9	-58.1	0	0	0	112.8	L181 L207 G208 L214 G215 Q216 N219 C223	L181-Y211 HydrophobicContact CD1-CE1 4.36Å; L181-Y211 HydrophobicContact CD2-CD1 4.15Å; L181-Y211 HydrophobicContact CD2-CE1 3.65Å; L181-Y211 HydrophobicContact CD2-CE2 4.25Å; L207-Y211 HydrophobicContact CD1-CD2 4.31Å; L207-Y211 HydrophobicContact CD1-CE2 3.83Å; L207-Y211 HydrophobicContact CD2-CE2 3.99Å; L207-Y211 HydrophobicContact CG-CD2 3.93Å; L207-Y211 HydrophobicContact CG-CE2 3.61Å; L207-Y211 WeakPolarHBondContact O-CD2 3.31Å; L207-Y211 PolarHBondContact O-N 2.85Å; G208-Y211 PolarHBondContact O-N 3.48Å; Y211-L214 HydrophobicContact CD1-CD1 4.45Å; Y211-L214 PolarHBondContact O-N 3.14Å; Y211-G215 PolarHBondContact O-N 3Å; Y211-G215 VanDerWaalsContact O-N 3.15Å; Y211-Q216 HydrophobicContact CD1-CB 4.05Å; Y211-Q216 VanDerWaalsContact CE1-OE1 3.32Å; Y211-Q216 PolarHBondContact O-N 2.92Å; Y211-N219 HydrophobicContact CD1-CB 3.8Å; Y211-N219 HydrophobicContact CD2-CB 4.22Å; Y211-N219 HydrophobicContact CE1-CB 3.85Å; Y211-N219 HydrophobicContact CE2-CB 4.25Å; Y211-N219 HydrophobicContact CG-CB 4.01Å; Y211-C223 VanDerWaalsContact CD2-SG 3.6Å; Y211-C223 WeakPolarHBondContact CE2-SG 3.3Å
212	L	86.6	Confident	89.1	Confident	16 Å²	16	39.5 Å²	39.5	8%	0.084	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-37.5	171.4	-72.7	175.9	0	0	0	112.2	G208 D209 L210 L214 G215 L217 A220 F224 V247 F250	G208-L212 WeakPolarHBondContact O-CG 3.3Å; G208-L212 PolarHBondContact O-N 3.31Å; D209-L212 WeakPolarHBondContact O-CB 3.41Å; D209-L212 PolarHBondContact O-N 3Å; L210-L212 VanDerWaalsContact C-N 3.26Å; L210-L212 PolarHBondContact O-N 3.45Å; L212-L214 VanDerWaalsContact C-N 3.32Å; L212-G215 PolarHBondContact O-N 3.03Å; L212-L217 HydrophobicContact CD2-CD2 3.84Å; L212-A220 HydrophobicContact CD2-CB 3.98Å; L212-A220 HydrophobicContact CG-CB 4.01Å; L212-F224 HydrophobicContact CD1-CE2 3.99Å; L212-F224 HydrophobicContact CD1-CZ 4.15Å; L212-F224 HydrophobicContact CG-CE2 4.38Å; L212-V247 HydrophobicContact CD1-CG2 4.17Å; L212-V247 HydrophobicContact CD2-CG1 4.35Å; L212-V247 HydrophobicContact CD2-CG2 3.84Å; L212-V247 HydrophobicContact CG-CG2 4.35Å; L212-F250 HydrophobicContact CD2-CD2 4.15Å; L212-F250 HydrophobicContact CD2-CE2 4.36Å
213	Q	85.4	Confident	89.1	Confident	92 Å²	92	33.4 Å²	33.4	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-69.7	-27.9	175.1	-69.6	177.7	1.1	0	0	113.5	L76 D77 D209 L210	L76-Q213 PolarHBondContact N-O 2.8Å; D77-Q213 PolarHBondContact N-O 3.38Å; D209-Q213 WeakPolarHBondContact O-CG 3.19Å; D209-Q213 PolarHBondContact O-N 3.3Å; L210-Q213 WeakPolarHBondContact O-CB 3.36Å; L210-Q213 PolarHBondContact O-N 3.24Å
214	L	85.2	Confident	89	Confident	24 Å²	24	33 Å²	33	13%	0.126	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-8.2	175.1	-67.3	170.1	0	0	0	113.3	L76 L181 L210 Y211 L212 Q216	L76-L214 HydrophobicContact CB-CD2 3.84Å; L181-L214 HydrophobicContact CD1-CD1 3.5Å; L181-L214 VanDerWaalsContact CD1-CD1 3.5Å; L181-L214 HydrophobicContact CD2-CD1 3.99Å; L181-L214 HydrophobicContact CG-CD1 3.74Å; L210-L214 HydrophobicContact CG-CD1 4.14Å; L210-L214 WeakPolarHBondContact O-CG 3.48Å; L210-L214 PolarHBondContact O-N 2.86Å; Y211-L214 HydrophobicContact CD1-CD1 4.45Å; Y211-L214 PolarHBondContact O-N 3.14Å; L212-L214 VanDerWaalsContact C-N 3.32Å; L214-Q216 VanDerWaalsContact C-N 3.33Å; L214-Q216 PolarHBondContact O-N 3.2Å
215	G	81.9	Confident	88.9	Confident	20 Å²	20	35.1 Å²	35.1	21%	0.206	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	7	-178.6	0	0	0	0	0	115.2	Y211 L212 L217	Y211-G215 PolarHBondContact O-N 3Å; Y211-G215 VanDerWaalsContact O-N 3.15Å; L212-G215 PolarHBondContact O-N 3.03Å; G215-L217 PolarHBondContact O-N 2.87Å; G215-L217 VanDerWaalsContact O-N 3.16Å
216	Q	87.4	Confident	88.8	Confident	85 Å²	85	41.6 Å²	41.6	40%	0.397	21%	0.214	S	C	.	.			trans	-88.5	79.5	179.7	-65.9	-173.2	-2.2	0	0	111.6	Y211 L214 S218 N219 A220	Y211-Q216 HydrophobicContact CD1-CB 4.05Å; Y211-Q216 VanDerWaalsContact CE1-OE1 3.32Å; Y211-Q216 PolarHBondContact O-N 2.92Å; L214-Q216 VanDerWaalsContact C-N 3.33Å; L214-Q216 PolarHBondContact O-N 3.2Å; Q216-S218 VanDerWaalsContact C-N 3.35Å; Q216-S218 PolarHBondContact O-N 3.41Å; Q216-N219 HydrophobicContact CB-CB 4.29Å; Q216-N219 PolarHBondContact O-N 3.35Å; Q216-N219 PolarHBondContact OE1-ND2 2.85Å; Q216-A220 PolarHBondContact O-N 3.48Å
217	L	87.1	Confident	88.6	Confident	23 Å²	23	38.4 Å²	38.4	12%	0.12	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-37.2	-174.6	-55.6	179.8	0	0	0	113.2	Y43 L212 G215 A220 N221 V247 F250 Q251	Y43-L217 HydrophobicContact CD1-CD2 4.45Å; Y43-L217 HydrophobicContact CE1-CD1 4.17Å; Y43-L217 HydrophobicContact CE1-CD2 4.13Å; L212-L217 HydrophobicContact CD2-CD2 3.84Å; G215-L217 PolarHBondContact O-N 2.87Å; G215-L217 VanDerWaalsContact O-N 3.16Å; L217-A220 PolarHBondContact O-N 3.29Å; L217-N221 PolarHBondContact O-N 3.3Å; L217-N221 VanDerWaalsContact O-N 3.08Å; L217-V247 HydrophobicContact CB-CG1 4.3Å; L217-V247 VanDerWaalsContact O-CG1 3.25Å; L217-V247 WeakPolarHBondContact O-CG1 3.44Å; L217-F250 HydrophobicContact CD1-CB 3.81Å; L217-F250 HydrophobicContact CD2-CB 4.03Å; L217-F250 HydrophobicContact CD2-CD2 4.26Å; L217-Q251 HydrophobicContact CB-CG 3.75Å; L217-Q251 HydrophobicContact CD1-CG 4.05Å; L217-Q251 PolarHBondContact O-NE2 3.06Å
218	S	89.8	Confident	88.4	Confident	53 Å²	53	44.3 Å²	44.3	37%	0.371	22%	0.219	S	C	.	.	H	α-helix	trans	-65.1	-44.8	-178.7	55.5	0	0	0	0	112	Q216 N221 K222	Q216-S218 VanDerWaalsContact C-N 3.35Å; Q216-S218 PolarHBondContact O-N 3.41Å; S218-N221 PolarHBondContact O-N 3.31Å; S218-K222 WeakPolarHBondContact O-CG 3.4Å; S218-K222 PolarHBondContact O-N 2.94Å; S218-K222 VanDerWaalsContact O-N 3.11Å
219	N	89	Confident	88.3	Confident	45 Å²	45	49.2 Å²	49.2	24%	0.241	25%	0.245	C	C	.	.	H	α-helix	trans	-69.6	-37.9	178.1	-68.7	-23.1	0	0	0	111.9	Y211 Q216 N221 K222 C223	Y211-N219 HydrophobicContact CD1-CB 3.8Å; Y211-N219 HydrophobicContact CD2-CB 4.22Å; Y211-N219 HydrophobicContact CE1-CB 3.85Å; Y211-N219 HydrophobicContact CE2-CB 4.25Å; Y211-N219 HydrophobicContact CG-CB 4.01Å; Q216-N219 HydrophobicContact CB-CB 4.29Å; Q216-N219 PolarHBondContact O-N 3.35Å; Q216-N219 PolarHBondContact OE1-ND2 2.85Å; N219-N221 VanDerWaalsContact C-N 3.34Å; N219-N221 PolarHBondContact O-N 3Å; N219-K222 PolarHBondContact O-N 2.94Å; N219-C223 PolarHBondContact O-N 2.84Å; N219-C223 PolarHBondContact O-SG 3.31Å
220	A	90.1	Very high	88.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-48.5	172.2	0	0	0	0	0	111.1	L212 Q216 L217 K222 C223 F224 V247	L212-A220 HydrophobicContact CD2-CB 3.98Å; L212-A220 HydrophobicContact CG-CB 4.01Å; Q216-A220 PolarHBondContact O-N 3.48Å; L217-A220 PolarHBondContact O-N 3.29Å; A220-K222 PolarHBondContact O-N 2.87Å; A220-C223 PolarHBondContact O-N 2.99Å; A220-C223 VanDerWaalsContact O-N 3.1Å; A220-F224 HydrophobicContact CB-CE2 4.2Å; A220-F224 WeakPolarHBondContact O-CD2 3.38Å; A220-F224 PolarHBondContact O-N 3.46Å; A220-V247 HydrophobicContact CB-CG1 4.2Å; A220-V247 HydrophobicContact CB-CG2 4.32Å
221	N	89.5	Confident	88.3	Confident	30 Å²	30	49.8 Å²	49.8	16%	0.16	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-42.5	178.7	-167	20.2	0	0	0	112.1	L217 S218 N219 C223 F224 A225 V247	L217-N221 PolarHBondContact O-N 3.3Å; L217-N221 VanDerWaalsContact O-N 3.08Å; S218-N221 PolarHBondContact O-N 3.31Å; N219-N221 VanDerWaalsContact C-N 3.34Å; N219-N221 PolarHBondContact O-N 3Å; N221-C223 VanDerWaalsContact C-N 3.28Å; N221-C223 PolarHBondContact O-N 3.34Å; N221-F224 PolarHBondContact O-N 3.15Å; N221-A225 VanDerWaalsContact O-CB 3.3Å; N221-A225 WeakPolarHBondContact O-CB 3.49Å; N221-A225 PolarHBondContact O-N 2.99Å; N221-V247 HydrophobicContact CB-CG1 3.96Å
222	K	91	Very high	88.2	Confident	86 Å²	86	52.4 Å²	52.4	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-37.5	174.8	-68.4	171	-175.2	171.4	0	111.6	D126 S218 N219 A220 R226	D126-K222 IonicContact OD1-NZ 3.57Å; D126-K222 PolarHBondContact OD1-NZ 3.47Å; D126-K222 IonicContact OD2-NZ 2.75Å; D126-K222 PolarHBondContact OD2-NZ 3.48Å; S218-K222 WeakPolarHBondContact O-CG 3.4Å; S218-K222 PolarHBondContact O-N 2.94Å; S218-K222 VanDerWaalsContact O-N 3.11Å; N219-K222 PolarHBondContact O-N 2.94Å; A220-K222 PolarHBondContact O-N 2.87Å; K222-R226 VanDerWaalsContact O-CG 3.27Å; K222-R226 WeakPolarHBondContact O-CG 3.03Å; K222-R226 PolarHBondContact O-N 2.92Å
223	C	89.9	Confident	88.2	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.034	28%	0.277	C	S	.	.	H	α-helix	trans	-70.6	-46	178.4	-64.7	0	0	0	0	112.6	Y211 N219 A220 N221 A225 R226 S227	Y211-C223 VanDerWaalsContact CD2-SG 3.6Å; Y211-C223 WeakPolarHBondContact CE2-SG 3.3Å; N219-C223 PolarHBondContact O-N 2.84Å; N219-C223 PolarHBondContact O-SG 3.31Å; A220-C223 PolarHBondContact O-N 2.99Å; A220-C223 VanDerWaalsContact O-N 3.1Å; N221-C223 VanDerWaalsContact C-N 3.28Å; N221-C223 PolarHBondContact O-N 3.34Å; C223-A225 VanDerWaalsContact C-N 3.31Å; C223-A225 PolarHBondContact O-N 2.94Å; C223-R226 WeakPolarHBondContact O-CB 3.35Å; C223-R226 PolarHBondContact O-N 3.1Å; C223-S227 PolarHBondContact O-N 2.94Å
224	F	91	Very high	88.2	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-32.9	175.5	-64.2	-57.8	0	0	0	112.6	D205 G208 L212 A220 N221 R226 S227 M240 N243 V244 V247	D205-F224 HydrophobicContact CB-CE1 4.49Å; G208-F224 VanDerWaalsContact C-CZ 3.44Å; L212-F224 HydrophobicContact CD1-CE2 3.99Å; L212-F224 HydrophobicContact CD1-CZ 4.15Å; L212-F224 HydrophobicContact CG-CE2 4.38Å; A220-F224 HydrophobicContact CB-CE2 4.2Å; A220-F224 WeakPolarHBondContact O-CD2 3.38Å; A220-F224 PolarHBondContact O-N 3.46Å; N221-F224 PolarHBondContact O-N 3.15Å; F224-R226 VanDerWaalsContact C-N 3.33Å; F224-R226 PolarHBondContact O-N 3.32Å; F224-S227 PolarHBondContact O-N 3.43Å; F224-S227 PolarHBondContact O-OG 3.35Å; F224-M240 WeakPolarHBondContact O-CG 3.18Å; F224-N243 HydrophobicContact CD1-CB 3.77Å; F224-N243 HydrophobicContact CD2-CB 4.44Å; F224-N243 HydrophobicContact CE1-CB 3.91Å; F224-N243 HydrophobicContact CG-CB 4.06Å; F224-N243 HydrophobicContact CZ-CB 4.3Å; F224-V244 HydrophobicContact CB-CG2 3.68Å; F224-V247 HydrophobicContact CD2-CG2 3.57Å; F224-V247 HydrophobicContact CE2-CG2 3.48Å; F224-V247 VanDerWaalsContact CE2-CG2 3.48Å
225	A	89.6	Confident	88.2	Confident	51 Å²	51	54.3 Å²	54.3	42%	0.421	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-33.6	174	0	0	0	0	0	112.6	N221 C223 R228	N221-A225 VanDerWaalsContact O-CB 3.3Å; N221-A225 WeakPolarHBondContact O-CB 3.49Å; N221-A225 PolarHBondContact O-N 2.99Å; C223-A225 VanDerWaalsContact C-N 3.31Å; C223-A225 PolarHBondContact O-N 2.94Å; A225-R228 VanDerWaalsContact O-CB 3.28Å; A225-R228 WeakPolarHBondContact O-CB 3.3Å
226	R	88.5	Confident	88.4	Confident	145 Å²	145	55 Å²	55	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-70.7	-28.9	175.8	-73.4	169.5	-174.1	170.9	1.8	112.8	K222 C223 F224 R228	K222-R226 VanDerWaalsContact O-CG 3.27Å; K222-R226 WeakPolarHBondContact O-CG 3.03Å; K222-R226 PolarHBondContact O-N 2.92Å; C223-R226 WeakPolarHBondContact O-CB 3.35Å; C223-R226 PolarHBondContact O-N 3.1Å; F224-R226 VanDerWaalsContact C-N 3.33Å; F224-R226 PolarHBondContact O-N 3.32Å; R226-R228 PolarHBondContact O-N 3.47Å
227	S	87.9	Confident	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.3	-19.7	-180	68.5	0	0	0	0	112.8	D205 C223 F224 D229 Y230 C231	D205-S227 PolarHBondContact OD1-OG 3.42Å; C223-S227 PolarHBondContact O-N 2.94Å; F224-S227 PolarHBondContact O-N 3.43Å; F224-S227 PolarHBondContact O-OG 3.35Å; S227-D229 VanDerWaalsContact C-N 3.32Å; S227-D229 PolarHBondContact O-N 3.22Å; S227-Y230 PolarHBondContact O-N 2.97Å; S227-Y230 VanDerWaalsContact O-N 3.16Å; S227-C231 PolarHBondContact O-SG 3.34Å; S227-C231 VanDerWaalsContact O-SG 3.41Å
228	R	88.3	Confident	88.4	Confident	135 Å²	135	53.3 Å²	53.3	51%	0.509	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-50.1	-45.2	175.5	-169	-172	65	-177	-3.4	113.9	A225 R226 Y230 C231 M240	A225-R228 VanDerWaalsContact O-CB 3.28Å; A225-R228 WeakPolarHBondContact O-CB 3.3Å; R226-R228 PolarHBondContact O-N 3.47Å; R228-Y230 PolarHBondContact O-N 3.46Å; R228-C231 PolarHBondContact O-N 2.89Å; R228-M240 HydrophobicContact CB-SD 3.48Å; R228-M240 WeakPolarHBondContact CB-SD 3.42Å; R228-M240 HydrophobicContact CG-SD 3.77Å
229	D	88.5	Confident	88.3	Confident	104 Å²	104	53.5 Å²	53.5	56%	0.556	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-72.8	-12.4	-171.7	-55.3	-30.2	0	0	0	112.5	S227	S227-D229 VanDerWaalsContact C-N 3.32Å; S227-D229 PolarHBondContact O-N 3.22Å
230	Y	89.9	Confident	88.3	Confident	68 Å²	68	51.7 Å²	51.7	27%	0.267	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-104.4	-2.2	179.4	-54.8	-73.8	0	0	0	113.5	I200 S227 R228	I200-Y230 HydrophobicContact CB-CD1 4.22Å; I200-Y230 HydrophobicContact CB-CD2 4.48Å; I200-Y230 HydrophobicContact CB-CE1 4.36Å; I200-Y230 HydrophobicContact CB-CG 4.28Å; I200-Y230 HydrophobicContact CD1-CD1 4.21Å; I200-Y230 HydrophobicContact CD1-CE1 3.91Å; I200-Y230 HydrophobicContact CG2-CD1 4Å; I200-Y230 HydrophobicContact CG2-CD2 3.68Å; I200-Y230 HydrophobicContact CG2-CE1 3.82Å; I200-Y230 HydrophobicContact CG2-CE2 3.47Å; I200-Y230 VanDerWaalsContact CG2-CE2 3.47Å; I200-Y230 HydrophobicContact CG2-CG 3.93Å; S227-Y230 PolarHBondContact O-N 2.97Å; S227-Y230 VanDerWaalsContact O-N 3.16Å; R228-Y230 PolarHBondContact O-N 3.46Å
231	C	87.2	Confident	88.2	Confident	17 Å²	17	51.7 Å²	51.7	12%	0.115	26%	0.257	C	S	.	.			trans	-71	134.5	175.2	-66.8	0	0	0	0	110.7	S227 R228 Q236 E237	S227-C231 PolarHBondContact O-SG 3.34Å; S227-C231 VanDerWaalsContact O-SG 3.41Å; R228-C231 PolarHBondContact O-N 2.89Å; C231-Q236 HydrophobicContact CB-CB 4.15Å; C231-E237 HydrophobicContact CB-CG 3.64Å
232	T	88.5	Confident	88.1	Confident	101 Å²	101	51.1 Å²	51.1	62%	0.62	25%	0.254	S	S	*	.			trans	-119.1	-26.4	176.3	56.3	0	0	0	0	112.5	K197 Q236	K197-T232 HydrophobicContact CD-CG2 4.06Å; T232-Q236 PolarHBondContact OG1-OE1 3.03Å
233	S	87.8	Confident	88	Confident	45 Å²	45	48.5 Å²	48.5	32%	0.315	24%	0.244	S	C	.	.	S	Bend	trans	-106.2	141.9	177.8	174.3	0	0	0	0	110.5	Q235 Q236 E237	S233-Q235 PolarHBondContact O-N 3.07Å; S233-Q235 VanDerWaalsContact O-N 3.17Å; S233-Q235 PolarHBondContact OG-N 3.29Å; S233-Q236 WeakPolarHBondContact O-CA 3.35Å; S233-Q236 VanDerWaalsContact O-CB 3.32Å; S233-Q236 WeakPolarHBondContact O-CB 3.43Å; S233-Q236 PolarHBondContact O-N 3.15Å; S233-E237 PolarHBondContact O-N 3.24Å; S233-E237 VanDerWaalsContact O-N 3.12Å
234	Q	84.9	Confident	88	Confident	44 Å²	44	48.4 Å²	48.4	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-54.5	-32.4	172.3	-174.1	-170.3	-8.9	0	0	112.5	Q236 E237 L238 L267	Q234-Q236 VanDerWaalsContact C-N 3.33Å; Q234-Q236 PolarHBondContact O-N 2.81Å; Q234-E237 PolarHBondContact O-N 3.4Å; Q234-L238 HydrophobicContact CG-CD1 4.5Å; Q234-L238 WeakPolarHBondContact O-CB 3.47Å; Q234-L238 VanDerWaalsContact O-CG 3.32Å; Q234-L238 WeakPolarHBondContact O-CG 3.4Å; Q234-L238 PolarHBondContact O-N 2.59Å; Q234-L267 HydrophobicContact CG-CB 4.43Å; Q234-L267 HydrophobicContact CG-CD2 4.42Å; Q234-L267 PolarHBondContact NE2-O 2.97Å
235	Q	84.4	Confident	87.9	Confident	83 Å²	83	48.7 Å²	48.7	39%	0.388	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-40	174.8	-175.4	-179.8	-1.1	0	0	111.7	S233 L238 T239 Y348	S233-Q235 PolarHBondContact O-N 3.07Å; S233-Q235 VanDerWaalsContact O-N 3.17Å; S233-Q235 PolarHBondContact OG-N 3.29Å; Q235-L238 PolarHBondContact O-N 3.21Å; Q235-T239 PolarHBondContact O-N 3.08Å; Q235-T239 PolarHBondContact O-OG1 3.43Å; Q235-Y348 HydrophobicContact CB-CE2 4.05Å; Q235-Y348 HydrophobicContact CG-CE2 4.38Å
236	Q	87.1	Confident	87.8	Confident	33 Å²	33	48.5 Å²	48.5	15%	0.154	24%	0.235	C	C	.	.	H	α-helix	trans	-67.3	-39.9	177.8	-63	171.4	-20	0	0	110.7	E198 C231 T232 S233 Q234 T239 M240	E198-Q236 PolarHBondContact OE2-NE2 3.12Å; C231-Q236 HydrophobicContact CB-CB 4.15Å; T232-Q236 PolarHBondContact OG1-OE1 3.03Å; S233-Q236 WeakPolarHBondContact O-CA 3.35Å; S233-Q236 VanDerWaalsContact O-CB 3.32Å; S233-Q236 WeakPolarHBondContact O-CB 3.43Å; S233-Q236 PolarHBondContact O-N 3.15Å; Q234-Q236 VanDerWaalsContact C-N 3.33Å; Q234-Q236 PolarHBondContact O-N 2.81Å; Q236-T239 PolarHBondContact O-N 3.32Å; Q236-M240 WeakPolarHBondContact O-CB 3.5Å; Q236-M240 PolarHBondContact O-N 2.88Å
237	E	87.3	Confident	87.8	Confident	67 Å²	67	41.6 Å²	41.6	31%	0.313	21%	0.209	S	C	.	.	H	α-helix	trans	-63.4	-42.1	173.9	-65.7	-176.4	176.4	0	0	112.2	C231 S233 Q234 M240 C241 L267	C231-E237 HydrophobicContact CB-CG 3.64Å; S233-E237 PolarHBondContact O-N 3.24Å; S233-E237 VanDerWaalsContact O-N 3.12Å; Q234-E237 PolarHBondContact O-N 3.4Å; E237-M240 PolarHBondContact O-N 3.18Å; E237-C241 WeakPolarHBondContact O-CB 3.49Å; E237-C241 PolarHBondContact O-N 2.98Å; E237-C241 PolarHBondContact O-SG 3.25Å; E237-L267 HydrophobicContact CB-CD1 4.08Å; E237-L267 WeakPolarHBondContact OE2-CD2 3.25Å
238	L	86.8	Confident	87.9	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-47.1	174.8	-74.1	171.8	0	0	0	111.5	Q234 Q235 M240 C241 L242 A264 L267 L352 L359	Q234-L238 HydrophobicContact CG-CD1 4.5Å; Q234-L238 WeakPolarHBondContact O-CB 3.47Å; Q234-L238 VanDerWaalsContact O-CG 3.32Å; Q234-L238 WeakPolarHBondContact O-CG 3.4Å; Q234-L238 PolarHBondContact O-N 2.59Å; Q235-L238 PolarHBondContact O-N 3.21Å; L238-M240 VanDerWaalsContact C-N 3.33Å; L238-M240 PolarHBondContact O-N 2.92Å; L238-C241 WeakPolarHBondContact O-CB 3.46Å; L238-C241 PolarHBondContact O-N 3.14Å; L238-L242 VanDerWaalsContact O-CG 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 2.84Å; L238-A264 HydrophobicContact CD2-CB 4.17Å; L238-A264 WeakPolarHBondContact CD2-O 3.45Å; L238-L267 HydrophobicContact CD2-CB 3.97Å; L238-L267 HydrophobicContact CG-CB 4.48Å; L238-L352 HydrophobicContact CD1-CD1 3.75Å; L238-L359 HydrophobicContact CD2-CD1 4.48Å
239	T	87.3	Confident	87.9	Confident	57 Å²	57	35.6 Å²	35.6	35%	0.35	19%	0.187	S	C	.	.	H	α-helix	trans	-59.6	-43	175.8	-58	0	0	0	0	111.8	Q235 Q236 C241 L242 N243	Q235-T239 PolarHBondContact O-N 3.08Å; Q235-T239 PolarHBondContact O-OG1 3.43Å; Q236-T239 PolarHBondContact O-N 3.32Å; T239-C241 PolarHBondContact O-N 3.02Å; T239-L242 PolarHBondContact O-N 3.27Å; T239-N243 PolarHBondContact O-N 3.32Å
240	M	88.2	Confident	87.7	Confident	6 Å²	6	31.2 Å²	31.2	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-45.5	174.8	177.7	-124.9	61.2	0	0	111.2	F224 R228 Q236 E237 L238 L242 N243 V244	F224-M240 WeakPolarHBondContact O-CG 3.18Å; R228-M240 HydrophobicContact CB-SD 3.48Å; R228-M240 WeakPolarHBondContact CB-SD 3.42Å; R228-M240 HydrophobicContact CG-SD 3.77Å; Q236-M240 WeakPolarHBondContact O-CB 3.5Å; Q236-M240 PolarHBondContact O-N 2.88Å; E237-M240 PolarHBondContact O-N 3.18Å; L238-M240 VanDerWaalsContact C-N 3.33Å; L238-M240 PolarHBondContact O-N 2.92Å; M240-L242 VanDerWaalsContact C-N 3.33Å; M240-L242 PolarHBondContact O-N 3.48Å; M240-N243 PolarHBondContact O-N 3.4Å; M240-V244 WeakPolarHBondContact O-CG2 3.23Å; M240-V244 PolarHBondContact O-N 3.37Å
241	C	89.2	Confident	87.6	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-43	177.8	-81.4	0	0	0	0	111.5	E237 L238 T239 V244 I245 A264	E237-C241 WeakPolarHBondContact O-CB 3.49Å; E237-C241 PolarHBondContact O-N 2.98Å; E237-C241 PolarHBondContact O-SG 3.25Å; L238-C241 WeakPolarHBondContact O-CB 3.46Å; L238-C241 PolarHBondContact O-N 3.14Å; T239-C241 PolarHBondContact O-N 3.02Å; C241-V244 PolarHBondContact O-N 2.68Å; C241-I245 WeakPolarHBondContact O-CB 3.41Å; C241-I245 WeakPolarHBondContact O-CD1 3.21Å; C241-I245 WeakPolarHBondContact O-CG1 3.27Å; C241-I245 PolarHBondContact O-N 3.38Å; C241-A264 HydrophobicContact CB-CB 3.9Å
242	L	87.8	Confident	87.4	Confident	17 Å²	17	35.7 Å²	35.7	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-40.3	178.1	-69.2	165.4	0	0	0	112.2	L238 T239 M240 I245 K246 A355 Q358 L359	L238-L242 VanDerWaalsContact O-CG 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 2.84Å; T239-L242 PolarHBondContact O-N 3.27Å; M240-L242 VanDerWaalsContact C-N 3.33Å; M240-L242 PolarHBondContact O-N 3.48Å; L242-I245 PolarHBondContact O-N 3.04Å; L242-K246 WeakPolarHBondContact O-CB 3.31Å; L242-K246 PolarHBondContact O-N 2.85Å; L242-A355 HydrophobicContact CD1-CB 4.1Å; L242-Q358 HydrophobicContact CD2-CB 3.81Å; L242-L359 HydrophobicContact CD2-CD2 4Å; L242-L359 HydrophobicContact CD2-CG 4.22Å
243	N	88.1	Confident	87.4	Confident	32 Å²	32	32 Å²	32	17%	0.171	16%	0.16	C	C	.	.	H	α-helix	trans	-64.8	-44.3	175	-73.5	-17.4	0	0	0	111.9	F224 T239 M240 I245 K246 V247	F224-N243 HydrophobicContact CD1-CB 3.77Å; F224-N243 HydrophobicContact CD2-CB 4.44Å; F224-N243 HydrophobicContact CE1-CB 3.91Å; F224-N243 HydrophobicContact CG-CB 4.06Å; F224-N243 HydrophobicContact CZ-CB 4.3Å; T239-N243 PolarHBondContact O-N 3.32Å; M240-N243 PolarHBondContact O-N 3.4Å; N243-I245 PolarHBondContact O-N 3.39Å; N243-K246 WeakPolarHBondContact O-CB 3.5Å; N243-K246 PolarHBondContact O-N 3.05Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.94Å; N243-V247 VanDerWaalsContact O-N 3.09Å
244	V	90.3	Very high	87.4	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-43.8	175.2	173.4	0	0	0	0	111.2	F224 M240 C241 K246 V247 A248	F224-V244 HydrophobicContact CB-CG2 3.68Å; M240-V244 WeakPolarHBondContact O-CG2 3.23Å; M240-V244 PolarHBondContact O-N 3.37Å; C241-V244 PolarHBondContact O-N 2.68Å; V244-K246 VanDerWaalsContact C-N 3.33Å; V244-K246 PolarHBondContact O-N 3.17Å; V244-V247 PolarHBondContact O-N 3.22Å; V244-A248 VanDerWaalsContact O-CB 3.29Å; V244-A248 WeakPolarHBondContact O-CB 3.47Å; V244-A248 PolarHBondContact O-N 3.33Å
245	I	89.5	Confident	87.6	Confident	6 Å²	6	34.5 Å²	34.5	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-46.1	175.8	-74.3	164	0	0	0	110.5	C241 L242 N243 V247 A248 I249 V257 H260 V261 L359 A362	C241-I245 WeakPolarHBondContact O-CB 3.41Å; C241-I245 WeakPolarHBondContact O-CD1 3.21Å; C241-I245 WeakPolarHBondContact O-CG1 3.27Å; C241-I245 PolarHBondContact O-N 3.38Å; L242-I245 PolarHBondContact O-N 3.04Å; N243-I245 PolarHBondContact O-N 3.39Å; I245-V247 PolarHBondContact O-N 2.87Å; I245-A248 PolarHBondContact O-N 3Å; I245-I249 HydrophobicContact CG2-CD1 3.74Å; I245-I249 HydrophobicContact CG2-CG1 4.35Å; I245-I249 VanDerWaalsContact O-CG1 3.27Å; I245-I249 WeakPolarHBondContact O-CG1 3.26Å; I245-I249 PolarHBondContact O-N 3.44Å; I245-V257 HydrophobicContact CG1-CG1 4.5Å; I245-V257 HydrophobicContact CG2-CG1 4.1Å; I245-H260 HydrophobicContact CD1-CB 4.33Å; I245-H260 HydrophobicContact CG1-CB 3.9Å; I245-V261 HydrophobicContact CD1-CG2 3.79Å; I245-V261 HydrophobicContact CG1-CG2 4.35Å; I245-L359 HydrophobicContact CD1-CD2 3.7Å; I245-A362 HydrophobicContact CG2-CB 3.7Å
246	K	87.4	Confident	87.8	Confident	48 Å²	48	35.2 Å²	35.2	21%	0.209	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-47.3	176.9	173.5	179.8	177.3	-166.4	0	112	L242 N243 V244 I249 F250 I395	L242-K246 WeakPolarHBondContact O-CB 3.31Å; L242-K246 PolarHBondContact O-N 2.85Å; N243-K246 WeakPolarHBondContact O-CB 3.5Å; N243-K246 PolarHBondContact O-N 3.05Å; V244-K246 VanDerWaalsContact C-N 3.33Å; V244-K246 PolarHBondContact O-N 3.17Å; K246-I249 PolarHBondContact O-N 3.14Å; K246-F250 HydrophobicContact CD-CE2 4.42Å; K246-F250 HydrophobicContact CG-CD2 4.44Å; K246-F250 HydrophobicContact CG-CE2 3.63Å; K246-F250 HydrophobicContact CG-CZ 3.89Å; K246-F250 VanDerWaalsContact O-CD2 3.29Å; K246-F250 WeakPolarHBondContact O-CD2 3.36Å; K246-F250 WeakPolarHBondContact O-CG 3.49Å; K246-F250 PolarHBondContact O-N 3.36Å; K246-I395 HydrophobicContact CB-CD1 4.19Å; K246-I395 HydrophobicContact CG-CD1 4.04Å
247	V	87.8	Confident	87.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.1	-40.3	178	-173.2	0	0	0	0	111.7	L212 L217 A220 N221 F224 N243 V244 I245 I249 F250 Q251	L212-V247 HydrophobicContact CD1-CG2 4.17Å; L212-V247 HydrophobicContact CD2-CG1 4.35Å; L212-V247 HydrophobicContact CD2-CG2 3.84Å; L212-V247 HydrophobicContact CG-CG2 4.35Å; L217-V247 HydrophobicContact CB-CG1 4.3Å; L217-V247 VanDerWaalsContact O-CG1 3.25Å; L217-V247 WeakPolarHBondContact O-CG1 3.44Å; A220-V247 HydrophobicContact CB-CG1 4.2Å; A220-V247 HydrophobicContact CB-CG2 4.32Å; N221-V247 HydrophobicContact CB-CG1 3.96Å; F224-V247 HydrophobicContact CD2-CG2 3.57Å; F224-V247 HydrophobicContact CE2-CG2 3.48Å; F224-V247 VanDerWaalsContact CE2-CG2 3.48Å; N243-V247 WeakPolarHBondContact O-CG2 3.49Å; N243-V247 PolarHBondContact O-N 2.94Å; N243-V247 VanDerWaalsContact O-N 3.09Å; V244-V247 PolarHBondContact O-N 3.22Å; I245-V247 PolarHBondContact O-N 2.87Å; V247-I249 VanDerWaalsContact C-N 3.34Å; V247-I249 PolarHBondContact O-N 3.22Å; V247-F250 PolarHBondContact O-N 3.41Å; V247-Q251 PolarHBondContact O-N 2.84Å
248	A	89	Confident	88	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-35	179.6	0	0	0	0	0	112.6	V244 I245 Q251 R252 A253 H256 V257	V244-A248 VanDerWaalsContact O-CB 3.29Å; V244-A248 WeakPolarHBondContact O-CB 3.47Å; V244-A248 PolarHBondContact O-N 3.33Å; I245-A248 PolarHBondContact O-N 3Å; A248-Q251 PolarHBondContact O-N 3.32Å; A248-R252 PolarHBondContact O-N 2.89Å; A248-R252 VanDerWaalsContact O-N 3.17Å; A248-A253 PolarHBondContact O-N 3.42Å; A248-A253 VanDerWaalsContact O-N 3.09Å; A248-H256 HydrophobicContact CB-CB 4.49Å; A248-V257 HydrophobicContact CB-CG2 3.55Å
249	I	88.1	Confident	88.1	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-44.1	171.6	-70.3	166.7	0	0	0	110.2	I245 K246 V247 Q251 R252 V257 L365 I395 F469	I245-I249 HydrophobicContact CG2-CD1 3.74Å; I245-I249 HydrophobicContact CG2-CG1 4.35Å; I245-I249 VanDerWaalsContact O-CG1 3.27Å; I245-I249 WeakPolarHBondContact O-CG1 3.26Å; I245-I249 PolarHBondContact O-N 3.44Å; K246-I249 PolarHBondContact O-N 3.14Å; V247-I249 VanDerWaalsContact C-N 3.34Å; V247-I249 PolarHBondContact O-N 3.22Å; I249-Q251 VanDerWaalsContact C-N 3.31Å; I249-Q251 PolarHBondContact O-N 3.21Å; I249-R252 PolarHBondContact O-N 2.95Å; I249-V257 HydrophobicContact CG1-CG2 4.11Å; I249-L365 HydrophobicContact CD1-CD1 4.34Å; I249-I395 HydrophobicContact CD1-CD1 4.06Å; I249-I395 HydrophobicContact CG2-CG2 4.2Å; I249-F469 HydrophobicContact CG2-CE1 3.93Å; I249-F469 HydrophobicContact CG2-CZ 3.77Å
250	F	86.1	Confident	88.1	Confident	12 Å²	12	34 Å²	34	5%	0.053	18%	0.18	C	C	.	.	H	α-helix	trans	-64.3	-34.4	176.8	-59.7	-36.2	0	0	0	113	Y43 I44 L212 L217 K246 V247 R252	Y43-F250 HydrophobicContact CD1-CB 4.09Å; Y43-F250 AromaticContact CD1-CD1 3.85Å; Y43-F250 HydrophobicContact CD1-CD1 3.85Å; Y43-F250 AromaticContact CD1-CD2 3.93Å; Y43-F250 HydrophobicContact CD1-CD2 3.93Å; Y43-F250 HydrophobicContact CD1-CE1 4.25Å; Y43-F250 HydrophobicContact CD1-CE2 4.31Å; Y43-F250 AromaticContact CD1-CG 3.7Å; Y43-F250 HydrophobicContact CD1-CG 3.7Å; Y43-F250 HydrophobicContact CD1-CZ 4.47Å; Y43-F250 HydrophobicContact CE1-CB 4.09Å; Y43-F250 HydrophobicContact CE1-CG 4.22Å; Y43-F250 HydrophobicContact CG-CD2 4.48Å; I44-F250 HydrophobicContact CB-CE1 4.03Å; I44-F250 HydrophobicContact CD1-CE1 3.88Å; I44-F250 HydrophobicContact CG1-CD1 4.45Å; I44-F250 HydrophobicContact CG1-CE1 3.83Å; L212-F250 HydrophobicContact CD2-CD2 4.15Å; L212-F250 HydrophobicContact CD2-CE2 4.36Å; L217-F250 HydrophobicContact CD1-CB 3.81Å; L217-F250 HydrophobicContact CD2-CB 4.03Å; L217-F250 HydrophobicContact CD2-CD2 4.26Å; K246-F250 HydrophobicContact CD-CE2 4.42Å; K246-F250 HydrophobicContact CG-CD2 4.44Å; K246-F250 HydrophobicContact CG-CE2 3.63Å; K246-F250 HydrophobicContact CG-CZ 3.89Å; K246-F250 VanDerWaalsContact O-CD2 3.29Å; K246-F250 WeakPolarHBondContact O-CD2 3.36Å; K246-F250 WeakPolarHBondContact O-CG 3.49Å; K246-F250 PolarHBondContact O-N 3.36Å; V247-F250 PolarHBondContact O-N 3.41Å; F250-R252 PolarHBondContact O-N 3.29Å
251	Q	86.3	Confident	88.1	Confident	66 Å²	66	34.1 Å²	34.1	31%	0.308	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.8	174.6	-68.2	178.9	-1.2	0	0	113.7	L217 V247 A248 I249 A253	L217-Q251 HydrophobicContact CB-CG 3.75Å; L217-Q251 HydrophobicContact CD1-CG 4.05Å; L217-Q251 PolarHBondContact O-NE2 3.06Å; V247-Q251 PolarHBondContact O-N 2.84Å; A248-Q251 PolarHBondContact O-N 3.32Å; I249-Q251 VanDerWaalsContact C-N 3.31Å; I249-Q251 PolarHBondContact O-N 3.21Å; Q251-A253 HydrophobicContact CB-CB 4.26Å; Q251-A253 PolarHBondContact O-N 3.12Å
252	R	83.2	Confident	88.1	Confident	114 Å²	114	38.5 Å²	38.5	43%	0.43	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	27	-169.9	-60.2	-179.7	68.4	131.2	-3.1	113.5	A248 I249 F250 W254 D472	A248-R252 PolarHBondContact O-N 2.89Å; A248-R252 VanDerWaalsContact O-N 3.17Å; I249-R252 PolarHBondContact O-N 2.95Å; F250-R252 PolarHBondContact O-N 3.29Å; R252-W254 PolarHBondContact O-N 3.22Å; R252-D472 IonicContact NH2-OD2 3.71Å; R252-D472 PolarHBondContact NH2-OD2 2.79Å
253	A	88.9	Confident	88.1	Confident	24 Å²	24	42.8 Å²	42.8	20%	0.198	22%	0.223	C	C	.	.			trans	-90.3	75.1	-179.7	0	0	0	0	0	111.5	A248 Q251 S255 H256 V257	A248-A253 PolarHBondContact O-N 3.42Å; A248-A253 VanDerWaalsContact O-N 3.09Å; Q251-A253 HydrophobicContact CB-CB 4.26Å; Q251-A253 PolarHBondContact O-N 3.12Å; A253-S255 VanDerWaalsContact C-N 3.34Å; A253-S255 PolarHBondContact O-N 3Å; A253-H256 HydrophobicContact CB-CB 4.42Å; A253-H256 PolarHBondContact O-N 3.16Å; A253-V257 PolarHBondContact O-N 2.86Å
254	W	88	Confident	88	Confident	55 Å²	55	41.2 Å²	41.2	21%	0.208	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-30.9	-171.7	-57.6	110.7	0	0	0	115.1	R252 V257 S258 L365 V366 A369 F469	R252-W254 PolarHBondContact O-N 3.22Å; W254-V257 PolarHBondContact O-N 2.96Å; W254-S258 PolarHBondContact O-N 3.41Å; W254-L365 HydrophobicContact CH2-CB 4.35Å; W254-L365 HydrophobicContact CZ3-CB 3.89Å; W254-V366 HydrophobicContact CE3-CG2 4.28Å; W254-A369 HydrophobicContact CB-CB 4.44Å; W254-A369 HydrophobicContact CD2-CB 3.43Å; W254-A369 VanDerWaalsContact CD2-CB 3.43Å; W254-A369 HydrophobicContact CE3-CB 4.01Å; W254-A369 HydrophobicContact CG-CB 3.63Å; W254-A369 HydrophobicContact CH2-CB 4.43Å; W254-A369 HydrophobicContact CZ2-CB 3.93Å; W254-A369 HydrophobicContact CZ3-CB 4.47Å; W254-F469 AromaticContact CH2-CD1 3.82Å; W254-F469 HydrophobicContact CH2-CD1 3.82Å; W254-F469 AromaticContact CH2-CE1 3.77Å; W254-F469 HydrophobicContact CH2-CE1 3.77Å; W254-F469 HydrophobicContact CZ2-CD1 4.19Å; W254-F469 HydrophobicContact CZ2-CE1 4.31Å
255	S	89.8	Confident	87.7	Confident	85 Å²	85	43.1 Å²	43.1	59%	0.594	23%	0.228	S	C	*	.	H	α-helix	trans	-63.3	-41.7	176.2	55.4	0	0	0	0	111.9	A253 S258 A259	A253-S255 VanDerWaalsContact C-N 3.34Å; A253-S255 PolarHBondContact O-N 3Å; S255-S258 PolarHBondContact O-N 3.47Å; S255-A259 PolarHBondContact O-N 2.83Å; S255-A259 VanDerWaalsContact O-N 3.17Å
256	H	87.3	Confident	87.5	Confident	98 Å²	98	45.5 Å²	45.5	45%	0.454	25%	0.246	S	C	.	.	H	α-helix	trans	-66.8	-39.9	175.6	-67.6	-176	0	0	0	111	A248 A253 A259 H260	A248-H256 HydrophobicContact CB-CB 4.49Å; A253-H256 HydrophobicContact CB-CB 4.42Å; A253-H256 PolarHBondContact O-N 3.16Å; H256-A259 PolarHBondContact O-N 3.05Å; H256-H260 PolarHBondContact O-CD2 3.21Å; H256-H260 VanDerWaalsContact O-CD2 3.26Å; H256-H260 PolarHBondContact O-N 3.33Å; H256-H260 VanDerWaalsContact O-N 3.11Å
257	V	88.5	Confident	87.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-49.5	174.8	-177.3	0	0	0	0	110.4	I245 A248 I249 A253 W254 A259 H260 V261 A362 V366	I245-V257 HydrophobicContact CG1-CG1 4.5Å; I245-V257 HydrophobicContact CG2-CG1 4.1Å; A248-V257 HydrophobicContact CB-CG2 3.55Å; I249-V257 HydrophobicContact CG1-CG2 4.11Å; A253-V257 PolarHBondContact O-N 2.86Å; W254-V257 PolarHBondContact O-N 2.96Å; V257-A259 PolarHBondContact O-N 3.32Å; V257-H260 PolarHBondContact O-N 2.93Å; V257-V261 HydrophobicContact CG1-CG2 3.94Å; V257-V261 WeakPolarHBondContact O-CB 3.38Å; V257-V261 VanDerWaalsContact O-CG2 3.25Å; V257-V261 WeakPolarHBondContact O-CG2 3.11Å; V257-V261 PolarHBondContact O-N 3.44Å; V257-A362 HydrophobicContact CG1-CB 4.49Å; V257-V366 HydrophobicContact CB-CG2 3.67Å; V257-V366 HydrophobicContact CG1-CG2 3.32Å
258	S	89.6	Confident	86.4	Confident	49 Å²	49	45 Å²	45	34%	0.343	25%	0.246	S	C	.	.	H	α-helix	trans	-56	-45.7	179.8	-172.2	0	0	0	0	113	W254 S255 H260 V261 T262	W254-S258 PolarHBondContact O-N 3.41Å; S255-S258 PolarHBondContact O-N 3.47Å; S258-H260 PolarHBondContact O-N 3.26Å; S258-V261 PolarHBondContact O-N 3.36Å; S258-T262 WeakPolarHBondContact O-CB 3.41Å; S258-T262 PolarHBondContact O-N 3.28Å; S258-T262 PolarHBondContact O-OG1 3.24Å
259	A	90.3	Very high	85.2	Confident	51 Å²	51	51.3 Å²	51.3	42%	0.421	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-40.6	179	0	0	0	0	0	112.3	S255 H256 V257 R263	S255-A259 PolarHBondContact O-N 2.83Å; S255-A259 VanDerWaalsContact O-N 3.17Å; H256-A259 PolarHBondContact O-N 3.05Å; V257-A259 PolarHBondContact O-N 3.32Å; A259-R263 WeakPolarHBondContact O-CB 3.42Å; A259-R263 PolarHBondContact O-N 3.38Å; A259-R263 VanDerWaalsContact O-N 3.15Å
260	H	86.2	Confident	83.7	Confident	38 Å²	38	56.9 Å²	56.9	18%	0.176	30%	0.304	C	S	.	.	H	α-helix	trans	-74.4	-35.1	178.3	-82.7	-90.3	0	0	0	113	I245 H256 V257 S258 R263 A264	I245-H260 HydrophobicContact CD1-CB 4.33Å; I245-H260 HydrophobicContact CG1-CB 3.9Å; H256-H260 PolarHBondContact O-CD2 3.21Å; H256-H260 VanDerWaalsContact O-CD2 3.26Å; H256-H260 PolarHBondContact O-N 3.33Å; H256-H260 VanDerWaalsContact O-N 3.11Å; V257-H260 PolarHBondContact O-N 2.93Å; S258-H260 PolarHBondContact O-N 3.26Å; H260-R263 PolarHBondContact CE1-NH1 3.39Å; H260-R263 PolarHBondContact ND1-NH1 2.98Å; H260-R263 PolarHBondContact O-N 2.96Å; H260-A264 VanDerWaalsContact O-CB 3.28Å; H260-A264 WeakPolarHBondContact O-CB 2.73Å; H260-A264 PolarHBondContact O-N 2.95Å
261	V	88.7	Confident	81.9	Confident	10 Å²	10	62.1 Å²	62.1	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-49.8	172.1	167	0	0	0	0	110.1	I245 V257 S258 R263 A264 S265 A362 A363	I245-V261 HydrophobicContact CD1-CG2 3.79Å; I245-V261 HydrophobicContact CG1-CG2 4.35Å; V257-V261 HydrophobicContact CG1-CG2 3.94Å; V257-V261 WeakPolarHBondContact O-CB 3.38Å; V257-V261 VanDerWaalsContact O-CG2 3.25Å; V257-V261 WeakPolarHBondContact O-CG2 3.11Å; V257-V261 PolarHBondContact O-N 3.44Å; S258-V261 PolarHBondContact O-N 3.36Å; V261-R263 VanDerWaalsContact C-N 3.29Å; V261-R263 PolarHBondContact O-N 2.85Å; V261-A264 PolarHBondContact O-N 3.03Å; V261-A264 VanDerWaalsContact O-N 3.08Å; V261-S265 PolarHBondContact O-N 2.9Å; V261-S265 PolarHBondContact O-OG 3.31Å; V261-A362 HydrophobicContact CG2-CB 3.82Å; V261-A363 HydrophobicContact CG1-CB 3.73Å
262	T	89.5	Confident	80.1	Confident	92 Å²	92	62.9 Å²	62.9	56%	0.564	33%	0.329	S	S	*	.	H	α-helix	trans	-58.5	-41.8	178.3	-55.2	0	0	0	0	111.8	S258 S266	S258-T262 WeakPolarHBondContact O-CB 3.41Å; S258-T262 PolarHBondContact O-N 3.28Å; S258-T262 PolarHBondContact O-OG1 3.24Å; T262-S266 PolarHBondContact O-N 2.93Å; T262-S266 VanDerWaalsContact O-N 3.14Å
263	R	87.7	Confident	78.2	Confident	107 Å²	107	61.2 Å²	61.2	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-40.5	175	-175.4	-176.6	-65.3	133.4	1	112.5	A259 H260 V261 S266 L267	A259-R263 WeakPolarHBondContact O-CB 3.42Å; A259-R263 PolarHBondContact O-N 3.38Å; A259-R263 VanDerWaalsContact O-N 3.15Å; H260-R263 PolarHBondContact CE1-NH1 3.39Å; H260-R263 PolarHBondContact ND1-NH1 2.98Å; H260-R263 PolarHBondContact O-N 2.96Å; V261-R263 VanDerWaalsContact C-N 3.29Å; V261-R263 PolarHBondContact O-N 2.85Å; R263-S266 PolarHBondContact O-OG 2.99Å; R263-L267 HydrophobicContact CG-CD1 4.47Å; R263-L267 WeakPolarHBondContact O-CD1 3.49Å; R263-L267 VanDerWaalsContact O-CG 3.31Å; R263-L267 WeakPolarHBondContact O-CG 3.42Å; R263-L267 PolarHBondContact O-N 3.42Å
264	A	85.8	Confident	75.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-73.8	-34.1	-179.2	0	0	0	0	0	112.3	L238 C241 H260 V261 L267 S268 L359	L238-A264 HydrophobicContact CD2-CB 4.17Å; L238-A264 WeakPolarHBondContact CD2-O 3.45Å; C241-A264 HydrophobicContact CB-CB 3.9Å; H260-A264 VanDerWaalsContact O-CB 3.28Å; H260-A264 WeakPolarHBondContact O-CB 2.73Å; H260-A264 PolarHBondContact O-N 2.95Å; V261-A264 PolarHBondContact O-N 3.03Å; V261-A264 VanDerWaalsContact O-N 3.08Å; A264-L267 PolarHBondContact O-N 3.45Å; A264-S268 WeakPolarHBondContact O-CB 3.07Å; A264-S268 PolarHBondContact O-N 3.37Å; A264-L359 HydrophobicContact CB-CD1 3.59Å; A264-L359 HydrophobicContact CB-CD2 3.4Å; A264-L359 HydrophobicContact CB-CG 4.13Å
265	S	83.7	Confident	73.6	Confident	42 Å²	42	63.5 Å²	63.5	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-64.3	-45.4	173	-63	0	0	0	0	111.5	V261 L267 S268 E269	V261-S265 PolarHBondContact O-N 2.9Å; V261-S265 PolarHBondContact O-OG 3.31Å; S265-L267 VanDerWaalsContact C-N 3.3Å; S265-L267 PolarHBondContact O-N 3.38Å; S265-S268 WeakPolarHBondContact O-CB 3.35Å; S265-S268 PolarHBondContact O-N 2.91Å; S265-E269 WeakPolarHBondContact O-CG 3.19Å; S265-E269 PolarHBondContact O-N 3.5Å
266	S	85	Confident	71.3	Confident	57 Å²	57	64.9 Å²	64.9	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-39	177.2	67.7	0	0	0	0	112	T262 R263 E269 L270	T262-S266 PolarHBondContact O-N 2.93Å; T262-S266 VanDerWaalsContact O-N 3.14Å; R263-S266 PolarHBondContact O-OG 2.99Å; S266-E269 PolarHBondContact O-N 2.92Å; S266-L270 VanDerWaalsContact O-CD1 3.28Å; S266-L270 WeakPolarHBondContact O-CD1 3.25Å; S266-L270 PolarHBondContact O-N 2.95Å
267	L	80	Confident	69.1	Low	33 Å²	33	66.3 Å²	66.3	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-58.5	-51.5	171.2	-71.7	165.2	0	0	0	110.1	Q234 E237 L238 R263 A264 S265 E269 L270	Q234-L267 HydrophobicContact CG-CB 4.43Å; Q234-L267 HydrophobicContact CG-CD2 4.42Å; Q234-L267 PolarHBondContact NE2-O 2.97Å; E237-L267 HydrophobicContact CB-CD1 4.08Å; E237-L267 WeakPolarHBondContact OE2-CD2 3.25Å; L238-L267 HydrophobicContact CD2-CB 3.97Å; L238-L267 HydrophobicContact CG-CB 4.48Å; R263-L267 HydrophobicContact CG-CD1 4.47Å; R263-L267 WeakPolarHBondContact O-CD1 3.49Å; R263-L267 VanDerWaalsContact O-CG 3.31Å; R263-L267 WeakPolarHBondContact O-CG 3.42Å; R263-L267 PolarHBondContact O-N 3.42Å; A264-L267 PolarHBondContact O-N 3.45Å; S265-L267 VanDerWaalsContact C-N 3.3Å; S265-L267 PolarHBondContact O-N 3.38Å; L267-E269 VanDerWaalsContact C-N 3.31Å; L267-E269 PolarHBondContact O-N 3.04Å; L267-L270 PolarHBondContact O-N 3.18Å
268	S	72	Confident	66.9	Low	5 Å²	5	68.3 Å²	68.3	4%	0.035	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-34.3	-176.8	-164.5	0	0	0	0	114.5	A264 S265 R356	A264-S268 WeakPolarHBondContact O-CB 3.07Å; A264-S268 PolarHBondContact O-N 3.37Å; S265-S268 WeakPolarHBondContact O-CB 3.35Å; S265-S268 PolarHBondContact O-N 2.91Å; S268-R356 PolarHBondContact O-NH2 3.26Å; S268-R356 VanDerWaalsContact OG-CG 3.23Å; S268-R356 WeakPolarHBondContact OG-CG 3.43Å; S268-R356 PolarHBondContact OG-NE 3.13Å
269	E	64.7	Low	64.9	Low	132 Å²	132	68.1 Å²	68.1	62%	0.617	39%	0.389	S	S	*	.	H	α-helix	trans	-77.9	-32.5	-176.8	-73	177	-173.5	0	0	113.8	S265 S266 L267 R271 D272	S265-E269 WeakPolarHBondContact O-CG 3.19Å; S265-E269 PolarHBondContact O-N 3.5Å; S266-E269 PolarHBondContact O-N 2.92Å; L267-E269 VanDerWaalsContact C-N 3.31Å; L267-E269 PolarHBondContact O-N 3.04Å; E269-R271 PolarHBondContact O-N 3.17Å; E269-D272 PolarHBondContact O-N 3.49Å; E269-D272 VanDerWaalsContact O-N 3.12Å
270	L	56	Low	62.7	Low	124 Å²	124	70.2 Å²	70.2	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.3	-173.9	-104.1	131.8	0	0	0	114.4	S266 L267 T273	S266-L270 VanDerWaalsContact O-CD1 3.28Å; S266-L270 WeakPolarHBondContact O-CD1 3.25Å; S266-L270 PolarHBondContact O-N 2.95Å; L267-L270 PolarHBondContact O-N 3.18Å; L270-T273 PolarHBondContact O-OG1 3.29Å
271	R	48	Very low	61	Low	122 Å²	122	70.8 Å²	70.8	46%	0.46	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-13.9	178.4	-163.4	166.5	-180	-177.9	-0.1	114.5	E269 T273 P275 Y348	E269-R271 PolarHBondContact O-N 3.17Å; R271-T273 VanDerWaalsContact C-N 3.33Å; R271-P275 WeakPolarHBondContact O-CD 2.89Å; R271-Y348 PolarHBondContact NH1-OH 3.43Å
272	D	48.4	Very low	59.4	Low	82 Å²	82	73.1 Å²	73.1	44%	0.439	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-24.5	174.7	-75.2	1.7	0	0	0	111.3	E269 R356	E269-D272 PolarHBondContact O-N 3.49Å; E269-D272 VanDerWaalsContact O-N 3.12Å; D272-R356 IonicContact OD1-CZ 2.79Å; D272-R356 IonicContact OD1-NH1 3.57Å; D272-R356 IonicContact OD1-NH2 3.07Å; D272-R356 PolarHBondContact OD1-NH2 2.97Å; D272-R356 IonicContact OD2-CZ 2.6Å; D272-R356 IonicContact OD2-NH1 3.66Å; D272-R356 PolarHBondContact OD2-NH1 3.35Å; D272-R356 IonicContact OD2-NH2 3.58Å; D272-R356 PolarHBondContact OD2-NH2 3.32Å
273	T	43.2	Very low	57.8	Low	79 Å²	79	74.9 Å²	74.9	49%	0.485	43%	0.426	S	S	.	.	S	Bend	trans	-84.2	-26.3	175.3	58.1	0	0	0	0	113.2	L270 R271 L276 L277	L270-T273 PolarHBondContact O-OG1 3.29Å; R271-T273 VanDerWaalsContact C-N 3.33Å; T273-L276 PolarHBondContact O-N 3.37Å; T273-L277 PolarHBondContact O-N 3.44Å
274	A	41.1	Very low	56.5	Low	51 Å²	51	74.5 Å²	74.5	42%	0.421	43%	0.432	S	S	.	.	H	α-helix	trans	-62.9	-43.2	-179.9	0	0	0	0	0	114.9	L276 L277 G278	A274-L276 PolarHBondContact O-N 3.49Å; A274-L277 PolarHBondContact O-N 3.25Å; A274-G278 PolarHBondContact O-N 3.15Å
275	P	41	Very low	55.3	Low	77 Å²	77	78.8 Å²	78.8	50%	0.5	46%	0.455	S	S	.	.	H	α-helix	trans	-70.2	-20.7	175.2	25.6	-31.4	0	0	0	112.3	R271 A279	R271-P275 WeakPolarHBondContact O-CD 2.89Å; P275-A279 WeakPolarHBondContact O-CA 3.45Å; P275-A279 WeakPolarHBondContact O-CB 3.42Å; P275-A279 PolarHBondContact O-N 3.12Å
276	L	41.3	Very low	54.6	Low	113 Å²	113	79.5 Å²	79.5	59%	0.592	46%	0.464	S	S	*	.	H	α-helix	trans	-75	-39.3	173.9	-70.3	172.4	0	0	0	112	T273 A274 N280	T273-L276 PolarHBondContact O-N 3.37Å; A274-L276 PolarHBondContact O-N 3.49Å; L276-N280 VanDerWaalsContact O-CB 3.24Å; L276-N280 WeakPolarHBondContact O-CB 3.35Å; L276-N280 PolarHBondContact O-N 3.44Å; L276-N280 PolarHBondContact O-ND2 2.9Å; L276-N280 VanDerWaalsContact O-ND2 3.11Å
277	L	41.2	Very low	53.7	Low	129 Å²	129	83.2 Å²	83.2	68%	0.675	47%	0.474	S	S	*	.	H	α-helix	trans	-71.1	-36.5	173.4	-76.6	160.8	0	0	0	112	T273 A274 A281	T273-L277 PolarHBondContact O-N 3.44Å; A274-L277 PolarHBondContact O-N 3.25Å; L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.47Å; L277-A281 PolarHBondContact O-N 2.82Å
278	G	41.7	Very low	52.8	Low	41 Å²	41	86.5 Å²	86.5	42%	0.423	49%	0.489	S	S	.	.	H	α-helix	trans	-72.7	-38.9	176.2	0	0	0	0	0	114	A274 A281 A282	A274-G278 PolarHBondContact O-N 3.15Å; G278-A281 PolarHBondContact O-N 2.97Å; G278-A282 VanDerWaalsContact O-CB 3.28Å; G278-A282 WeakPolarHBondContact O-CB 3.29Å; G278-A282 PolarHBondContact O-N 3.11Å
279	A	47.6	Very low	52.4	Low	46 Å²	46	94.7 Å²	94.7	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-43.8	173.9	0	0	0	0	0	110.5	P275 A281 A282 E283	P275-A279 WeakPolarHBondContact O-CA 3.45Å; P275-A279 WeakPolarHBondContact O-CB 3.42Å; P275-A279 PolarHBondContact O-N 3.12Å; A279-A281 VanDerWaalsContact C-N 3.32Å; A279-A281 PolarHBondContact O-N 3.48Å; A279-A282 PolarHBondContact O-N 3.35Å; A279-E283 WeakPolarHBondContact O-CB 3.47Å; A279-E283 PolarHBondContact O-N 3.44Å
280	N	44.8	Very low	52.4	Low	94 Å²	94	91.7 Å²	91.7	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-39.8	174.1	-71	-18.7	0	0	0	111.5	L276 L284	L276-N280 VanDerWaalsContact O-CB 3.24Å; L276-N280 WeakPolarHBondContact O-CB 3.35Å; L276-N280 PolarHBondContact O-N 3.44Å; L276-N280 PolarHBondContact O-ND2 2.9Å; L276-N280 VanDerWaalsContact O-ND2 3.11Å; N280-L284 VanDerWaalsContact O-CB 3.24Å; N280-L284 WeakPolarHBondContact O-CB 3.49Å; N280-L284 PolarHBondContact O-N 3.17Å
281	A	50.3	Low	52.7	Low	50 Å²	50	94.8 Å²	94.8	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-70.1	-35.8	176.5	0	0	0	0	0	113.1	L277 G278 A279 N285	L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.47Å; L277-A281 PolarHBondContact O-N 2.82Å; G278-A281 PolarHBondContact O-N 2.97Å; A279-A281 VanDerWaalsContact C-N 3.32Å; A279-A281 PolarHBondContact O-N 3.48Å; A281-N285 WeakPolarHBondContact O-CB 3.3Å; A281-N285 PolarHBondContact O-N 3.41Å; A281-N285 PolarHBondContact O-ND2 3.18Å
282	A	54.3	Low	53.4	Low	60 Å²	60	93.1 Å²	93.1	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-71.9	-40.5	175.5	0	0	0	0	0	111.8	G278 A279 N285 A286	G278-A282 VanDerWaalsContact O-CB 3.28Å; G278-A282 WeakPolarHBondContact O-CB 3.29Å; G278-A282 PolarHBondContact O-N 3.11Å; A279-A282 PolarHBondContact O-N 3.35Å; A282-N285 PolarHBondContact O-N 2.94Å; A282-A286 WeakPolarHBondContact O-CB 3.46Å; A282-A286 PolarHBondContact O-N 2.92Å
283	E	56.1	Low	53.7	Low	128 Å²	128	95.3 Å²	95.3	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-66.2	-39.1	172.2	-90.7	177.3	138.2	0	0	111.6	A279 A286 Q287	A279-E283 WeakPolarHBondContact O-CB 3.47Å; A279-E283 PolarHBondContact O-N 3.44Å; E283-A286 PolarHBondContact O-N 3.05Å; E283-Q287 VanDerWaalsContact O-CB 3.29Å; E283-Q287 WeakPolarHBondContact O-CB 3.48Å; E283-Q287 WeakPolarHBondContact O-CG 3.41Å; E283-Q287 PolarHBondContact O-N 2.85Å
284	L	59.3	Low	54.3	Low	99 Å²	99	94 Å²	94	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-42	175.3	-145	105.3	0	0	0	111.2	N280 Q288	N280-L284 VanDerWaalsContact O-CB 3.24Å; N280-L284 WeakPolarHBondContact O-CB 3.49Å; N280-L284 PolarHBondContact O-N 3.17Å; L284-Q288 VanDerWaalsContact O-CB 3.32Å; L284-Q288 WeakPolarHBondContact O-CB 3.31Å; L284-Q288 VanDerWaalsContact O-CG 3.24Å; L284-Q288 WeakPolarHBondContact O-CG 3.41Å; L284-Q288 PolarHBondContact O-N 2.93Å
285	N	62.4	Low	54.9	Low	90 Å²	90	97.4 Å²	97.4	48%	0.481	53%	0.534	S	S	.	.	H	α-helix	trans	-69.9	-34.6	175.5	-85.7	-28.9	0	0	0	112.7	A281 A282 R289	A281-N285 WeakPolarHBondContact O-CB 3.3Å; A281-N285 PolarHBondContact O-N 3.41Å; A281-N285 PolarHBondContact O-ND2 3.18Å; A282-N285 PolarHBondContact O-N 2.94Å; N285-R289 WeakPolarHBondContact O-CB 3.48Å; N285-R289 WeakPolarHBondContact O-CG 3.47Å; N285-R289 PolarHBondContact O-N 3.17Å
286	A	68.5	Low	55.6	Low	58 Å²	58	97.6 Å²	97.6	48%	0.479	54%	0.543	S	S	.	.	H	α-helix	trans	-70.9	-41.4	174.9	0	0	0	0	0	111.5	A282 E283 R289 S290	A282-A286 WeakPolarHBondContact O-CB 3.46Å; A282-A286 PolarHBondContact O-N 2.92Å; E283-A286 PolarHBondContact O-N 3.05Å; A286-R289 PolarHBondContact O-N 3.44Å; A286-S290 PolarHBondContact O-N 3.34Å
287	Q	65.3	Low	56.2	Low	134 Å²	134	103 Å²	103	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-63.1	-43.6	171.9	-84.6	-177.2	-16.9	0	0	111	E283 S290 R291	E283-Q287 VanDerWaalsContact O-CB 3.29Å; E283-Q287 WeakPolarHBondContact O-CB 3.48Å; E283-Q287 WeakPolarHBondContact O-CG 3.41Å; E283-Q287 PolarHBondContact O-N 2.85Å; Q287-S290 PolarHBondContact O-N 3.13Å; Q287-S290 PolarHBondContact O-OG 3.25Å; Q287-R291 WeakPolarHBondContact O-CB 3.48Å; Q287-R291 PolarHBondContact O-N 2.9Å
288	Q	61.7	Low	56.8	Low	103 Å²	103	103.7 Å²	103.7	48%	0.481	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-42.6	175.4	-77.9	179.8	-3.3	0	0	112.1	L284 R291 T292	L284-Q288 VanDerWaalsContact O-CB 3.32Å; L284-Q288 WeakPolarHBondContact O-CB 3.31Å; L284-Q288 VanDerWaalsContact O-CG 3.24Å; L284-Q288 WeakPolarHBondContact O-CG 3.41Å; L284-Q288 PolarHBondContact O-N 2.93Å; Q288-R291 PolarHBondContact O-N 3.17Å; Q288-T292 WeakPolarHBondContact O-CG2 3.49Å; Q288-T292 PolarHBondContact O-N 2.97Å; Q288-T292 PolarHBondContact O-OG1 3.13Å
289	R	63.5	Low	56.8	Low	177 Å²	177	104.9 Å²	104.9	67%	0.668	57%	0.571	S	S	*	*	H	α-helix	trans	-62.8	-44.1	174.8	-77.6	-179.6	-176.5	-179.8	1.6	112.4	N285 A286 R291 T292 E293	N285-R289 WeakPolarHBondContact O-CB 3.48Å; N285-R289 WeakPolarHBondContact O-CG 3.47Å; N285-R289 PolarHBondContact O-N 3.17Å; A286-R289 PolarHBondContact O-N 3.44Å; R289-R291 PolarHBondContact O-N 3.33Å; R289-T292 WeakPolarHBondContact CA-OG1 3.47Å; R289-T292 PolarHBondContact O-N 3.27Å; R289-T292 PolarHBondContact O-OG1 3.22Å; R289-E293 WeakPolarHBondContact O-CB 3.32Å; R289-E293 WeakPolarHBondContact O-CG 3.28Å; R289-E293 PolarHBondContact O-N 3.13Å
290	S	64.1	Low	56.9	Low	68 Å²	68	108.4 Å²	108.4	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-62.5	-33.7	174.9	81.1	0	0	0	0	112	A286 Q287 A294	A286-S290 PolarHBondContact O-N 3.34Å; Q287-S290 PolarHBondContact O-N 3.13Å; Q287-S290 PolarHBondContact O-OG 3.25Å; S290-A294 VanDerWaalsContact O-CB 3.23Å; S290-A294 WeakPolarHBondContact O-CB 3.44Å; S290-A294 PolarHBondContact O-N 2.94Å
291	R	63.4	Low	56.8	Low	189 Å²	189	110.2 Å²	110.2	71%	0.713	60%	0.603	S	S	*	*	H	α-helix	trans	-73.4	-38.4	178.3	-134.8	176	164.8	136.8	-2.6	111.9	Q287 Q288 R289 L295	Q287-R291 WeakPolarHBondContact O-CB 3.48Å; Q287-R291 PolarHBondContact O-N 2.9Å; Q288-R291 PolarHBondContact O-N 3.17Å; R289-R291 PolarHBondContact O-N 3.33Å; R291-L295 WeakPolarHBondContact O-CB 3.25Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 3.13Å
292	T	61.6	Low	56.1	Low	88 Å²	88	118.9 Å²	118.9	54%	0.54	63%	0.625	S	S	.	*	H	α-helix	trans	-70.3	-35.9	174.2	51.5	0	0	0	0	111.9	Q288 R289 A296	Q288-T292 WeakPolarHBondContact O-CG2 3.49Å; Q288-T292 PolarHBondContact O-N 2.97Å; Q288-T292 PolarHBondContact O-OG1 3.13Å; R289-T292 WeakPolarHBondContact CA-OG1 3.47Å; R289-T292 PolarHBondContact O-N 3.27Å; R289-T292 PolarHBondContact O-OG1 3.22Å; T292-A296 WeakPolarHBondContact O-CB 3.35Å; T292-A296 PolarHBondContact O-N 3.36Å
293	E	55.6	Low	55.2	Low	128 Å²	128	121 Å²	121	60%	0.598	63%	0.631	S	S	*	*	H	α-helix	trans	-71.7	-35.5	175.1	-72.7	175.3	-170	0	0	112.1	R289 R297	R289-E293 WeakPolarHBondContact O-CB 3.32Å; R289-E293 WeakPolarHBondContact O-CG 3.28Å; R289-E293 PolarHBondContact O-N 3.13Å; E293-R297 PolarHBondContact O-N 2.8Å
294	A	55	Low	54.5	Low	52 Å²	52	120.7 Å²	120.7	43%	0.43	64%	0.639	S	S	.	*	H	α-helix	trans	-69	-39.6	172.9	0	0	0	0	0	112.2	S290 R297 L298	S290-A294 VanDerWaalsContact O-CB 3.23Å; S290-A294 WeakPolarHBondContact O-CB 3.44Å; S290-A294 PolarHBondContact O-N 2.94Å; A294-R297 PolarHBondContact O-N 2.55Å; A294-L298 PolarHBondContact O-N 3.44Å
295	L	54.1	Low	53.5	Low	121 Å²	121	122.1 Å²	122.1	63%	0.634	65%	0.652	S	S	*	*	H	α-helix	trans	-68	-33.9	174.9	-83.5	162.2	0	0	0	112.5	R291 R297 L298	R291-L295 WeakPolarHBondContact O-CB 3.25Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 3.13Å; L295-R297 PolarHBondContact O-N 2.89Å; L295-L298 PolarHBondContact O-N 3.46Å
296	A	55.5	Low	52.4	Low	82 Å²	82	123 Å²	123	68%	0.678	67%	0.672	S	S	*	*	H	α-helix	trans	-67.5	-22.8	174.3	0	0	0	0	0	113.2	T292	T292-A296 WeakPolarHBondContact O-CB 3.35Å; T292-A296 PolarHBondContact O-N 3.36Å
297	R	54.3	Low	50.9	Low	225 Å²	225	123.5 Å²	123.5	85%	0.849	68%	0.682	S	S	*	*	H	α-helix	trans	-86.9	-14.4	177.4	-72.6	-174.9	175.7	172.5	1.9	114.5	E293 A294 L295 G299	E293-R297 PolarHBondContact O-N 2.8Å; A294-R297 PolarHBondContact O-N 2.55Å; L295-R297 PolarHBondContact O-N 2.89Å; R297-G299 VanDerWaalsContact C-N 3.33Å; R297-G299 PolarHBondContact O-N 3.45Å
298	L	53.2	Low	49.8	Very low	144 Å²	144	124.9 Å²	124.9	75%	0.754	69%	0.692	S	S	*	*	S	Bend	trans	-88.3	7.6	-177.9	-85.5	154.6	0	0	0	114.4	A294 L295	A294-L298 PolarHBondContact O-N 3.44Å; L295-L298 PolarHBondContact O-N 3.46Å
299	G	42.5	Very low	48.6	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	71%	0.708	S	S	*	*	S	Bend	trans	-86	4.9	-174.4	0	0	0	0	0	117.9	R297	R297-G299 VanDerWaalsContact C-N 3.33Å; R297-G299 PolarHBondContact O-N 3.45Å
300	T	50.1	Low	47.2	Very low	120 Å²	120	120.4 Å²	120.4	74%	0.736	71%	0.71	S	S	*	*	S	Bend	trans	-141.3	126.9	-175.2	-32.2	0	0	0	0	113.6
301	T	42.3	Very low	45.9	Very low	132 Å²	132	126 Å²	126	81%	0.81	73%	0.729	S	S	*	*			trans	77.6	106	170.7	72.7	0	0	0	0	115.7
302	R	35.3	Very low	44.4	Very low	233 Å²	233	121.9 Å²	121.9	88%	0.879	73%	0.729	S	S	*	*				86.1	112	51.1	-150	-162	162.7	163	-5.3	113.6
303	T	36.4	Very low	43.2	Very low	103 Å²	103	122.4 Å²	122.4	63%	0.632	74%	0.736	S	S	*	*			trans	96.7	131.7	143.9	1.3	0	0	0	0	122.4
304	T	40.7	Very low	42.2	Very low	122 Å²	122	122.3 Å²	122.3	75%	0.748	75%	0.745	S	S	*	*			trans	81.3	140	155.3	66.2	0	0	0	0	118.4
305	T	38.8	Very low	41.2	Very low	129 Å²	129	131.8 Å²	131.8	79%	0.791	77%	0.77	S	S	*	*			cis	-177.4	142.9	-33.3	15.9	0	0	0	0	105.8
306	A	38.1	Very low	40.2	Very low	109 Å²	109	129.2 Å²	129.2	90%	0.901	77%	0.772	S	S	*	*			trans	66.5	143.4	164.8	0	0	0	0	0	117.8
307	G	37.6	Very low	39.3	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	78%	0.778	S	S	*	*			cis	170.2	132.9	0.2	0	0	0	0	0	109.4
308	I	43.1	Very low	38.3	Very low	163 Å²	163	125.6 Å²	125.6	84%	0.836	78%	0.776	S	S	*	*			trans	70	109.3	136.3	-56.2	173.9	0	0	0	120.7
309	S	34.8	Very low	37.5	Very low	117 Å²	117	124 Å²	124	82%	0.818	78%	0.777	S	S	*	*			trans	58	141.4	137	75.5	0	0	0	0	124.2
310	G	35.8	Very low	37.1	Very low	69 Å²	69	128.7 Å²	128.7	71%	0.711	79%	0.786	S	S	*	*			trans	142.2	97.5	142.5	0	0	0	0	0	117
311	E	34.9	Very low	36.6	Very low	185 Å²	185	130.4 Å²	130.4	86%	0.864	79%	0.789	S	S	*	*			trans	44.8	122.3	136	-66	179.7	158	0	0	123.9
312	S	32.8	Very low	36	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	79%	0.787	S	S	*	*				56.2	144.2	124.2	82.8	0	0	0	0	123.5
313	S	35.5	Very low	36.3	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	78%	0.78	S	S	*	*			trans	108.4	99	149.5	-55.3	0	0	0	0	118.8
314	T	35.1	Very low	36.1	Very low	126 Å²	126	125.2 Å²	125.2	77%	0.773	78%	0.784	S	S	*	*				34.4	147.4	123.1	55.3	0	0	0	0	122.9
315	R	35.3	Very low	35.9	Very low	252 Å²	252	124.6 Å²	124.6	95%	0.951	78%	0.784	S	S	*	*			trans	82.4	132.9	173.6	-57.1	175.1	172	-179.9	-2.7	112.4
316	G	31.8	Very low	35.7	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	79%	0.792	S	S	*	*			cis	146	144.3	16.7	0	0	0	0	0	105.6
317	S	37.8	Very low	35.5	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	79%	0.788	S	S	*	*			trans	86.8	108.9	162.3	-47.8	0	0	0	0	119.6
318	S	33.1	Very low	35.4	Very low	115 Å²	115	134.5 Å²	134.5	80%	0.804	79%	0.789	S	S	*	*				59.9	111.1	117.6	-37.2	0	0	0	0	121.1
319	S	36.6	Very low	35	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	78%	0.78	S	S	*	*			trans	173.5	114.4	132.3	36	0	0	0	0	108
320	L	34	Very low	35	Very low	164 Å²	164	136.1 Å²	136.1	86%	0.859	78%	0.781	S	S	*	*				41.6	111.2	95.1	-82.6	151.6	0	0	0	112.3
321	I	38.9	Very low	35	Very low	156 Å²	156	140.7 Å²	140.7	80%	0.8	78%	0.783	S	S	*	*			trans	176	118.4	136.6	-82.7	145.1	0	0	0	107.7
322	D	28.7	Very low	35	Very low	147 Å²	147	138 Å²	138	79%	0.786	78%	0.782	S	S	*	*			trans	-81.9	142.2	163.1	-168	16.9	0	0	0	108.2
323	P	41.5	Very low	35.3	Very low	111 Å²	111	136.5 Å²	136.5	72%	0.721	78%	0.782	S	S	*	*			trans	-131.6	109	159.9	32.8	-16.4	0	0	0	112.5
324	S	34	Very low	35.2	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	79%	0.79	S	S	*	*			trans	-66.8	150.9	148.8	-72.6	0	0	0	0	111
325	S	35.3	Very low	35.3	Very low	109 Å²	109	139 Å²	139	76%	0.762	79%	0.793	S	S	*	*			trans	82.3	109	161.5	78.5	0	0	0	0	118.6
326	R	35	Very low	35.3	Very low	252 Å²	252	135.6 Å²	135.6	95%	0.951	79%	0.792	S	S	*	*			trans	-141.8	111	138	-120.4	179.2	-148.6	-136.3	4.3	111.3
327	I	33.8	Very low	35.4	Very low	158 Å²	158	135.8 Å²	135.8	81%	0.81	79%	0.793	S	S	*	*			trans	-65.8	134	167	-67.1	156.9	0	0	0	109
328	S	36.3	Very low	35	Very low	104 Å²	104	133.7 Å²	133.7	73%	0.727	79%	0.79	S	S	*	*			trans	-174.5	104.5	133.4	-123.6	0	0	0	0	113.4
329	S	34.1	Very low	35.1	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	79%	0.791	S	S	*	*			trans	31.4	120.7	132.5	67.4	0	0	0	0	120.7
330	R	34.8	Very low	35.1	Very low	221 Å²	221	137.1 Å²	137.1	83%	0.834	79%	0.789	S	S	*	*				164	137.1	105.1	-91.8	-179.5	179.9	-178.4	-1.3	113.5
331	H	35.4	Very low	35.1	Very low	166 Å²	166	134.1 Å²	134.1	77%	0.769	78%	0.779	S	S	*	*			trans	74.9	118.9	159.6	-69	-63.2	0	0	0	121.1
332	P	35.4	Very low	35.3	Very low	128 Å²	128	132.6 Å²	132.6	83%	0.831	78%	0.777	S	S	*	*			trans	-91	142.1	163.8	35.3	-26.9	0	0	0	110.9
333	G	38.1	Very low	36.2	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	77%	0.772	S	S	*	*			trans	-175.1	102.1	174.8	0	0	0	0	0	111.4
334	D	34.7	Very low	36.2	Very low	159 Å²	159	127.7 Å²	127.7	85%	0.85	77%	0.766	S	S	*	*			trans	19.5	110.1	159.1	-61.9	-27	0	0	0	119.7
335	S	35.9	Very low	37	Very low	120 Å²	120	125 Å²	125	84%	0.839	75%	0.754	S	S	*	*			trans	-142.1	99.9	154.5	-70.1	0	0	0	0	109.2	G337	S335-G337 PolarHBondContact O-N 2.8Å
336	I	36.2	Very low	38.3	Very low	180 Å²	180	125.1 Å²	125.1	92%	0.923	74%	0.743	S	S	*	*			trans	-65.8	96.5	171.2	-63.4	170.9	0	0	0	107.3
337	G	32.8	Very low	39.6	Very low	69 Å²	69	117.1 Å²	117.1	71%	0.711	73%	0.725	S	S	*	*			trans	-115.3	110	172.2	0	0	0	0	0	110.1	S335	S335-G337 PolarHBondContact O-N 2.8Å
338	G	30.9	Very low	41.2	Very low	73 Å²	73	112 Å²	112	75%	0.753	70%	0.696	S	S	*	*			trans	-65	130.6	-177.5	0	0	0	0	0	113.6	V340	G338-V340 PolarHBondContact O-N 2.78Å
339	H	35.4	Very low	42.8	Very low	179 Å²	179	115.3 Å²	115.3	83%	0.829	69%	0.693	S	S	*	*			trans	-78.3	108	171	-153.7	-65.8	0	0	0	109
340	V	36.4	Very low	44.7	Very low	119 Å²	119	113.7 Å²	113.7	72%	0.721	68%	0.677	S	S	*	*			trans	-76.9	131.1	171.4	178	0	0	0	0	108.7	G338 T342	G338-V340 PolarHBondContact O-N 2.78Å; V340-T342 PolarHBondContact O-N 3.39Å
341	P	33.8	Very low	46.5	Very low	101 Å²	101	104.6 Å²	104.6	66%	0.656	65%	0.649	S	S	*	*			trans	-73.9	120.4	-178.3	28.2	-31.6	0	0	0	111.2	S343	P341-S343 PolarHBondContact O-N 3.21Å
342	T	43	Very low	48.5	Very low	124 Å²	124	97.6 Å²	97.6	76%	0.761	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	9.8	-178.7	-32	0	0	0	0	113.8	V340 G344	V340-T342 PolarHBondContact O-N 3.39Å; T342-G344 PolarHBondContact O-N 2.97Å
343	S	47.1	Very low	50.5	Low	96 Å²	96	92.7 Å²	92.7	67%	0.671	59%	0.588	S	S	*	*	H	α-helix	trans	-70.9	-28	-170.6	63	0	0	0	0	114.9	P341 G345	P341-S343 PolarHBondContact O-N 3.21Å; S343-G345 VanDerWaalsContact C-N 3.31Å; S343-G345 PolarHBondContact O-N 3.02Å
344	G	41.5	Very low	52.4	Low	59 Å²	59	92.4 Å²	92.4	61%	0.608	57%	0.567	S	S	*	*	H	α-helix	trans	-70.1	-23.1	-178	0	0	0	0	0	114.8	T342	T342-G344 PolarHBondContact O-N 2.97Å
345	G	51.9	Low	54.4	Low	44 Å²	44	85.1 Å²	85.1	45%	0.454	53%	0.529	S	S	.	.	H	α-helix	trans	-75.4	-29	-178	0	0	0	0	0	114	S343 R349	S343-G345 VanDerWaalsContact C-N 3.31Å; S343-G345 PolarHBondContact O-N 3.02Å; G345-R349 PolarHBondContact O-N 3.19Å
346	Q	61.6	Low	56.6	Low	112 Å²	112	83.3 Å²	83.3	52%	0.523	50%	0.504	S	S	.	.	H	α-helix	trans	-72.8	-47.6	-177.8	-155.5	70.2	23.9	0	0	110.9	Y348 R349 D350	Q346-Y348 VanDerWaalsContact C-N 3.26Å; Q346-Y348 PolarHBondContact O-N 2.75Å; Q346-R349 PolarHBondContact O-N 3.28Å; Q346-D350 PolarHBondContact O-N 2.87Å
347	S	62.7	Low	58.9	Low	84 Å²	84	74.9 Å²	74.9	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-58	-35.4	178.8	179	0	0	0	0	113.3	A351	S347-A351 WeakPolarHBondContact O-CB 3.32Å; S347-A351 PolarHBondContact O-N 3.04Å
348	Y	67.1	Low	61.2	Low	51 Å²	51	72.3 Å²	72.3	20%	0.2	43%	0.43	C	S	.	.	H	α-helix	trans	-70.2	-40.5	175.5	-176.7	-93.5	0	0	0	112.7	Q235 R271 Q346 D350 A351 L352	Q235-Y348 HydrophobicContact CB-CE2 4.05Å; Q235-Y348 HydrophobicContact CG-CE2 4.38Å; R271-Y348 PolarHBondContact NH1-OH 3.43Å; Q346-Y348 VanDerWaalsContact C-N 3.26Å; Q346-Y348 PolarHBondContact O-N 2.75Å; Y348-D350 VanDerWaalsContact C-N 3.34Å; Y348-A351 PolarHBondContact O-N 3.42Å; Y348-L352 PolarHBondContact O-N 2.69Å
349	R	71	Confident	63.8	Low	173 Å²	173	69.1 Å²	69.1	65%	0.653	40%	0.396	S	S	*	.	H	α-helix	trans	-64.9	-41.7	176	-75.2	-178.4	177.5	178	-0.7	111	G345 Q346 L352 A353	G345-R349 PolarHBondContact O-N 3.19Å; Q346-R349 PolarHBondContact O-N 3.28Å; R349-L352 PolarHBondContact O-N 3.07Å; R349-A353 WeakPolarHBondContact O-CB 3.47Å; R349-A353 PolarHBondContact O-N 2.92Å
350	D	73	Confident	66.2	Low	58 Å²	58	61.1 Å²	61.1	31%	0.31	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-41.5	177.5	-57.7	-22.5	0	0	0	110.6	Q346 Y348 L352 A353 Q354	Q346-D350 PolarHBondContact O-N 2.87Å; Y348-D350 VanDerWaalsContact C-N 3.34Å; D350-L352 PolarHBondContact O-N 3.38Å; D350-A353 PolarHBondContact O-N 3.28Å; D350-Q354 WeakPolarHBondContact O-CB 3.5Å; D350-Q354 WeakPolarHBondContact O-CG 3.26Å; D350-Q354 PolarHBondContact O-N 3.01Å
351	A	72.2	Confident	68.6	Low	31 Å²	31	56.4 Å²	56.4	26%	0.256	33%	0.331	S	S	.	.	H	α-helix	trans	-64.6	-38	175.4	0	0	0	0	0	113	S347 Y348 A355	S347-A351 WeakPolarHBondContact O-CB 3.32Å; S347-A351 PolarHBondContact O-N 3.04Å; Y348-A351 PolarHBondContact O-N 3.42Å; A351-A355 PolarHBondContact O-N 3.32Å
352	L	77.5	Confident	71.2	Confident	18 Å²	18	51.8 Å²	51.8	9%	0.094	30%	0.302	C	S	.	.	H	α-helix	trans	-68.9	-41.9	175.3	-171.7	77.1	0	0	0	111.4	L238 Y348 R349 D350 Q354 A355 R356	L238-L352 HydrophobicContact CD1-CD1 3.75Å; Y348-L352 PolarHBondContact O-N 2.69Å; R349-L352 PolarHBondContact O-N 3.07Å; D350-L352 PolarHBondContact O-N 3.38Å; L352-Q354 VanDerWaalsContact C-N 3.34Å; L352-A355 PolarHBondContact O-N 3.49Å; L352-R356 WeakPolarHBondContact O-CG 3.29Å; L352-R356 PolarHBondContact O-N 3.24Å
353	A	77.1	Confident	73.4	Confident	25 Å²	25	46.7 Å²	46.7	21%	0.207	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-39.2	176.8	0	0	0	0	0	111.4	R349 D350 R356 T357 H387	R349-A353 WeakPolarHBondContact O-CB 3.47Å; R349-A353 PolarHBondContact O-N 2.92Å; D350-A353 PolarHBondContact O-N 3.28Å; A353-R356 WeakPolarHBondContact O-CB 3.43Å; A353-R356 PolarHBondContact O-N 3.5Å; A353-T357 PolarHBondContact O-N 2.9Å; A353-H387 VanDerWaalsContact CB-CD2 3.43Å; A353-H387 WeakPolarHBondContact CB-CD2 3.44Å; A353-H387 VanDerWaalsContact CB-NE2 3.28Å; A353-H387 WeakPolarHBondContact CB-NE2 3.29Å
354	Q	78.5	Confident	75.4	Confident	65 Å²	65	42.1 Å²	42.1	30%	0.304	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-50.1	168.3	-72.1	167.2	16	0	0	111.2	D350 L352 R356 T357 Q358 H387	D350-Q354 WeakPolarHBondContact O-CB 3.5Å; D350-Q354 WeakPolarHBondContact O-CG 3.26Å; D350-Q354 PolarHBondContact O-N 3.01Å; L352-Q354 VanDerWaalsContact C-N 3.34Å; Q354-R356 PolarHBondContact O-N 2.98Å; Q354-T357 PolarHBondContact O-N 3.4Å; Q354-T357 VanDerWaalsContact O-N 3.16Å; Q354-T357 PolarHBondContact O-OG1 3.23Å; Q354-Q358 WeakPolarHBondContact O-CG 3.5Å; Q354-Q358 PolarHBondContact O-N 2.88Å; Q354-H387 HydrophobicContact CB-CB 4.34Å; Q354-H387 HydrophobicContact CG-CB 3.64Å
355	A	78	Confident	77.6	Confident	6 Å²	6	39.4 Å²	39.4	5%	0.05	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-38.5	177.6	0	0	0	0	0	112	L242 A351 L352 Q358 L359	L242-A355 HydrophobicContact CD1-CB 4.1Å; A351-A355 PolarHBondContact O-N 3.32Å; L352-A355 PolarHBondContact O-N 3.49Å; A355-Q358 PolarHBondContact O-N 2.94Å; A355-L359 WeakPolarHBondContact O-CB 3.3Å; A355-L359 WeakPolarHBondContact O-CG 3.35Å; A355-L359 PolarHBondContact O-N 3.35Å
356	R	81.9	Confident	79.5	Confident	82 Å²	82	38 Å²	38	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-62.7	-46.5	175.8	-73.6	175.4	-179.4	172	2.3	112.7	S268 D272 L352 A353 Q354 Q358 L359 A360	S268-R356 PolarHBondContact O-NH2 3.26Å; S268-R356 VanDerWaalsContact OG-CG 3.23Å; S268-R356 WeakPolarHBondContact OG-CG 3.43Å; S268-R356 PolarHBondContact OG-NE 3.13Å; D272-R356 IonicContact OD1-CZ 2.79Å; D272-R356 IonicContact OD1-NH1 3.57Å; D272-R356 IonicContact OD1-NH2 3.07Å; D272-R356 PolarHBondContact OD1-NH2 2.97Å; D272-R356 IonicContact OD2-CZ 2.6Å; D272-R356 IonicContact OD2-NH1 3.66Å; D272-R356 PolarHBondContact OD2-NH1 3.35Å; D272-R356 IonicContact OD2-NH2 3.58Å; D272-R356 PolarHBondContact OD2-NH2 3.32Å; L352-R356 WeakPolarHBondContact O-CG 3.29Å; L352-R356 PolarHBondContact O-N 3.24Å; A353-R356 WeakPolarHBondContact O-CB 3.43Å; A353-R356 PolarHBondContact O-N 3.5Å; Q354-R356 PolarHBondContact O-N 2.98Å; R356-Q358 VanDerWaalsContact C-N 3.33Å; R356-Q358 PolarHBondContact O-N 2.83Å; R356-L359 PolarHBondContact O-N 3.41Å; R356-A360 WeakPolarHBondContact O-CB 3.41Å; R356-A360 PolarHBondContact O-N 2.78Å
357	T	82.9	Confident	80.9	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-40.1	177.9	57.9	0	0	0	0	111.6	A353 Q354 A360 I361 V383 N384 H387	A353-T357 PolarHBondContact O-N 2.9Å; Q354-T357 PolarHBondContact O-N 3.4Å; Q354-T357 VanDerWaalsContact O-N 3.16Å; Q354-T357 PolarHBondContact O-OG1 3.23Å; T357-A360 PolarHBondContact O-N 3.26Å; T357-I361 WeakPolarHBondContact O-CG1 3.47Å; T357-I361 PolarHBondContact O-N 3.28Å; T357-V383 HydrophobicContact CG2-CG1 4.47Å; T357-N384 HydrophobicContact CG2-CB 3.94Å; T357-H387 HydrophobicContact CG2-CB 4.12Å
358	Q	82.5	Confident	82.2	Confident	14 Å²	14	31.3 Å²	31.3	7%	0.065	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-41.2	177	-62.9	-176.3	-11.1	0	0	112.6	L242 Q354 A355 R356 I361 A362 S390 T392	L242-Q358 HydrophobicContact CD2-CB 3.81Å; Q354-Q358 WeakPolarHBondContact O-CG 3.5Å; Q354-Q358 PolarHBondContact O-N 2.88Å; A355-Q358 PolarHBondContact O-N 2.94Å; R356-Q358 VanDerWaalsContact C-N 3.33Å; R356-Q358 PolarHBondContact O-N 2.83Å; Q358-I361 PolarHBondContact O-N 3.32Å; Q358-A362 WeakPolarHBondContact O-CB 3.38Å; Q358-A362 PolarHBondContact O-N 3.26Å; Q358-S390 PolarHBondContact NE2-OG 2.75Å; Q358-T392 WeakPolarHBondContact CB-OG1 3.47Å; Q358-T392 HydrophobicContact CG-CG2 4.36Å; Q358-T392 WeakPolarHBondContact CG-OG1 3.42Å; Q358-T392 PolarHBondContact NE2-OG1 3.19Å; Q358-T392 VanDerWaalsContact NE2-OG1 3.12Å; Q358-T392 VanDerWaalsContact OE1-CG2 3.3Å; Q358-T392 PolarHBondContact OE1-OG1 3.24Å
359	L	85.3	Confident	83.2	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-39.4	175.5	-71.1	172.9	0	0	0	111.8	L238 L242 I245 A264 A355 R356 A362 A363	L238-L359 HydrophobicContact CD2-CD1 4.48Å; L242-L359 HydrophobicContact CD2-CD2 4Å; L242-L359 HydrophobicContact CD2-CG 4.22Å; I245-L359 HydrophobicContact CD1-CD2 3.7Å; A264-L359 HydrophobicContact CB-CD1 3.59Å; A264-L359 HydrophobicContact CB-CD2 3.4Å; A264-L359 HydrophobicContact CB-CG 4.13Å; A355-L359 WeakPolarHBondContact O-CB 3.3Å; A355-L359 WeakPolarHBondContact O-CG 3.35Å; A355-L359 PolarHBondContact O-N 3.35Å; R356-L359 PolarHBondContact O-N 3.41Å; L359-A362 PolarHBondContact O-N 3.34Å; L359-A363 VanDerWaalsContact O-CB 3.3Å; L359-A363 WeakPolarHBondContact O-CB 3.27Å; L359-A363 PolarHBondContact O-N 3.03Å
360	A	86	Confident	84.1	Confident	10 Å²	10	25.6 Å²	25.6	8%	0.083	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-41.7	175.2	0	0	0	0	0	112	R356 T357 A363 G364 Q382 V383	R356-A360 WeakPolarHBondContact O-CB 3.41Å; R356-A360 PolarHBondContact O-N 2.78Å; T357-A360 PolarHBondContact O-N 3.26Å; A360-A363 PolarHBondContact O-N 2.88Å; A360-G364 PolarHBondContact O-N 2.75Å; A360-Q382 HydrophobicContact CB-CB 4.45Å; A360-V383 HydrophobicContact CB-CG2 4.07Å
361	I	87.4	Confident	84.8	Confident	21 Å²	21	31.1 Å²	31.1	11%	0.108	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-47.2	173.9	-65.4	166.6	0	0	0	110.5	T357 Q358 A363 G364 L365 V383 V396 L401	T357-I361 WeakPolarHBondContact O-CG1 3.47Å; T357-I361 PolarHBondContact O-N 3.28Å; Q358-I361 PolarHBondContact O-N 3.32Å; I361-A363 PolarHBondContact O-N 3.06Å; I361-G364 PolarHBondContact O-N 2.75Å; I361-L365 HydrophobicContact CG2-CD1 4.37Å; I361-L365 WeakPolarHBondContact O-CG 3.42Å; I361-L365 PolarHBondContact O-N 3.18Å; I361-V383 HydrophobicContact CD1-CG1 4.23Å; I361-V383 HydrophobicContact CD1-CG2 4.46Å; I361-V383 HydrophobicContact CG1-CG1 4.33Å; I361-V383 HydrophobicContact CG1-CG2 3.68Å; I361-V396 HydrophobicContact CG2-CB 4.35Å; I361-V396 HydrophobicContact CG2-CG2 4.21Å; I361-L401 HydrophobicContact CG1-CD1 4.45Å
362	A	87.4	Confident	85.8	Confident	4 Å²	4	33 Å²	33	3%	0.033	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-43.4	178.6	0	0	0	0	0	112	I245 V257 V261 Q358 L359 L365 V366	I245-A362 HydrophobicContact CG2-CB 3.7Å; V257-A362 HydrophobicContact CG1-CB 4.49Å; V261-A362 HydrophobicContact CG2-CB 3.82Å; Q358-A362 WeakPolarHBondContact O-CB 3.38Å; Q358-A362 PolarHBondContact O-N 3.26Å; L359-A362 PolarHBondContact O-N 3.34Å; A362-L365 PolarHBondContact O-N 3.28Å; A362-V366 VanDerWaalsContact O-CG2 3.31Å; A362-V366 WeakPolarHBondContact O-CG2 3.4Å; A362-V366 PolarHBondContact O-N 2.93Å
363	A	88.7	Confident	86.5	Confident	16 Å²	16	33.2 Å²	33.2	13%	0.132	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-46.3	174.3	0	0	0	0	0	111.5	V261 L359 A360 I361 L365 V366 E367 N379	V261-A363 HydrophobicContact CG1-CB 3.73Å; L359-A363 VanDerWaalsContact O-CB 3.3Å; L359-A363 WeakPolarHBondContact O-CB 3.27Å; L359-A363 PolarHBondContact O-N 3.03Å; A360-A363 PolarHBondContact O-N 2.88Å; I361-A363 PolarHBondContact O-N 3.06Å; A363-L365 VanDerWaalsContact C-N 3.33Å; A363-L365 PolarHBondContact O-N 2.68Å; A363-V366 PolarHBondContact O-N 3.47Å; A363-E367 PolarHBondContact O-N 3.24Å; A363-N379 HydrophobicContact CB-CB 4.39Å
364	G	88.9	Confident	87.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-38.8	177.2	0	0	0	0	0	112.8	A360 I361 E367 L368 F380	A360-G364 PolarHBondContact O-N 2.75Å; I361-G364 PolarHBondContact O-N 2.75Å; G364-E367 PolarHBondContact O-N 3.45Å; G364-L368 WeakPolarHBondContact O-CB 3.39Å; G364-L368 PolarHBondContact O-N 3.17Å; G364-F380 VanDerWaalsContact CA-CE1 3.49Å; G364-F380 WeakPolarHBondContact O-CZ 3.37Å
365	L	89.2	Confident	87.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-66.4	-37.4	174.3	-70.3	175.7	0	0	0	112.8	I249 W254 I361 A362 A363 L368 A369 F380 V396 F404 F469	I249-L365 HydrophobicContact CD1-CD1 4.34Å; W254-L365 HydrophobicContact CH2-CB 4.35Å; W254-L365 HydrophobicContact CZ3-CB 3.89Å; I361-L365 HydrophobicContact CG2-CD1 4.37Å; I361-L365 WeakPolarHBondContact O-CG 3.42Å; I361-L365 PolarHBondContact O-N 3.18Å; A362-L365 PolarHBondContact O-N 3.28Å; A363-L365 VanDerWaalsContact C-N 3.33Å; A363-L365 PolarHBondContact O-N 2.68Å; L365-L368 WeakPolarHBondContact O-CB 3.2Å; L365-L368 PolarHBondContact O-N 3.18Å; L365-A369 WeakPolarHBondContact O-CB 3.41Å; L365-A369 PolarHBondContact O-N 2.89Å; L365-F380 HydrophobicContact CD2-CZ 4.46Å; L365-V396 HydrophobicContact CD1-CG2 3.92Å; L365-V396 HydrophobicContact CD2-CG2 4.48Å; L365-F404 HydrophobicContact CD2-CD2 4.44Å; L365-F404 HydrophobicContact CD2-CE2 4Å; L365-F469 HydrophobicContact CD2-CD2 4.37Å; L365-F469 HydrophobicContact CD2-CG 4.23Å
366	V	90.4	Very high	88.4	Confident	14 Å²	14	34.4 Å²	34.4	9%	0.085	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-45.9	173.3	176.4	0	0	0	0	110.9	W254 V257 A362 A363 L368 A369 S370	W254-V366 HydrophobicContact CE3-CG2 4.28Å; V257-V366 HydrophobicContact CB-CG2 3.67Å; V257-V366 HydrophobicContact CG1-CG2 3.32Å; A362-V366 VanDerWaalsContact O-CG2 3.31Å; A362-V366 WeakPolarHBondContact O-CG2 3.4Å; A362-V366 PolarHBondContact O-N 2.93Å; A363-V366 PolarHBondContact O-N 3.47Å; V366-L368 VanDerWaalsContact C-N 3.33Å; V366-A369 PolarHBondContact O-N 3.4Å; V366-S370 PolarHBondContact O-N 2.95Å; V366-S370 PolarHBondContact O-OG 2.94Å
367	E	91	Very high	88.8	Confident	54 Å²	54	30.5 Å²	30.5	25%	0.252	16%	0.158	S	C	.	.	H	α-helix	trans	-68	-32.8	178.3	-67.2	-62.6	161.5	0	0	112.4	A363 G364 S370 R371 N372 A376	A363-E367 PolarHBondContact O-N 3.24Å; G364-E367 PolarHBondContact O-N 3.45Å; E367-S370 WeakPolarHBondContact CA-OG 3.41Å; E367-S370 PolarHBondContact O-N 3.13Å; E367-S370 PolarHBondContact O-OG 3.14Å; E367-S370 PolarHBondContact OE2-OG 3.47Å; E367-R371 PolarHBondContact O-N 2.74Å; E367-N372 CarbonylContact O-C 3.59Å; E367-N372 PolarHBondContact O-N 2.75Å; E367-N372 VanDerWaalsContact OE2-CB 3.27Å; E367-N372 WeakPolarHBondContact OE2-CB 3.28Å; E367-N372 PolarHBondContact OE2-ND2 3.09Å; E367-A376 HydrophobicContact CB-CB 3.78Å
368	L	90.8	Very high	89	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-49.6	171.5	-166.4	93.8	0	0	0	109.8	G364 L365 V366 S370 R371 A376 F469 H473	G364-L368 WeakPolarHBondContact O-CB 3.39Å; G364-L368 PolarHBondContact O-N 3.17Å; L365-L368 WeakPolarHBondContact O-CB 3.2Å; L365-L368 PolarHBondContact O-N 3.18Å; V366-L368 VanDerWaalsContact C-N 3.33Å; L368-S370 VanDerWaalsContact C-N 3.32Å; L368-S370 PolarHBondContact O-N 3.49Å; L368-R371 WeakPolarHBondContact O-CA 3.48Å; L368-R371 PolarHBondContact O-N 3.31Å; L368-A376 HydrophobicContact CB-CB 4.49Å; L368-F469 HydrophobicContact CD2-CB 4.27Å; L368-H473 PolarHBondContact O-CE1 3.18Å; L368-H473 PolarHBondContact O-NE2 3.07Å
369	A	88.7	Confident	89.2	Confident	31 Å²	31	34.5 Å²	34.5	26%	0.256	18%	0.178	S	C	.	.	H	α-helix	trans	-63.9	-33.5	179.8	0	0	0	0	0	113.2	W254 L365 V366 R371	W254-A369 HydrophobicContact CB-CB 4.44Å; W254-A369 HydrophobicContact CD2-CB 3.43Å; W254-A369 VanDerWaalsContact CD2-CB 3.43Å; W254-A369 HydrophobicContact CE3-CB 4.01Å; W254-A369 HydrophobicContact CG-CB 3.63Å; W254-A369 HydrophobicContact CH2-CB 4.43Å; W254-A369 HydrophobicContact CZ2-CB 3.93Å; W254-A369 HydrophobicContact CZ3-CB 4.47Å; L365-A369 WeakPolarHBondContact O-CB 3.41Å; L365-A369 PolarHBondContact O-N 2.89Å; V366-A369 PolarHBondContact O-N 3.4Å; A369-R371 PolarHBondContact O-N 3.29Å
370	S	88.9	Confident	89.2	Confident	72 Å²	72	34.2 Å²	34.2	50%	0.503	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	2.3	173.8	70.8	0	0	0	0	113.8	V366 E367 L368 N372	V366-S370 PolarHBondContact O-N 2.95Å; V366-S370 PolarHBondContact O-OG 2.94Å; E367-S370 WeakPolarHBondContact CA-OG 3.41Å; E367-S370 PolarHBondContact O-N 3.13Å; E367-S370 PolarHBondContact O-OG 3.14Å; E367-S370 PolarHBondContact OE2-OG 3.47Å; L368-S370 VanDerWaalsContact C-N 3.32Å; L368-S370 PolarHBondContact O-N 3.49Å; S370-N372 PolarHBondContact O-N 3.27Å
371	R	88.5	Confident	89.1	Confident	175 Å²	175	34.6 Å²	34.6	66%	0.66	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	18.6	-174	-56.8	179.7	175.5	-174.2	-2	114	E367 L368 A369 Y373	E367-R371 PolarHBondContact O-N 2.74Å; L368-R371 WeakPolarHBondContact O-CA 3.48Å; L368-R371 PolarHBondContact O-N 3.31Å; A369-R371 PolarHBondContact O-N 3.29Å; R371-Y373 PolarHBondContact O-N 3.43Å
372	N	91.7	Very high	88.8	Confident	70 Å²	70	39.6 Å²	39.6	37%	0.374	20%	0.2	S	C	.	.			trans	-91.8	79.4	174.3	-176.9	11.3	0	0	0	110.7	E367 S370 R374 G375 A376	E367-N372 CarbonylContact O-C 3.59Å; E367-N372 PolarHBondContact O-N 2.75Å; E367-N372 VanDerWaalsContact OE2-CB 3.27Å; E367-N372 WeakPolarHBondContact OE2-CB 3.28Å; E367-N372 PolarHBondContact OE2-ND2 3.09Å; S370-N372 PolarHBondContact O-N 3.27Å; N372-R374 PolarHBondContact O-N 3.45Å; N372-G375 PolarHBondContact O-N 3.27Å; N372-G375 PolarHBondContact OD1-N 2.87Å; N372-A376 WeakPolarHBondContact O-CB 3.29Å; N372-A376 PolarHBondContact O-N 3.47Å
373	Y	93	Very high	88.3	Confident	23 Å²	23	39.7 Å²	39.7	9%	0.09	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-27.7	-175.7	-50.3	-55.2	0	0	0	113.5	R371 A377 H473 A476 L477	R371-Y373 PolarHBondContact O-N 3.43Å; Y373-A377 WeakPolarHBondContact O-CB 3.38Å; Y373-A377 PolarHBondContact O-N 2.88Å; Y373-H473 HydrophobicContact CE1-CB 4.22Å; Y373-A476 WeakPolarHBondContact OH-CB 2.94Å; Y373-L477 HydrophobicContact CD1-CD2 3.6Å; Y373-L477 HydrophobicContact CD1-CG 4.25Å; Y373-L477 HydrophobicContact CD2-CD2 3.93Å; Y373-L477 HydrophobicContact CE1-CD1 4.4Å; Y373-L477 HydrophobicContact CE1-CD2 3.81Å; Y373-L477 HydrophobicContact CE1-CG 3.96Å; Y373-L477 HydrophobicContact CE2-CD2 4.12Å; Y373-L477 HydrophobicContact CE2-CG 4.5Å; Y373-L477 HydrophobicContact CG-CD2 3.66Å
374	R	92.6	Very high	87.4	Confident	101 Å²	101	42.6 Å²	42.6	38%	0.381	21%	0.214	S	C	.	.	H	α-helix	trans	-74	-44.6	-178.7	-173.4	173.8	175.3	89.1	0.8	110.5	N372 A376 A377 M378 T412 E417	N372-R374 PolarHBondContact O-N 3.45Å; R374-A376 VanDerWaalsContact C-N 3.34Å; R374-A377 PolarHBondContact O-N 3.3Å; R374-M378 WeakPolarHBondContact O-CG 3.43Å; R374-M378 PolarHBondContact O-N 3.06Å; R374-M378 VanDerWaalsContact O-N 3.15Å; R374-T412 HydrophobicContact CB-CG2 3.99Å; R374-E417 IonicContact CZ-OE1 3.52Å; R374-E417 IonicContact CZ-OE2 3.73Å; R374-E417 IonicContact NH1-OE1 3.85Å; R374-E417 IonicContact NH1-OE2 3.73Å; R374-E417 PolarHBondContact NH1-OE2 3.4Å; R374-E417 IonicContact NH2-OE1 2.75Å; R374-E417 PolarHBondContact NH2-OE1 3.02Å; R374-E417 IonicContact NH2-OE2 2.69Å
375	G	90.5	Very high	86.2	Confident	19 Å²	19	45.7 Å²	45.7	20%	0.196	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-43.7	172.7	0	0	0	0	0	111.8	N372 A377 M378 N379	N372-G375 PolarHBondContact O-N 3.27Å; N372-G375 PolarHBondContact OD1-N 2.87Å; G375-A377 PolarHBondContact O-N 3.09Å; G375-M378 PolarHBondContact O-N 3.28Å; G375-N379 PolarHBondContact O-N 3.46Å; G375-N379 VanDerWaalsContact O-N 3.07Å; G375-N379 PolarHBondContact O-ND2 3.34Å
376	A	90.5	Very high	84.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-49.6	176.5	0	0	0	0	0	111.9	E367 L368 N372 R374 M378 N379 F380	E367-A376 HydrophobicContact CB-CB 3.78Å; L368-A376 HydrophobicContact CB-CB 4.49Å; N372-A376 WeakPolarHBondContact O-CB 3.29Å; N372-A376 PolarHBondContact O-N 3.47Å; R374-A376 VanDerWaalsContact C-N 3.34Å; A376-M378 PolarHBondContact O-N 3.25Å; A376-N379 PolarHBondContact O-N 3.36Å; A376-F380 HydrophobicContact CB-CD2 4.33Å; A376-F380 HydrophobicContact CB-CE2 3.92Å; A376-F380 WeakPolarHBondContact O-CD2 3.45Å; A376-F380 VanDerWaalsContact O-CG 3.3Å; A376-F380 WeakPolarHBondContact O-CG 3.45Å; A376-F380 PolarHBondContact O-N 3.04Å
377	A	89	Confident	83.2	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-56.1	-51.8	177.6	0	0	0	0	0	111.2	Y373 R374 G375 N379 F380 L381 C408 F413	Y373-A377 WeakPolarHBondContact O-CB 3.38Å; Y373-A377 PolarHBondContact O-N 2.88Å; R374-A377 PolarHBondContact O-N 3.3Å; G375-A377 PolarHBondContact O-N 3.09Å; A377-N379 VanDerWaalsContact C-N 3.3Å; A377-N379 PolarHBondContact O-N 3.17Å; A377-F380 PolarHBondContact O-N 3.23Å; A377-F380 VanDerWaalsContact O-N 3.13Å; A377-L381 VanDerWaalsContact O-CG 3.25Å; A377-L381 WeakPolarHBondContact O-CG 3.29Å; A377-L381 PolarHBondContact O-N 3.17Å; A377-C408 HydrophobicContact CB-CB 3.89Å; A377-F413 HydrophobicContact CB-CE1 4.15Å; A377-F413 HydrophobicContact CB-CE2 3.94Å; A377-F413 HydrophobicContact CB-CZ 3.46Å; A377-F413 VanDerWaalsContact CB-CZ 3.46Å
378	M	88.8	Confident	81.5	Confident	63 Å²	63	50.5 Å²	50.5	31%	0.31	26%	0.255	S	S	.	.	H	α-helix	trans	-59.4	-37.8	-179.2	-68.6	-60.9	-173.6	0	0	113.3	R374 G375 A376 L381 F413 L421	R374-M378 WeakPolarHBondContact O-CG 3.43Å; R374-M378 PolarHBondContact O-N 3.06Å; R374-M378 VanDerWaalsContact O-N 3.15Å; G375-M378 PolarHBondContact O-N 3.28Å; A376-M378 PolarHBondContact O-N 3.25Å; M378-L381 HydrophobicContact SD-CD1 4.16Å; M378-F413 HydrophobicContact CE-CD1 4.44Å; M378-F413 HydrophobicContact CE-CE1 3.54Å; M378-F413 HydrophobicContact CE-CZ 4.08Å; M378-F413 HydrophobicContact SD-CE1 4.08Å; M378-F413 HydrophobicContact SD-CZ 4.03Å; M378-L421 HydrophobicContact CE-CD1 3.73Å; M378-L421 HydrophobicContact SD-CD1 4.12Å
379	N	86.6	Confident	79.7	Confident	39 Å²	39	59.1 Å²	59.1	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-69.7	-41.5	175.8	-71.8	-29.2	0	0	0	111.8	A363 G375 A376 A377 L381 Q382	A363-N379 HydrophobicContact CB-CB 4.39Å; G375-N379 PolarHBondContact O-N 3.46Å; G375-N379 VanDerWaalsContact O-N 3.07Å; G375-N379 PolarHBondContact O-ND2 3.34Å; A376-N379 PolarHBondContact O-N 3.36Å; A377-N379 VanDerWaalsContact C-N 3.3Å; A377-N379 PolarHBondContact O-N 3.17Å; N379-L381 VanDerWaalsContact C-N 3.33Å; N379-L381 PolarHBondContact O-N 2.94Å; N379-Q382 WeakPolarHBondContact O-CB 3.38Å; N379-Q382 PolarHBondContact O-N 3.32Å
380	F	85.4	Confident	77.5	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-31.2	177.6	-64.2	-47.8	0	0	0	113.2	G364 L365 A376 A377 Q382 V383 L401 F404 I405	G364-F380 VanDerWaalsContact CA-CE1 3.49Å; G364-F380 WeakPolarHBondContact O-CZ 3.37Å; L365-F380 HydrophobicContact CD2-CZ 4.46Å; A376-F380 HydrophobicContact CB-CD2 4.33Å; A376-F380 HydrophobicContact CB-CE2 3.92Å; A376-F380 WeakPolarHBondContact O-CD2 3.45Å; A376-F380 VanDerWaalsContact O-CG 3.3Å; A376-F380 WeakPolarHBondContact O-CG 3.45Å; A376-F380 PolarHBondContact O-N 3.04Å; A377-F380 PolarHBondContact O-N 3.23Å; A377-F380 VanDerWaalsContact O-N 3.13Å; F380-Q382 PolarHBondContact O-N 2.92Å; F380-V383 WeakPolarHBondContact O-CB 3.44Å; F380-V383 VanDerWaalsContact O-CG2 3.3Å; F380-V383 WeakPolarHBondContact O-CG2 3.3Å; F380-V383 PolarHBondContact O-N 3.27Å; F380-L401 HydrophobicContact CB-CD1 4.23Å; F380-L401 HydrophobicContact CD1-CD1 3.61Å; F380-L401 HydrophobicContact CE1-CD1 4.17Å; F380-L401 HydrophobicContact CG-CD1 4.08Å; F380-F404 HydrophobicContact CD2-CB 4.29Å; F380-F404 HydrophobicContact CE2-CB 3.92Å; F380-F404 HydrophobicContact CZ-CB 4.3Å; F380-F404 HydrophobicContact CZ-CD2 4.3Å; F380-I405 HydrophobicContact CB-CD1 4Å; F380-I405 HydrophobicContact CB-CG1 3.47Å; F380-I405 VanDerWaalsContact CB-CG1 3.47Å; F380-I405 HydrophobicContact CG-CG1 4.25Å
381	L	83.4	Confident	75.6	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.094	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.6	176.2	-64.2	175.5	0	0	0	113.2	A377 M378 N379 V383 I405 F413 L421 V422 L428	A377-L381 VanDerWaalsContact O-CG 3.25Å; A377-L381 WeakPolarHBondContact O-CG 3.29Å; A377-L381 PolarHBondContact O-N 3.17Å; M378-L381 HydrophobicContact SD-CD1 4.16Å; N379-L381 VanDerWaalsContact C-N 3.33Å; N379-L381 PolarHBondContact O-N 2.94Å; L381-V383 VanDerWaalsContact C-N 3.26Å; L381-V383 PolarHBondContact O-N 3.16Å; L381-I405 HydrophobicContact CD2-CG2 4.1Å; L381-F413 HydrophobicContact CD1-CE2 3.85Å; L381-F413 HydrophobicContact CD1-CZ 3.76Å; L381-L421 HydrophobicContact CD1-CB 3.9Å; L381-L421 HydrophobicContact CD1-CD1 4.29Å; L381-V422 HydrophobicContact CD2-CG2 4.07Å; L381-L428 HydrophobicContact CB-CD1 4.2Å; L381-L428 HydrophobicContact CD2-CD1 3.1Å; L381-L428 HydrophobicContact CD2-CG 4.44Å; L381-L428 HydrophobicContact CG-CD1 4.18Å
382	Q	80.8	Confident	73.5	Confident	126 Å²	126	52 Å²	52	59%	0.589	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-5.5	177.4	-63.3	177.1	18.1	0	0	113.2	A360 N379 F380 N384	A360-Q382 HydrophobicContact CB-CB 4.45Å; N379-Q382 WeakPolarHBondContact O-CB 3.38Å; N379-Q382 PolarHBondContact O-N 3.32Å; F380-Q382 PolarHBondContact O-N 2.92Å; Q382-N384 PolarHBondContact O-N 3.25Å
383	V	77	Confident	71.5	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.042	26%	0.26	C	S	.	.			trans	-75.7	121.8	-177.4	-179.3	0	0	0	0	110.3	T357 A360 I361 F380 L381 L401	T357-V383 HydrophobicContact CG2-CG1 4.47Å; A360-V383 HydrophobicContact CB-CG2 4.07Å; I361-V383 HydrophobicContact CD1-CG1 4.23Å; I361-V383 HydrophobicContact CD1-CG2 4.46Å; I361-V383 HydrophobicContact CG1-CG1 4.33Å; I361-V383 HydrophobicContact CG1-CG2 3.68Å; F380-V383 WeakPolarHBondContact O-CB 3.44Å; F380-V383 VanDerWaalsContact O-CG2 3.3Å; F380-V383 WeakPolarHBondContact O-CG2 3.3Å; F380-V383 PolarHBondContact O-N 3.27Å; L381-V383 VanDerWaalsContact C-N 3.26Å; L381-V383 PolarHBondContact O-N 3.16Å; V383-L401 HydrophobicContact CB-CD2 4.17Å; V383-L401 HydrophobicContact CG1-CD2 3.74Å; V383-L401 HydrophobicContact CG2-CD2 4.4Å
384	N	69.6	Low	69.9	Low	77 Å²	77	54.4 Å²	54.4	41%	0.412	28%	0.275	S	S	.	.			trans	-86.2	133.9	173.6	-67.1	-42.9	0	0	0	110.9	T357 Q382 D386	T357-N384 HydrophobicContact CG2-CB 3.94Å; Q382-N384 PolarHBondContact O-N 3.25Å; N384-D386 VanDerWaalsContact C-N 3.31Å; N384-D386 PolarHBondContact O-N 3.43Å
385	H	64	Low	68.8	Low	64 Å²	64	50.1 Å²	50.1	30%	0.296	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-59.9	-36.3	-177.2	179.8	-88.1	0	0	0	113.2	H387 C388 L430	H385-H387 PolarHBondContact O-N 2.89Å; H385-C388 PolarHBondContact O-N 3.36Å; H385-L430 HydrophobicContact CB-CB 4.47Å
386	D	59.6	Low	68.1	Low	129 Å²	129	49.5 Å²	49.5	69%	0.69	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-67.7	-7.9	-171.1	-59.6	-19.7	0	0	0	114.9	N384	N384-D386 VanDerWaalsContact C-N 3.31Å; N384-D386 PolarHBondContact O-N 3.43Å
387	H	56.9	Low	67.5	Low	30 Å²	30	50.2 Å²	50.2	14%	0.139	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-124.5	9.2	-171.1	-66	-28.1	0	0	0	114.1	A353 Q354 T357 H385 E389 S390	A353-H387 VanDerWaalsContact CB-CD2 3.43Å; A353-H387 WeakPolarHBondContact CB-CD2 3.44Å; A353-H387 VanDerWaalsContact CB-NE2 3.28Å; A353-H387 WeakPolarHBondContact CB-NE2 3.29Å; Q354-H387 HydrophobicContact CB-CB 4.34Å; Q354-H387 HydrophobicContact CG-CB 3.64Å; T357-H387 HydrophobicContact CG2-CB 4.12Å; H385-H387 PolarHBondContact O-N 2.89Å; H387-E389 PolarHBondContact O-N 3.25Å; H387-S390 PolarHBondContact O-OG 3.48Å
388	C	54.4	Low	67.1	Low	12 Å²	12	52.8 Å²	52.8	8%	0.081	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	4.2	176.5	-82.7	0	0	0	0	114.4	H385 S393 I398	H385-C388 PolarHBondContact O-N 3.36Å; C388-S393 WeakPolarHBondContact O-CB 3.29Å; C388-S393 PolarHBondContact O-OG 3.21Å; C388-I398 HydrophobicContact CB-CD1 4.15Å; C388-I398 HydrophobicContact CB-CG1 3.95Å
389	E	53.1	Low	66.7	Low	185 Å²	185	51.2 Å²	51.2	86%	0.864	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	10.5	175.8	-65.7	-171.3	169.7	0	0	114.2	H387	H387-E389 PolarHBondContact O-N 3.25Å
390	S	42.8	Very low	66.6	Low	6 Å²	6	49.7 Å²	49.7	4%	0.042	26%	0.257	C	S	.	.	S	Bend	trans	-84.8	154.7	-178.3	55.6	0	0	0	0	112.2	Q358 H387 T392 S393	Q358-S390 PolarHBondContact NE2-OG 2.75Å; H387-S390 PolarHBondContact O-OG 3.48Å; S390-T392 PolarHBondContact O-N 3.21Å; S390-S393 VanDerWaalsContact O-CB 3.3Å; S390-S393 WeakPolarHBondContact O-CB 3.39Å; S390-S393 PolarHBondContact O-N 3.19Å; S390-S393 PolarHBondContact O-OG 3.05Å
391	P	49	Very low	66.6	Low	96 Å²	96	49.8 Å²	49.8	62%	0.623	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-6.8	-162.1	18.9	-32.4	0	0	0	118.2	R394	P391-R394 WeakPolarHBondContact O-CB 3.45Å
392	T	45.3	Very low	66.8	Low	25 Å²	25	49 Å²	49	15%	0.153	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.3	168.6	73.5	0	0	0	0	113.9	Q358 S390 R394 I395	Q358-T392 WeakPolarHBondContact CB-OG1 3.47Å; Q358-T392 HydrophobicContact CG-CG2 4.36Å; Q358-T392 WeakPolarHBondContact CG-OG1 3.42Å; Q358-T392 PolarHBondContact NE2-OG1 3.19Å; Q358-T392 VanDerWaalsContact NE2-OG1 3.12Å; Q358-T392 VanDerWaalsContact OE1-CG2 3.3Å; Q358-T392 PolarHBondContact OE1-OG1 3.24Å; S390-T392 PolarHBondContact O-N 3.21Å; T392-R394 PolarHBondContact O-N 2.96Å; T392-R394 VanDerWaalsContact O-N 3.13Å; T392-I395 WeakPolarHBondContact O-CB 3.44Å; T392-I395 PolarHBondContact O-N 3.35Å
393	S	50.1	Low	67.1	Low	33 Å²	33	44.4 Å²	44.4	23%	0.231	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.3	166	76.4	0	0	0	0	112.5	C388 S390 I395 V396	C388-S393 WeakPolarHBondContact O-CB 3.29Å; C388-S393 PolarHBondContact O-OG 3.21Å; S390-S393 VanDerWaalsContact O-CB 3.3Å; S390-S393 WeakPolarHBondContact O-CB 3.39Å; S390-S393 PolarHBondContact O-N 3.19Å; S390-S393 PolarHBondContact O-OG 3.05Å; S393-I395 PolarHBondContact O-N 3.24Å; S393-I395 VanDerWaalsContact O-N 3.13Å; S393-V396 CarbonylContact O-C 3.6Å; S393-V396 PolarHBondContact O-N 3.21Å
394	R	59	Low	67.7	Low	111 Å²	111	44.1 Å²	44.1	42%	0.419	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-20	168.1	-119.4	172.8	-169.2	-178.6	-12	114	Q41 I44 P391 T392	Q41-R394 HydrophobicContact CB-CG 3.75Å; I44-R394 WeakPolarHBondContact CG2-O 3.08Å; P391-R394 WeakPolarHBondContact O-CB 3.45Å; T392-R394 PolarHBondContact O-N 2.96Å; T392-R394 VanDerWaalsContact O-N 3.13Å
395	I	69.2	Low	68.6	Low	11 Å²	11	40.5 Å²	40.5	6%	0.056	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-49.2	177.8	-58	177.8	0	0	0	110.8	I44 R48 K246 I249 T392 S393 F469	I44-I395 HydrophobicContact CD1-CB 3.84Å; I44-I395 HydrophobicContact CD1-CG1 4.26Å; I44-I395 HydrophobicContact CD1-CG2 3.32Å; I44-I395 WeakPolarHBondContact CD1-O 3.29Å; R48-I395 PolarHBondContact NH2-O 3.3Å; K246-I395 HydrophobicContact CB-CD1 4.19Å; K246-I395 HydrophobicContact CG-CD1 4.04Å; I249-I395 HydrophobicContact CD1-CD1 4.06Å; I249-I395 HydrophobicContact CG2-CG2 4.2Å; T392-I395 WeakPolarHBondContact O-CB 3.44Å; T392-I395 PolarHBondContact O-N 3.35Å; S393-I395 PolarHBondContact O-N 3.24Å; S393-I395 VanDerWaalsContact O-N 3.13Å; I395-F469 HydrophobicContact CG2-CE2 4.3Å; I395-F469 HydrophobicContact CG2-CZ 4.19Å
396	V	75.4	Confident	69.8	Low	7 Å²	7	37.7 Å²	37.7	4%	0.042	20%	0.197	C	C	.	.	S	Bend	trans	-124.9	119.2	-174.9	-178.4	0	0	0	0	108.5	I361 L365 S393 D400 L401 F404 F469	I361-V396 HydrophobicContact CG2-CB 4.35Å; I361-V396 HydrophobicContact CG2-CG2 4.21Å; L365-V396 HydrophobicContact CD1-CG2 3.92Å; L365-V396 HydrophobicContact CD2-CG2 4.48Å; S393-V396 CarbonylContact O-C 3.6Å; S393-V396 PolarHBondContact O-N 3.21Å; V396-D400 HydrophobicContact CG1-CB 3.69Å; V396-L401 HydrophobicContact CG1-CB 4.27Å; V396-F404 HydrophobicContact CG1-CD2 4.23Å; V396-F404 HydrophobicContact CG1-CE2 3.73Å; V396-F404 HydrophobicContact CG2-CE2 4.44Å; V396-F469 HydrophobicContact CG2-CE2 4.39Å
397	T	79	Confident	71.3	Confident	15 Å²	15	31.7 Å²	31.7	9%	0.092	17%	0.165	C	C	.	.			trans	-72.4	163	177.3	57.1	0	0	0	0	111	N39 Y40 S399 D400 L401	N39-T397 HydrophobicContact CB-CG2 3.59Å; Y40-T397 HydrophobicContact CD1-CG2 3.86Å; Y40-T397 HydrophobicContact CD2-CG2 4.47Å; Y40-T397 HydrophobicContact CE1-CG2 3.33Å; Y40-T397 HydrophobicContact CE2-CG2 4.03Å; Y40-T397 HydrophobicContact CG-CG2 4.4Å; Y40-T397 VanDerWaalsContact CZ-CG2 3.42Å; Y40-T397 PolarHBondContact OH-OG1 2.98Å; T397-S399 PolarHBondContact O-N 3.49Å; T397-D400 PolarHBondContact O-N 3.33Å; T397-D400 WeakPolarHBondContact OG1-CB 3.34Å; T397-D400 PolarHBondContact OG1-N 2.82Å; T397-D400 VanDerWaalsContact OG1-N 3.13Å; T397-D400 PolarHBondContact OG1-OD1 2.84Å; T397-D400 PolarHBondContact OG1-OD2 3.19Å; T397-L401 PolarHBondContact O-N 3.48Å
398	I	80.3	Confident	72.9	Confident	55 Å²	55	30.3 Å²	30.3	28%	0.282	16%	0.159	S	C	.	.	H	α-helix	trans	-56	-42.6	173	-63.7	178.4	0	0	0	110	C388 L401 A402 L431 A434	C388-I398 HydrophobicContact CB-CD1 4.15Å; C388-I398 HydrophobicContact CB-CG1 3.95Å; I398-L401 PolarHBondContact O-N 3.35Å; I398-A402 PolarHBondContact O-N 3.29Å; I398-L431 HydrophobicContact CB-CD1 4.28Å; I398-L431 HydrophobicContact CG2-CD1 3.3Å; I398-L431 HydrophobicContact CG2-CG 4.5Å; I398-A434 HydrophobicContact CG2-CB 4.39Å
399	S	80.8	Confident	74.6	Confident	29 Å²	29	29.7 Å²	29.7	20%	0.203	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-47.3	176.1	-54.4	0	0	0	0	112.5	T397 L401 A402 F403 E435	T397-S399 PolarHBondContact O-N 3.49Å; S399-L401 VanDerWaalsContact C-N 3.29Å; S399-L401 PolarHBondContact O-N 3.3Å; S399-A402 WeakPolarHBondContact O-CB 3.22Å; S399-A402 PolarHBondContact O-N 2.85Å; S399-A402 VanDerWaalsContact O-N 3.14Å; S399-F403 WeakPolarHBondContact O-CD2 3.31Å; S399-F403 PolarHBondContact O-N 3.17Å; S399-E435 VanDerWaalsContact CB-OE1 3.26Å; S399-E435 WeakPolarHBondContact CB-OE1 3.43Å; S399-E435 PolarHBondContact OG-OE1 2.88Å
400	D	83.8	Confident	76.4	Confident	8 Å²	8	21 Å²	21	4%	0.043	11%	0.114	C	C	.	.	H	α-helix	trans	-58.4	-43.6	176.9	-69.9	-13.8	0	0	0	111.2	Y40 R48 V396 T397 A402 F403 F404	Y40-D400 WeakPolarHBondContact CE1-OD2 3.42Å; Y40-D400 PolarHBondContact OH-OD1 3.43Å; Y40-D400 PolarHBondContact OH-OD2 3.18Å; R48-D400 IonicContact CZ-OD2 3.85Å; R48-D400 IonicContact NH1-OD2 2.95Å; R48-D400 IonicContact NH2-OD2 2.95Å; R48-D400 PolarHBondContact NH2-OD2 2.87Å; V396-D400 HydrophobicContact CG1-CB 3.69Å; T397-D400 PolarHBondContact O-N 3.33Å; T397-D400 WeakPolarHBondContact OG1-CB 3.34Å; T397-D400 PolarHBondContact OG1-N 2.82Å; T397-D400 VanDerWaalsContact OG1-N 3.13Å; T397-D400 PolarHBondContact OG1-OD1 2.84Å; T397-D400 PolarHBondContact OG1-OD2 3.19Å; D400-A402 VanDerWaalsContact C-N 3.31Å; D400-A402 PolarHBondContact O-N 3.43Å; D400-F403 PolarHBondContact O-N 3.43Å; D400-F403 VanDerWaalsContact O-N 3.17Å; D400-F404 HydrophobicContact CB-CE2 4.14Å; D400-F404 HydrophobicContact CB-CZ 4.14Å; D400-F404 WeakPolarHBondContact O-CD2 3.31Å; D400-F404 VanDerWaalsContact O-CG 3.25Å; D400-F404 WeakPolarHBondContact O-CG 3.37Å; D400-F404 PolarHBondContact O-N 3.17Å
401	L	85.3	Confident	78.7	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-61.8	-40.2	178.1	-177.1	65.2	0	0	0	111.5	I361 F380 V383 V396 T397 I398 S399 F404 I405 L431	I361-L401 HydrophobicContact CG1-CD1 4.45Å; F380-L401 HydrophobicContact CB-CD1 4.23Å; F380-L401 HydrophobicContact CD1-CD1 3.61Å; F380-L401 HydrophobicContact CE1-CD1 4.17Å; F380-L401 HydrophobicContact CG-CD1 4.08Å; V383-L401 HydrophobicContact CB-CD2 4.17Å; V383-L401 HydrophobicContact CG1-CD2 3.74Å; V383-L401 HydrophobicContact CG2-CD2 4.4Å; V396-L401 HydrophobicContact CG1-CB 4.27Å; T397-L401 PolarHBondContact O-N 3.48Å; I398-L401 PolarHBondContact O-N 3.35Å; S399-L401 VanDerWaalsContact C-N 3.29Å; S399-L401 PolarHBondContact O-N 3.3Å; L401-F404 PolarHBondContact O-N 3.46Å; L401-I405 HydrophobicContact CD1-CD1 4.09Å; L401-I405 HydrophobicContact CD1-CG1 4.35Å; L401-I405 HydrophobicContact CD2-CD1 4.43Å; L401-I405 HydrophobicContact CG-CD1 3.82Å; L401-I405 HydrophobicContact CG-CG1 4.47Å; L401-I405 WeakPolarHBondContact O-CB 3.4Å; L401-I405 VanDerWaalsContact O-CG1 3.28Å; L401-I405 WeakPolarHBondContact O-CG1 3.48Å; L401-I405 PolarHBondContact O-N 3.28Å; L401-L431 HydrophobicContact CD2-CD1 4.37Å; L401-L431 HydrophobicContact CD2-CD2 3.92Å; L401-L431 HydrophobicContact CG-CD2 3.99Å
402	A	87.1	Confident	80.6	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-43.4	174.2	0	0	0	0	0	111.6	I398 S399 D400 I405 T406 L431 L432 E435	I398-A402 PolarHBondContact O-N 3.29Å; S399-A402 WeakPolarHBondContact O-CB 3.22Å; S399-A402 PolarHBondContact O-N 2.85Å; S399-A402 VanDerWaalsContact O-N 3.14Å; D400-A402 VanDerWaalsContact C-N 3.31Å; D400-A402 PolarHBondContact O-N 3.43Å; A402-I405 PolarHBondContact O-N 3.13Å; A402-T406 WeakPolarHBondContact O-CB 3.16Å; A402-T406 VanDerWaalsContact O-CG2 3.24Å; A402-T406 WeakPolarHBondContact O-CG2 3.37Å; A402-T406 PolarHBondContact O-N 3.41Å; A402-T406 PolarHBondContact O-OG1 3.41Å; A402-L431 HydrophobicContact CB-CG 4.37Å; A402-L432 HydrophobicContact CB-CD2 4.43Å; A402-E435 HydrophobicContact CB-CB 4.3Å; A402-E435 HydrophobicContact CB-CG 4.35Å
403	F	88.1	Confident	82.7	Confident	31 Å²	31	16.8 Å²	16.8	14%	0.136	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-43.6	174.4	-72.1	-65.1	0	0	0	112.3	S399 D400 T406 L407 C438 L460 L464	S399-F403 WeakPolarHBondContact O-CD2 3.31Å; S399-F403 PolarHBondContact O-N 3.17Å; D400-F403 PolarHBondContact O-N 3.43Å; D400-F403 VanDerWaalsContact O-N 3.17Å; F403-T406 WeakPolarHBondContact CA-OG1 3.37Å; F403-T406 PolarHBondContact O-N 2.96Å; F403-T406 PolarHBondContact O-OG1 2.81Å; F403-L407 WeakPolarHBondContact O-CB 3.48Å; F403-L407 VanDerWaalsContact O-CG 3.25Å; F403-L407 WeakPolarHBondContact O-CG 3.15Å; F403-L407 PolarHBondContact O-N 3.06Å; F403-C438 WeakPolarHBondContact CD1-SG 3.12Å; F403-C438 VanDerWaalsContact CE1-SG 3.53Å; F403-L460 HydrophobicContact CE1-CD1 4.01Å; F403-L460 HydrophobicContact CE1-CD2 4.27Å; F403-L464 HydrophobicContact CB-CD2 4.12Å; F403-L464 HydrophobicContact CD1-CD2 3.87Å; F403-L464 HydrophobicContact CG-CD2 3.98Å
404	F	88.8	Confident	84.3	Confident	1 Å²	1	19.8 Å²	19.8	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-61.9	-46.6	177.1	-60	-23.4	0	0	0	111.8	L365 F380 V396 D400 L401 T406 C408 D467 F469 L470	L365-F404 HydrophobicContact CD2-CD2 4.44Å; L365-F404 HydrophobicContact CD2-CE2 4Å; F380-F404 HydrophobicContact CD2-CB 4.29Å; F380-F404 HydrophobicContact CE2-CB 3.92Å; F380-F404 HydrophobicContact CZ-CB 4.3Å; F380-F404 HydrophobicContact CZ-CD2 4.3Å; V396-F404 HydrophobicContact CG1-CD2 4.23Å; V396-F404 HydrophobicContact CG1-CE2 3.73Å; V396-F404 HydrophobicContact CG2-CE2 4.44Å; D400-F404 HydrophobicContact CB-CE2 4.14Å; D400-F404 HydrophobicContact CB-CZ 4.14Å; D400-F404 WeakPolarHBondContact O-CD2 3.31Å; D400-F404 VanDerWaalsContact O-CG 3.25Å; D400-F404 WeakPolarHBondContact O-CG 3.37Å; D400-F404 PolarHBondContact O-N 3.17Å; L401-F404 PolarHBondContact O-N 3.46Å; F404-T406 PolarHBondContact O-N 2.89Å; F404-C408 VanDerWaalsContact O-CB 3.26Å; F404-C408 WeakPolarHBondContact O-CB 3.49Å; F404-C408 PolarHBondContact O-N 3.5Å; F404-C408 PolarHBondContact O-SG 3Å; F404-D467 WeakPolarHBondContact CE1-OD2 3.39Å; F404-D467 WeakPolarHBondContact CZ-OD2 3.28Å; F404-F469 HydrophobicContact CZ-CB 4.17Å; F404-F469 HydrophobicContact CZ-CD2 4.32Å; F404-L470 HydrophobicContact CD1-CD1 4.37Å; F404-L470 HydrophobicContact CE1-CB 4.14Å; F404-L470 HydrophobicContact CE1-CD2 4.49Å
405	I	88.4	Confident	85.6	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-62	-47	178.6	-70.1	167.4	0	0	0	110.4	F380 L381 L401 A402 S409 L428 L431	F380-I405 HydrophobicContact CB-CD1 4Å; F380-I405 HydrophobicContact CB-CG1 3.47Å; F380-I405 VanDerWaalsContact CB-CG1 3.47Å; F380-I405 HydrophobicContact CG-CG1 4.25Å; L381-I405 HydrophobicContact CD2-CG2 4.1Å; L401-I405 HydrophobicContact CD1-CD1 4.09Å; L401-I405 HydrophobicContact CD1-CG1 4.35Å; L401-I405 HydrophobicContact CD2-CD1 4.43Å; L401-I405 HydrophobicContact CG-CD1 3.82Å; L401-I405 HydrophobicContact CG-CG1 4.47Å; L401-I405 WeakPolarHBondContact O-CB 3.4Å; L401-I405 VanDerWaalsContact O-CG1 3.28Å; L401-I405 WeakPolarHBondContact O-CG1 3.48Å; L401-I405 PolarHBondContact O-N 3.28Å; A402-I405 PolarHBondContact O-N 3.13Å; I405-S409 WeakPolarHBondContact O-CB 3.38Å; I405-S409 PolarHBondContact O-N 2.91Å; I405-S409 PolarHBondContact O-OG 3.08Å; I405-L428 HydrophobicContact CD1-CD2 3.76Å; I405-L431 HydrophobicContact CD1-CD2 3.53Å
406	T	88.6	Confident	86.4	Confident	4 Å²	4	24.3 Å²	24.3	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-65.1	-44.3	-178.2	53	0	0	0	0	112.7	A402 F403 F404 S409 L410 L432 C438 L442	A402-T406 WeakPolarHBondContact O-CB 3.16Å; A402-T406 VanDerWaalsContact O-CG2 3.24Å; A402-T406 WeakPolarHBondContact O-CG2 3.37Å; A402-T406 PolarHBondContact O-N 3.41Å; A402-T406 PolarHBondContact O-OG1 3.41Å; F403-T406 WeakPolarHBondContact CA-OG1 3.37Å; F403-T406 PolarHBondContact O-N 2.96Å; F403-T406 PolarHBondContact O-OG1 2.81Å; F404-T406 PolarHBondContact O-N 2.89Å; T406-S409 WeakPolarHBondContact CA-OG 3.47Å; T406-S409 PolarHBondContact O-OG 3.01Å; T406-L410 VanDerWaalsContact O-CB 3.3Å; T406-L410 WeakPolarHBondContact O-CB 3.46Å; T406-L410 VanDerWaalsContact O-CD1 3.32Å; T406-L410 WeakPolarHBondContact O-CD1 3.3Å; T406-L410 WeakPolarHBondContact O-CG 3.34Å; T406-L410 PolarHBondContact O-N 3.44Å; T406-L432 HydrophobicContact CG2-CD2 3.6Å; T406-C438 HydrophobicContact CG2-CB 3.43Å; T406-C438 VanDerWaalsContact CG2-CB 3.43Å; T406-C438 PolarHBondContact OG1-SG 2.85Å; T406-C438 VanDerWaalsContact OG1-SG 3.38Å; T406-L442 HydrophobicContact CG2-CD1 3.54Å; T406-L442 HydrophobicContact CG2-CG 3.92Å
407	L	91.5	Very high	86.9	Confident	4 Å²	4	26 Å²	26	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-45	179.2	-65.3	169.2	0	0	0	112.4	F403 L410 A411 L457 L464 L470 L477 F478 I481	F403-L407 WeakPolarHBondContact O-CB 3.48Å; F403-L407 VanDerWaalsContact O-CG 3.25Å; F403-L407 WeakPolarHBondContact O-CG 3.15Å; F403-L407 PolarHBondContact O-N 3.06Å; L407-L410 PolarHBondContact O-N 2.87Å; L407-A411 WeakPolarHBondContact O-CB 3.29Å; L407-A411 PolarHBondContact O-N 2.99Å; L407-L457 HydrophobicContact CD2-CD1 3.64Å; L407-L464 HydrophobicContact CD1-CD1 3.76Å; L407-L464 HydrophobicContact CD1-CD2 4.14Å; L407-L464 HydrophobicContact CD1-CG 4.5Å; L407-L464 HydrophobicContact CD2-CD1 4.15Å; L407-L470 HydrophobicContact CD1-CD1 3.96Å; L407-L470 HydrophobicContact CD1-CD2 3.43Å; L407-L470 VanDerWaalsContact CD1-CD2 3.43Å; L407-L470 HydrophobicContact CD1-CG 4.26Å; L407-L477 HydrophobicContact CB-CD1 4.22Å; L407-F478 HydrophobicContact CD2-CE2 4.42Å; L407-I481 HydrophobicContact CD2-CD1 4.07Å
408	C	91.1	Very high	87.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.8	-37.6	179.2	-66.1	0	0	0	0	112.1	A377 F404 T412	A377-C408 HydrophobicContact CB-CB 3.89Å; F404-C408 VanDerWaalsContact O-CB 3.26Å; F404-C408 WeakPolarHBondContact O-CB 3.49Å; F404-C408 PolarHBondContact O-N 3.5Å; F404-C408 PolarHBondContact O-SG 3Å; C408-T412 PolarHBondContact O-N 3.38Å; C408-T412 PolarHBondContact O-OG1 3.31Å
409	S	89.6	Confident	87.4	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.1	-43.9	175.7	57.9	0	0	0	0	112.3	I405 T406 A411 T412 F413	I405-S409 WeakPolarHBondContact O-CB 3.38Å; I405-S409 PolarHBondContact O-N 2.91Å; I405-S409 PolarHBondContact O-OG 3.08Å; T406-S409 WeakPolarHBondContact CA-OG 3.47Å; T406-S409 PolarHBondContact O-OG 3.01Å; S409-A411 VanDerWaalsContact C-N 3.32Å; S409-A411 PolarHBondContact O-N 3.26Å; S409-T412 PolarHBondContact O-N 2.87Å; S409-F413 WeakPolarHBondContact O-CB 3.44Å; S409-F413 PolarHBondContact O-N 3.09Å
410	L	91.1	Very high	87.7	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64	-36.5	177.1	-73	166.9	0	0	0	112.7	T406 L407 L418 I441 L442 F445 I481	T406-L410 VanDerWaalsContact O-CB 3.3Å; T406-L410 WeakPolarHBondContact O-CB 3.46Å; T406-L410 VanDerWaalsContact O-CD1 3.32Å; T406-L410 WeakPolarHBondContact O-CD1 3.3Å; T406-L410 WeakPolarHBondContact O-CG 3.34Å; T406-L410 PolarHBondContact O-N 3.44Å; L407-L410 PolarHBondContact O-N 2.87Å; L410-L418 HydrophobicContact CD2-CD1 4.19Å; L410-I441 HydrophobicContact CD1-CG2 3.48Å; L410-I441 VanDerWaalsContact CD1-CG2 3.48Å; L410-L442 HydrophobicContact CD2-CD2 4Å; L410-L442 HydrophobicContact CG-CD2 3.95Å; L410-F445 HydrophobicContact CD2-CB 3.56Å; L410-F445 HydrophobicContact CD2-CD1 3.7Å; L410-F445 HydrophobicContact CD2-CD2 3.78Å; L410-F445 HydrophobicContact CD2-CE1 4.29Å; L410-F445 HydrophobicContact CD2-CE2 4.37Å; L410-F445 HydrophobicContact CD2-CG 3.4Å; L410-I481 HydrophobicContact CB-CD1 4Å; L410-I481 HydrophobicContact CB-CG1 3.86Å; L410-I481 HydrophobicContact CB-CG2 4.46Å
411	A	91.1	Very high	87.6	Confident	11 Å²	11	29.7 Å²	29.7	9%	0.091	16%	0.158	C	C	.	.	H	α-helix	trans	-71.8	-30.4	179.5	0	0	0	0	0	113	L407 S409 L477 E480 I481	L407-A411 WeakPolarHBondContact O-CB 3.29Å; L407-A411 PolarHBondContact O-N 2.99Å; S409-A411 VanDerWaalsContact C-N 3.32Å; S409-A411 PolarHBondContact O-N 3.26Å; A411-L477 HydrophobicContact CB-CD2 3.79Å; A411-E480 HydrophobicContact CB-CB 4.12Å; A411-I481 HydrophobicContact CB-CG1 4.04Å
412	T	89.5	Confident	87.3	Confident	29 Å²	29	29.7 Å²	29.7	18%	0.178	16%	0.157	C	C	.	.	H	α-helix	trans	-120.2	-30.8	-166.4	63.1	0	0	0	0	116.2	R374 C408 S409	R374-T412 HydrophobicContact CB-CG2 3.99Å; C408-T412 PolarHBondContact O-N 3.38Å; C408-T412 PolarHBondContact O-OG1 3.31Å; S409-T412 PolarHBondContact O-N 2.87Å
413	F	88	Confident	87	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.			trans	-81.8	148	-173.6	-65	-30.9	0	0	0	112.8	A377 M378 L381 S409 E417 L418 L421 V422	A377-F413 HydrophobicContact CB-CE1 4.15Å; A377-F413 HydrophobicContact CB-CE2 3.94Å; A377-F413 HydrophobicContact CB-CZ 3.46Å; A377-F413 VanDerWaalsContact CB-CZ 3.46Å; M378-F413 HydrophobicContact CE-CD1 4.44Å; M378-F413 HydrophobicContact CE-CE1 3.54Å; M378-F413 HydrophobicContact CE-CZ 4.08Å; M378-F413 HydrophobicContact SD-CE1 4.08Å; M378-F413 HydrophobicContact SD-CZ 4.03Å; L381-F413 HydrophobicContact CD1-CE2 3.85Å; L381-F413 HydrophobicContact CD1-CZ 3.76Å; S409-F413 WeakPolarHBondContact O-CB 3.44Å; S409-F413 PolarHBondContact O-N 3.09Å; F413-E417 HydrophobicContact CB-CB 4Å; F413-E417 HydrophobicContact CD1-CB 4.44Å; F413-E417 HydrophobicContact CG-CB 4.32Å; F413-L418 HydrophobicContact CB-CB 4.3Å; F413-L421 HydrophobicContact CE1-CD1 4.23Å; F413-L421 HydrophobicContact CE2-CD1 4.45Å; F413-L421 HydrophobicContact CZ-CD1 4.19Å; F413-V422 HydrophobicContact CD2-CG2 4.19Å; F413-V422 HydrophobicContact CE2-CG2 4.21Å
414	E	85.4	Confident	86.5	Confident	96 Å²	96	33.4 Å²	33.4	45%	0.449	19%	0.19	S	C	.	.			trans	-76.2	163.8	168.7	-42.7	-134.6	118.2	0	0	110.8	T416 E417 L418 R484	E414-T416 PolarHBondContact O-N 2.96Å; E414-T416 VanDerWaalsContact O-N 3.16Å; E414-E417 HydrophobicContact CB-CB 4.46Å; E414-E417 HydrophobicContact CB-CG 4.27Å; E414-E417 HydrophobicContact CG-CG 4.32Å; E414-E417 PolarHBondContact N-OE2 3.18Å; E414-E417 PolarHBondContact O-N 2.75Å; E414-L418 WeakPolarHBondContact O-CB 3.39Å; E414-L418 PolarHBondContact O-N 3.1Å; E414-R484 IonicContact OE1-CZ 3.99Å; E414-R484 IonicContact OE1-NH1 3.14Å; E414-R484 IonicContact OE1-NH2 3.34Å; E414-R484 PolarHBondContact OE1-NH2 3.3Å
415	R	84.9	Confident	86.1	Confident	122 Å²	122	35.9 Å²	35.9	46%	0.46	20%	0.203	S	C	.	.	H	α-helix	trans	-56.5	-34.2	178.6	-170.3	176.5	-174.7	-174.1	3.7	112.8	A419 H446	R415-A419 PolarHBondContact O-N 3.5Å; R415-H446 PolarHBondContact NE-O 3.08Å; R415-H446 VanDerWaalsContact NE-O 3.14Å; R415-H446 PolarHBondContact NH2-O 2.91Å
416	T	85.6	Confident	85.4	Confident	94 Å²	94	39 Å²	39	58%	0.577	23%	0.229	S	C	*	.	H	α-helix	trans	-73	-48.6	176.4	48.5	0	0	0	0	111.7	E414 L418 A419 T420	E414-T416 PolarHBondContact O-N 2.96Å; E414-T416 VanDerWaalsContact O-N 3.16Å; T416-L418 PolarHBondContact O-N 3.1Å; T416-A419 PolarHBondContact O-N 2.97Å; T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.41Å; T416-T420 PolarHBondContact O-OG1 3.28Å
417	E	87.2	Confident	84.5	Confident	44 Å²	44	40.5 Å²	40.5	21%	0.206	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-41.7	178	-67	-173.7	147.2	0	0	111.8	R374 F413 E414 A419 T420 L421	R374-E417 IonicContact CZ-OE1 3.52Å; R374-E417 IonicContact CZ-OE2 3.73Å; R374-E417 IonicContact NH1-OE1 3.85Å; R374-E417 IonicContact NH1-OE2 3.73Å; R374-E417 PolarHBondContact NH1-OE2 3.4Å; R374-E417 IonicContact NH2-OE1 2.75Å; R374-E417 PolarHBondContact NH2-OE1 3.02Å; R374-E417 IonicContact NH2-OE2 2.69Å; F413-E417 HydrophobicContact CB-CB 4Å; F413-E417 HydrophobicContact CD1-CB 4.44Å; F413-E417 HydrophobicContact CG-CB 4.32Å; E414-E417 HydrophobicContact CB-CB 4.46Å; E414-E417 HydrophobicContact CB-CG 4.27Å; E414-E417 HydrophobicContact CG-CG 4.32Å; E414-E417 PolarHBondContact N-OE2 3.18Å; E414-E417 PolarHBondContact O-N 2.75Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.01Å; E417-T420 PolarHBondContact O-N 3.11Å; E417-T420 PolarHBondContact O-OG1 3.39Å; E417-L421 HydrophobicContact CB-CD1 4.18Å; E417-L421 WeakPolarHBondContact O-CB 3.44Å; E417-L421 WeakPolarHBondContact O-CG 3.25Å; E417-L421 PolarHBondContact O-N 3.46Å
418	L	86	Confident	83.6	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	24%	0.239	C	C	.	.	I	π-helix	trans	-62.4	-41.4	178	-171	155.3	0	0	0	111.2	L410 F413 E414 T416 V422 L423 L442 F445 H446	L410-L418 HydrophobicContact CD2-CD1 4.19Å; F413-L418 HydrophobicContact CB-CB 4.3Å; E414-L418 WeakPolarHBondContact O-CB 3.39Å; E414-L418 PolarHBondContact O-N 3.1Å; T416-L418 PolarHBondContact O-N 3.1Å; L418-V422 WeakPolarHBondContact O-CB 3.49Å; L418-V422 PolarHBondContact O-N 2.69Å; L418-V422 VanDerWaalsContact O-N 3.1Å; L418-L423 HydrophobicContact CD2-CD1 4.1Å; L418-L423 HydrophobicContact CD2-CG 4.27Å; L418-L423 PolarHBondContact O-N 2.9Å; L418-L442 HydrophobicContact CD1-CD2 4.01Å; L418-L442 HydrophobicContact CD2-CD2 4.46Å; L418-L442 HydrophobicContact CG-CD2 4.36Å; L418-F445 HydrophobicContact CD1-CD1 3.96Å; L418-F445 HydrophobicContact CD1-CE1 4.41Å; L418-H446 HydrophobicContact CD2-CB 4.36Å
419	A	84.5	Confident	82.9	Confident	31 Å²	31	46.6 Å²	46.6	26%	0.256	26%	0.263	S	S	.	.	I	π-helix	trans	-67.5	-42	178.1	0	0	0	0	0	112.4	R415 T416 E417 L423 G424	R415-A419 PolarHBondContact O-N 3.5Å; T416-A419 PolarHBondContact O-N 2.97Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.01Å; A419-L423 WeakPolarHBondContact O-CB 3.3Å; A419-G424 PolarHBondContact O-N 3.35Å
420	T	86	Confident	82.3	Confident	96 Å²	96	50.5 Å²	50.5	59%	0.589	28%	0.283	S	S	*	.	I	π-helix	trans	-77.1	-45.8	-177.8	54.9	0	0	0	0	112.3	T416 E417	T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.41Å; T416-T420 PolarHBondContact O-OG1 3.28Å; E417-T420 PolarHBondContact O-N 3.11Å; E417-T420 PolarHBondContact O-OG1 3.39Å
421	L	81.3	Confident	81.4	Confident	56 Å²	56	50.7 Å²	50.7	29%	0.293	28%	0.284	S	S	.	.	I	π-helix	trans	-84.8	-38.1	-171.2	-62.4	175.6	0	0	0	113.5	M378 L381 F413 E417 N425	M378-L421 HydrophobicContact CE-CD1 3.73Å; M378-L421 HydrophobicContact SD-CD1 4.12Å; L381-L421 HydrophobicContact CD1-CB 3.9Å; L381-L421 HydrophobicContact CD1-CD1 4.29Å; F413-L421 HydrophobicContact CE1-CD1 4.23Å; F413-L421 HydrophobicContact CE2-CD1 4.45Å; F413-L421 HydrophobicContact CZ-CD1 4.19Å; E417-L421 HydrophobicContact CB-CD1 4.18Å; E417-L421 WeakPolarHBondContact O-CB 3.44Å; E417-L421 WeakPolarHBondContact O-CG 3.25Å; E417-L421 PolarHBondContact O-N 3.46Å; L421-N425 VanDerWaalsContact O-CB 3.23Å; L421-N425 WeakPolarHBondContact O-CB 3.27Å
422	V	80	Confident	80.9	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	28%	0.282	C	S	.	.	I	π-helix	trans	-99.1	-54.1	-174.7	-173.7	0	0	0	0	110.8	L381 F413 L418 L432 L442	L381-V422 HydrophobicContact CD2-CG2 4.07Å; F413-V422 HydrophobicContact CD2-CG2 4.19Å; F413-V422 HydrophobicContact CE2-CG2 4.21Å; L418-V422 WeakPolarHBondContact O-CB 3.49Å; L418-V422 PolarHBondContact O-N 2.69Å; L418-V422 VanDerWaalsContact O-N 3.1Å; V422-L432 HydrophobicContact CG1-CD1 3.89Å; V422-L442 HydrophobicContact CG1-CD1 3.71Å
423	L	79.3	Confident	80.2	Confident	60 Å²	60	54.5 Å²	54.5	31%	0.314	30%	0.298	S	S	.	.	I	π-helix	trans	-75.7	-29.5	-177.5	-63.1	174.5	0	0	0	112.6	L418 A419 R429 H446	L418-L423 HydrophobicContact CD2-CD1 4.1Å; L418-L423 HydrophobicContact CD2-CG 4.27Å; L418-L423 PolarHBondContact O-N 2.9Å; A419-L423 WeakPolarHBondContact O-CB 3.3Å; L423-R429 PolarHBondContact O-NH2 3.38Å; L423-H446 HydrophobicContact CD1-CB 4.42Å
424	G	79.2	Confident	79.6	Confident	50 Å²	50	57.1 Å²	57.1	52%	0.515	32%	0.32	S	S	.	.	S	Bend	trans	-78.2	-22	177.8	0	0	0	0	0	114.7	A419	A419-G424 PolarHBondContact O-N 3.35Å
425	N	78.9	Confident	79.3	Confident	52 Å²	52	54.9 Å²	54.9	28%	0.278	31%	0.31	S	S	.	.			trans	-85.6	118.9	-175.6	-169.2	-11.1	0	0	0	111.5	L421 S427 L428 R429	L421-N425 VanDerWaalsContact O-CB 3.23Å; L421-N425 WeakPolarHBondContact O-CB 3.27Å; N425-S427 PolarHBondContact O-N 3.11Å; N425-S427 PolarHBondContact OD1-N 3.02Å; N425-L428 HydrophobicContact CB-CB 4.38Å; N425-L428 HydrophobicContact CB-CD1 4.04Å; N425-L428 HydrophobicContact CB-CG 4.34Å; N425-L428 PolarHBondContact O-N 3.36Å; N425-R429 PolarHBondContact O-N 3.19Å
426	A	74.7	Confident	79.3	Confident	66 Å²	66	52.9 Å²	52.9	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-38.7	-177.8	0	0	0	0	0	112.7	L428 R429 L430	A426-L428 VanDerWaalsContact C-N 3.29Å; A426-L428 PolarHBondContact O-N 3.37Å; A426-R429 WeakPolarHBondContact O-CB 3.43Å; A426-R429 PolarHBondContact O-N 2.92Å; A426-L430 PolarHBondContact O-N 3.38Å
427	S	70.1	Confident	79.3	Confident	36 Å²	36	50 Å²	50	25%	0.252	30%	0.299	S	S	.	.	H	α-helix	trans	-63.3	-37.1	-178.3	-56	0	0	0	0	112.1	N425 L431	N425-S427 PolarHBondContact O-N 3.11Å; N425-S427 PolarHBondContact OD1-N 3.02Å; S427-L431 PolarHBondContact O-N 3.48Å
428	L	72.9	Confident	79.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-79.5	-27.7	178.6	-66.2	175.1	0	0	0	112.7	L381 I405 N425 A426 L430 L431 L432	L381-L428 HydrophobicContact CB-CD1 4.2Å; L381-L428 HydrophobicContact CD2-CD1 3.1Å; L381-L428 HydrophobicContact CD2-CG 4.44Å; L381-L428 HydrophobicContact CG-CD1 4.18Å; I405-L428 HydrophobicContact CD1-CD2 3.76Å; N425-L428 HydrophobicContact CB-CB 4.38Å; N425-L428 HydrophobicContact CB-CD1 4.04Å; N425-L428 HydrophobicContact CB-CG 4.34Å; N425-L428 PolarHBondContact O-N 3.36Å; A426-L428 VanDerWaalsContact C-N 3.29Å; A426-L428 PolarHBondContact O-N 3.37Å; L428-L430 VanDerWaalsContact C-N 3.29Å; L428-L430 PolarHBondContact O-N 2.92Å; L428-L431 HydrophobicContact CD2-CD2 4.17Å; L428-L431 WeakPolarHBondContact O-CB 3.27Å; L428-L431 PolarHBondContact O-N 3.47Å; L428-L432 WeakPolarHBondContact O-CB 3.48Å; L428-L432 VanDerWaalsContact O-CG 3.23Å; L428-L432 WeakPolarHBondContact O-CG 3.37Å; L428-L432 PolarHBondContact O-N 3.32Å
429	R	76.2	Confident	79.3	Confident	132 Å²	132	54 Å²	54	50%	0.498	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-42.8	173.8	-167.6	178.6	-62.6	158	3	110.8	L423 N425 A426 L431 L432 E433	L423-R429 PolarHBondContact O-NH2 3.38Å; N425-R429 PolarHBondContact O-N 3.19Å; A426-R429 WeakPolarHBondContact O-CB 3.43Å; A426-R429 PolarHBondContact O-N 2.92Å; R429-L431 VanDerWaalsContact C-N 3.34Å; R429-L431 PolarHBondContact O-N 3.2Å; R429-L432 CarbonylContact O-C 3.6Å; R429-L432 PolarHBondContact O-N 3.04Å; R429-E433 WeakPolarHBondContact O-CB 3.36Å; R429-E433 VanDerWaalsContact O-CG 3.24Å; R429-E433 WeakPolarHBondContact O-CG 3.35Å; R429-E433 PolarHBondContact O-N 2.9Å
430	L	75.7	Confident	79.5	Confident	81 Å²	81	55.1 Å²	55.1	42%	0.424	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-41.3	174.2	-65.3	172.4	0	0	0	111.9	H385 A426 L428 E433	H385-L430 HydrophobicContact CB-CB 4.47Å; A426-L430 PolarHBondContact O-N 3.38Å; L428-L430 VanDerWaalsContact C-N 3.29Å; L428-L430 PolarHBondContact O-N 2.92Å; L430-E433 PolarHBondContact O-N 3.27Å
431	L	73.5	Confident	79.8	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-43.2	175.6	-173.3	74.4	0	0	0	112.4	I398 L401 A402 I405 S427 L428 R429 E433 A434	I398-L431 HydrophobicContact CB-CD1 4.28Å; I398-L431 HydrophobicContact CG2-CD1 3.3Å; I398-L431 HydrophobicContact CG2-CG 4.5Å; L401-L431 HydrophobicContact CD2-CD1 4.37Å; L401-L431 HydrophobicContact CD2-CD2 3.92Å; L401-L431 HydrophobicContact CG-CD2 3.99Å; A402-L431 HydrophobicContact CB-CG 4.37Å; I405-L431 HydrophobicContact CD1-CD2 3.53Å; S427-L431 PolarHBondContact O-N 3.48Å; L428-L431 HydrophobicContact CD2-CD2 4.17Å; L428-L431 WeakPolarHBondContact O-CB 3.27Å; L428-L431 PolarHBondContact O-N 3.47Å; R429-L431 VanDerWaalsContact C-N 3.34Å; R429-L431 PolarHBondContact O-N 3.2Å; L431-E433 VanDerWaalsContact C-N 3.31Å; L431-A434 WeakPolarHBondContact O-CB 3.46Å; L431-A434 PolarHBondContact O-N 3.32Å
432	L	78.9	Confident	80.1	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-76.3	-18.2	179.8	-68.2	171.2	0	0	0	112.9	A402 T406 V422 L428 R429 A434 E435 C438 L442	A402-L432 HydrophobicContact CB-CD2 4.43Å; T406-L432 HydrophobicContact CG2-CD2 3.6Å; V422-L432 HydrophobicContact CG1-CD1 3.89Å; L428-L432 WeakPolarHBondContact O-CB 3.48Å; L428-L432 VanDerWaalsContact O-CG 3.23Å; L428-L432 WeakPolarHBondContact O-CG 3.37Å; L428-L432 PolarHBondContact O-N 3.32Å; R429-L432 CarbonylContact O-C 3.6Å; R429-L432 PolarHBondContact O-N 3.04Å; L432-A434 VanDerWaalsContact C-N 3.28Å; L432-E435 CarbonylContact O-C 3.37Å; L432-E435 PolarHBondContact O-N 3.32Å; L432-E435 VanDerWaalsContact O-O 3.14Å; L432-C438 HydrophobicContact CD2-CB 3.95Å; L432-L442 HydrophobicContact CD1-CD1 3.74Å; L432-L442 HydrophobicContact CD2-CD1 4.14Å
433	E	75.9	Confident	80.5	Confident	110 Å²	110	51.6 Å²	51.6	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-68.9	-28	171.3	-83.6	170.4	-164.4	0	0	111.9	R429 L430 L431 E435	R429-E433 WeakPolarHBondContact O-CB 3.36Å; R429-E433 VanDerWaalsContact O-CG 3.24Å; R429-E433 WeakPolarHBondContact O-CG 3.35Å; R429-E433 PolarHBondContact O-N 2.9Å; L430-E433 PolarHBondContact O-N 3.27Å; L431-E433 VanDerWaalsContact C-N 3.31Å; E433-E435 VanDerWaalsContact C-N 3.34Å
434	A	76.2	Confident	81	Confident	55 Å²	55	49.3 Å²	49.3	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-67.2	-34.1	173.8	0	0	0	0	0	112.6	I398 L431 L432	I398-A434 HydrophobicContact CG2-CB 4.39Å; L431-A434 WeakPolarHBondContact O-CB 3.46Å; L431-A434 PolarHBondContact O-N 3.32Å; L432-A434 VanDerWaalsContact C-N 3.28Å
435	E	78.7	Confident	81.5	Confident	50 Å²	50	47 Å²	47	23%	0.234	25%	0.254	C	S	.	.			trans	-122.2	87.2	-178.2	-69.3	-62.1	158.7	0	0	111.4	S399 A402 L432 E433 A437 C438	S399-E435 VanDerWaalsContact CB-OE1 3.26Å; S399-E435 WeakPolarHBondContact CB-OE1 3.43Å; S399-E435 PolarHBondContact OG-OE1 2.88Å; A402-E435 HydrophobicContact CB-CB 4.3Å; A402-E435 HydrophobicContact CB-CG 4.35Å; L432-E435 CarbonylContact O-C 3.37Å; L432-E435 PolarHBondContact O-N 3.32Å; L432-E435 VanDerWaalsContact O-O 3.14Å; E433-E435 VanDerWaalsContact C-N 3.34Å; E435-A437 PolarHBondContact O-N 3.03Å; E435-A437 VanDerWaalsContact O-N 3.15Å; E435-C438 HydrophobicContact CB-CB 4.33Å; E435-C438 WeakPolarHBondContact O-CB 3.5Å; E435-C438 PolarHBondContact O-N 3.35Å; E435-C438 VanDerWaalsContact O-N 3.14Å
436	P	84	Confident	82	Confident	79 Å²	79	47.3 Å²	47.3	51%	0.513	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-26.7	-174.7	24.5	-34.2	0	0	0	113.2	C438 R439 D440	P436-C438 VanDerWaalsContact C-N 3.31Å; P436-C438 PolarHBondContact O-N 3.49Å; P436-R439 PolarHBondContact O-N 3.34Å; P436-D440 PolarHBondContact O-N 3.39Å
437	A	86.3	Confident	82.7	Confident	35 Å²	35	49.9 Å²	49.9	29%	0.289	25%	0.254	S	S	.	.	H	α-helix	trans	-59.4	-42.8	176.9	0	0	0	0	0	111.9	E435 D440 I441	E435-A437 PolarHBondContact O-N 3.03Å; E435-A437 VanDerWaalsContact O-N 3.15Å; A437-D440 PolarHBondContact O-N 2.91Å; A437-I441 WeakPolarHBondContact O-CD1 3.29Å; A437-I441 WeakPolarHBondContact O-CG1 3.29Å; A437-I441 PolarHBondContact O-N 2.9Å; A437-I441 VanDerWaalsContact O-N 3.15Å
438	C	87.1	Confident	83.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-44.4	177.2	-81.4	0	0	0	0	112	F403 T406 L432 E435 P436 I441 L442	F403-C438 WeakPolarHBondContact CD1-SG 3.12Å; F403-C438 VanDerWaalsContact CE1-SG 3.53Å; T406-C438 HydrophobicContact CG2-CB 3.43Å; T406-C438 VanDerWaalsContact CG2-CB 3.43Å; T406-C438 PolarHBondContact OG1-SG 2.85Å; T406-C438 VanDerWaalsContact OG1-SG 3.38Å; L432-C438 HydrophobicContact CD2-CB 3.95Å; E435-C438 HydrophobicContact CB-CB 4.33Å; E435-C438 WeakPolarHBondContact O-CB 3.5Å; E435-C438 PolarHBondContact O-N 3.35Å; E435-C438 VanDerWaalsContact O-N 3.14Å; P436-C438 VanDerWaalsContact C-N 3.31Å; P436-C438 PolarHBondContact O-N 3.49Å; C438-I441 PolarHBondContact O-N 2.96Å; C438-L442 WeakPolarHBondContact O-CG 3.4Å; C438-L442 PolarHBondContact O-N 2.96Å; C438-L442 VanDerWaalsContact O-N 3.1Å
439	R	86.3	Confident	84.3	Confident	128 Å²	128	53.2 Å²	53.2	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-61	-47.3	176.9	178.8	-172.8	163	-172.1	-3.8	111.6	P436 I441 L442 Q443	P436-R439 PolarHBondContact O-N 3.34Å; R439-I441 VanDerWaalsContact C-N 3.3Å; R439-I441 PolarHBondContact O-N 3.06Å; R439-L442 PolarHBondContact O-N 2.79Å; R439-Q443 WeakPolarHBondContact O-CB 3.45Å; R439-Q443 PolarHBondContact O-N 3.39Å
440	D	88.8	Confident	84.9	Confident	55 Å²	55	47.4 Å²	47.4	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-60.4	-41.1	-179.9	-78	-4.9	0	0	0	111.4	P436 A437 Q443 S444 R456	P436-D440 PolarHBondContact O-N 3.39Å; A437-D440 PolarHBondContact O-N 2.91Å; D440-Q443 PolarHBondContact O-N 3.05Å; D440-S444 VanDerWaalsContact O-CB 3.29Å; D440-S444 WeakPolarHBondContact O-CB 3.41Å; D440-S444 PolarHBondContact O-N 3.01Å; D440-S444 PolarHBondContact O-OG 3.32Å; D440-R456 IonicContact OD2-CZ 3.81Å; D440-R456 IonicContact OD2-NH1 3.18Å; D440-R456 PolarHBondContact OD2-NH1 3.21Å; D440-R456 IonicContact OD2-NH2 2.68Å
441	I	91.1	Very high	85.5	Confident	5 Å²	5	45 Å²	45	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-48	177.8	-67.1	166	0	0	0	110.4	L410 A437 C438 R439 Q443 S444 F445 R456 L460	L410-I441 HydrophobicContact CD1-CG2 3.48Å; L410-I441 VanDerWaalsContact CD1-CG2 3.48Å; A437-I441 WeakPolarHBondContact O-CD1 3.29Å; A437-I441 WeakPolarHBondContact O-CG1 3.29Å; A437-I441 PolarHBondContact O-N 2.9Å; A437-I441 VanDerWaalsContact O-N 3.15Å; C438-I441 PolarHBondContact O-N 2.96Å; R439-I441 VanDerWaalsContact C-N 3.3Å; R439-I441 PolarHBondContact O-N 3.06Å; I441-Q443 VanDerWaalsContact C-N 3.33Å; I441-Q443 PolarHBondContact O-N 3.02Å; I441-S444 PolarHBondContact O-N 3.37Å; I441-F445 WeakPolarHBondContact O-CB 3.46Å; I441-F445 PolarHBondContact O-N 3.15Å; I441-R456 HydrophobicContact CD1-CB 4.21Å; I441-R456 HydrophobicContact CG1-CB 3.87Å; I441-L460 HydrophobicContact CD1-CD1 3.49Å; I441-L460 VanDerWaalsContact CD1-CD1 3.49Å
442	L	89	Confident	86.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-42.8	177.3	-74.6	171	0	0	0	112.1	T406 L410 L418 V422 L432 C438 R439 F445 H446	T406-L442 HydrophobicContact CG2-CD1 3.54Å; T406-L442 HydrophobicContact CG2-CG 3.92Å; L410-L442 HydrophobicContact CD2-CD2 4Å; L410-L442 HydrophobicContact CG-CD2 3.95Å; L418-L442 HydrophobicContact CD1-CD2 4.01Å; L418-L442 HydrophobicContact CD2-CD2 4.46Å; L418-L442 HydrophobicContact CG-CD2 4.36Å; V422-L442 HydrophobicContact CG1-CD1 3.71Å; L432-L442 HydrophobicContact CD1-CD1 3.74Å; L432-L442 HydrophobicContact CD2-CD1 4.14Å; C438-L442 WeakPolarHBondContact O-CG 3.4Å; C438-L442 PolarHBondContact O-N 2.96Å; C438-L442 VanDerWaalsContact O-N 3.1Å; R439-L442 PolarHBondContact O-N 2.79Å; L442-F445 PolarHBondContact O-N 2.96Å; L442-H446 WeakPolarHBondContact O-CB 3.44Å; L442-H446 PolarHBondContact O-N 3.16Å
443	Q	88	Confident	86.8	Confident	72 Å²	72	46.7 Å²	46.7	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-67.1	-42.6	178.4	-175.4	171.8	-14.9	0	0	111.6	R439 D440 I441 F445 H446 Q447	R439-Q443 WeakPolarHBondContact O-CB 3.45Å; R439-Q443 PolarHBondContact O-N 3.39Å; D440-Q443 PolarHBondContact O-N 3.05Å; I441-Q443 VanDerWaalsContact C-N 3.33Å; I441-Q443 PolarHBondContact O-N 3.02Å; Q443-F445 VanDerWaalsContact C-N 3.34Å; Q443-F445 PolarHBondContact O-N 3.35Å; Q443-H446 PolarHBondContact O-N 3.25Å; Q443-Q447 HydrophobicContact CG-CG 4.37Å; Q443-Q447 WeakPolarHBondContact O-CB 3.37Å; Q443-Q447 VanDerWaalsContact O-CG 3.29Å; Q443-Q447 WeakPolarHBondContact O-CG 3.49Å; Q443-Q447 PolarHBondContact O-N 3.06Å
444	S	90.1	Very high	87.4	Confident	13 Å²	13	42.3 Å²	42.3	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-43.9	176.7	-54.7	0	0	0	0	111	D440 I441 H446 Q447 A448 D449	D440-S444 VanDerWaalsContact O-CB 3.29Å; D440-S444 WeakPolarHBondContact O-CB 3.41Å; D440-S444 PolarHBondContact O-N 3.01Å; D440-S444 PolarHBondContact O-OG 3.32Å; I441-S444 PolarHBondContact O-N 3.37Å; S444-H446 PolarHBondContact O-N 2.97Å; S444-Q447 PolarHBondContact O-N 3.42Å; S444-A448 PolarHBondContact O-N 3.35Å; S444-D449 PolarHBondContact O-N 3.4Å
445	F	89.9	Confident	88	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176	-167.1	-94	0	0	0	111.9	L410 L418 I441 L442 Q443 A448 Y450 R484 A485 Q488	L410-F445 HydrophobicContact CD2-CB 3.56Å; L410-F445 HydrophobicContact CD2-CD1 3.7Å; L410-F445 HydrophobicContact CD2-CD2 3.78Å; L410-F445 HydrophobicContact CD2-CE1 4.29Å; L410-F445 HydrophobicContact CD2-CE2 4.37Å; L410-F445 HydrophobicContact CD2-CG 3.4Å; L418-F445 HydrophobicContact CD1-CD1 3.96Å; L418-F445 HydrophobicContact CD1-CE1 4.41Å; I441-F445 WeakPolarHBondContact O-CB 3.46Å; I441-F445 PolarHBondContact O-N 3.15Å; L442-F445 PolarHBondContact O-N 2.96Å; Q443-F445 VanDerWaalsContact C-N 3.34Å; Q443-F445 PolarHBondContact O-N 3.35Å; F445-A448 PolarHBondContact O-N 2.99Å; F445-Y450 HydrophobicContact CD2-CD1 4.17Å; F445-Y450 HydrophobicContact CD2-CE1 4.15Å; F445-Y450 HydrophobicContact CE2-CD1 4.32Å; F445-Y450 HydrophobicContact CE2-CE1 4.12Å; F445-R484 HydrophobicContact CZ-CG 4.27Å; F445-A485 HydrophobicContact CE2-CB 4.12Å; F445-Q488 VanDerWaalsContact CE1-OE1 3.22Å
446	H	89	Confident	88.5	Confident	57 Å²	57	44 Å²	44	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-68.2	-34.6	177.2	-173.3	71.5	0	0	0	113.4	R415 L418 L423 L442 Q443 S444 A448	R415-H446 PolarHBondContact NE-O 3.08Å; R415-H446 VanDerWaalsContact NE-O 3.14Å; R415-H446 PolarHBondContact NH2-O 2.91Å; L418-H446 HydrophobicContact CD2-CB 4.36Å; L423-H446 HydrophobicContact CD1-CB 4.42Å; L442-H446 WeakPolarHBondContact O-CB 3.44Å; L442-H446 PolarHBondContact O-N 3.16Å; Q443-H446 PolarHBondContact O-N 3.25Å; S444-H446 PolarHBondContact O-N 2.97Å; H446-A448 PolarHBondContact O-N 3.48Å
447	Q	89.5	Confident	88.8	Confident	121 Å²	121	40.3 Å²	40.3	57%	0.565	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-1.8	175.7	-70.3	178.3	-7.2	0	0	113.4	Q443 S444 D449	Q443-Q447 HydrophobicContact CG-CG 4.37Å; Q443-Q447 WeakPolarHBondContact O-CB 3.37Å; Q443-Q447 VanDerWaalsContact O-CG 3.29Å; Q443-Q447 WeakPolarHBondContact O-CG 3.49Å; Q443-Q447 PolarHBondContact O-N 3.06Å; S444-Q447 PolarHBondContact O-N 3.42Å; Q447-D449 VanDerWaalsContact C-N 3.27Å; Q447-D449 PolarHBondContact O-N 3.15Å
448	A	86.3	Confident	88.8	Confident	41 Å²	41	43 Å²	43	34%	0.339	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	24.5	-176.2	0	0	0	0	0	114.7	S444 F445 H446 Y450	S444-A448 PolarHBondContact O-N 3.35Å; F445-A448 PolarHBondContact O-N 2.99Å; H446-A448 PolarHBondContact O-N 3.48Å; A448-Y450 HydrophobicContact CB-CE2 4.02Å; A448-Y450 WeakPolarHBondContact O-CD2 3.17Å; A448-Y450 PolarHBondContact O-N 2.88Å
449	D	89.9	Confident	88.8	Confident	65 Å²	65	51.2 Å²	51.2	35%	0.348	26%	0.262	S	S	.	.			trans	-91	85.1	168	-176.8	5.4	0	0	0	110	S444 Q447 A451 S452 C453	S444-D449 PolarHBondContact O-N 3.4Å; Q447-D449 VanDerWaalsContact C-N 3.27Å; Q447-D449 PolarHBondContact O-N 3.15Å; D449-A451 PolarHBondContact OD1-N 2.85Å; D449-S452 PolarHBondContact OD1-N 3.48Å; D449-S452 PolarHBondContact OD1-OG 3.4Å; D449-S452 WeakPolarHBondContact OD2-CB 3.31Å; D449-S452 PolarHBondContact OD2-OG 3.22Å; D449-C453 WeakPolarHBondContact O-CB 3.43Å; D449-C453 PolarHBondContact O-N 3.42Å
450	Y	89.4	Confident	88.8	Confident	11 Å²	11	46.5 Å²	46.5	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-76.3	-26.9	-177.3	-53.9	-67	0	0	0	113	F445 A448 C453 L454 A485 Q488 Y489 F505	F445-Y450 HydrophobicContact CD2-CD1 4.17Å; F445-Y450 HydrophobicContact CD2-CE1 4.15Å; F445-Y450 HydrophobicContact CE2-CD1 4.32Å; F445-Y450 HydrophobicContact CE2-CE1 4.12Å; A448-Y450 HydrophobicContact CB-CE2 4.02Å; A448-Y450 WeakPolarHBondContact O-CD2 3.17Å; A448-Y450 PolarHBondContact O-N 2.88Å; Y450-C453 PolarHBondContact O-N 2.95Å; Y450-L454 WeakPolarHBondContact O-CB 3.45Å; Y450-L454 WeakPolarHBondContact O-CG 3.5Å; Y450-L454 PolarHBondContact O-N 3.43Å; Y450-A485 HydrophobicContact CD1-CB 3.69Å; Y450-A485 HydrophobicContact CE1-CB 4.11Å; Y450-A485 HydrophobicContact CG-CB 4.23Å; Y450-Q488 VanDerWaalsContact OH-CB 3.27Å; Y450-Q488 WeakPolarHBondContact OH-CB 3.42Å; Y450-Y489 AromaticContact CD2-CD2 3.85Å; Y450-Y489 HydrophobicContact CD2-CD2 3.85Å; Y450-Y489 HydrophobicContact CD2-CG 4.45Å; Y450-Y489 AromaticContact CE2-CD2 3.77Å; Y450-Y489 HydrophobicContact CE2-CD2 3.77Å; Y450-Y489 HydrophobicContact CE2-CG 4.24Å; Y450-F505 HydrophobicContact CD2-CZ 4.13Å; Y450-F505 HydrophobicContact CG-CE1 4.28Å; Y450-F505 HydrophobicContact CG-CZ 4.22Å
451	A	87.5	Confident	88.6	Confident	31 Å²	31	49 Å²	49	26%	0.256	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-53.3	179	0	0	0	0	0	110.5	D449 C453 L454 G455 A504	D449-A451 PolarHBondContact OD1-N 2.85Å; A451-C453 VanDerWaalsContact C-N 3.31Å; A451-C453 PolarHBondContact O-N 3.02Å; A451-L454 PolarHBondContact O-N 3.34Å; A451-G455 PolarHBondContact O-N 3.25Å; A451-A504 WeakPolarHBondContact CB-O 3.42Å
452	S	89.4	Confident	88.1	Confident	49 Å²	49	50.8 Å²	50.8	34%	0.343	26%	0.261	S	S	.	.	H	α-helix	trans	-62.6	-39.4	177	-62.2	0	0	0	0	112	D449 R456	D449-S452 PolarHBondContact OD1-N 3.48Å; D449-S452 PolarHBondContact OD1-OG 3.4Å; D449-S452 WeakPolarHBondContact OD2-CB 3.31Å; D449-S452 PolarHBondContact OD2-OG 3.22Å; S452-R456 WeakPolarHBondContact O-CB 3.35Å; S452-R456 VanDerWaalsContact O-CG 3.29Å; S452-R456 WeakPolarHBondContact O-CG 3.22Å; S452-R456 PolarHBondContact O-N 2.93Å
453	C	89.8	Confident	87.9	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-53.4	177.9	-178.3	0	0	0	0	111.5	D449 Y450 A451 R456 L457	D449-C453 WeakPolarHBondContact O-CB 3.43Å; D449-C453 PolarHBondContact O-N 3.42Å; Y450-C453 PolarHBondContact O-N 2.95Å; A451-C453 VanDerWaalsContact C-N 3.31Å; A451-C453 PolarHBondContact O-N 3.02Å; C453-R456 PolarHBondContact O-N 3.49Å; C453-L457 VanDerWaalsContact O-CB 3.29Å; C453-L457 WeakPolarHBondContact O-CB 3.5Å; C453-L457 PolarHBondContact O-N 3.25Å
454	L	89.3	Confident	87.7	Confident	18 Å²	18	50.2 Å²	50.2	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-36.1	-179.5	-69	173.1	0	0	0	111.8	Y450 A451 L457 N458 F505	Y450-L454 WeakPolarHBondContact O-CB 3.45Å; Y450-L454 WeakPolarHBondContact O-CG 3.5Å; Y450-L454 PolarHBondContact O-N 3.43Å; A451-L454 PolarHBondContact O-N 3.34Å; L454-L457 HydrophobicContact CD2-CD2 4.43Å; L454-L457 PolarHBondContact O-N 3.34Å; L454-N458 WeakPolarHBondContact O-CB 3.3Å; L454-N458 VanDerWaalsContact O-CG 3.29Å; L454-N458 PolarHBondContact O-N 3.07Å; L454-N458 PolarHBondContact O-ND2 3.11Å; L454-F505 HydrophobicContact CD1-CD1 3.61Å; L454-F505 HydrophobicContact CD1-CE1 4.02Å
455	G	89.1	Confident	87.4	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-43.4	174	0	0	0	0	0	112.7	A451 K459	A451-G455 PolarHBondContact O-N 3.25Å; G455-K459 PolarHBondContact O-N 2.99Å
456	R	88.9	Confident	87.1	Confident	107 Å²	107	51.9 Å²	51.9	40%	0.404	27%	0.267	S	S	.	.	H	α-helix	trans	-67.7	-41.1	174	-72.2	174.8	-173	-111.7	9.9	111.8	D440 I441 S452 C453 N458 K459 L460	D440-R456 IonicContact OD2-CZ 3.81Å; D440-R456 IonicContact OD2-NH1 3.18Å; D440-R456 PolarHBondContact OD2-NH1 3.21Å; D440-R456 IonicContact OD2-NH2 2.68Å; I441-R456 HydrophobicContact CD1-CB 4.21Å; I441-R456 HydrophobicContact CG1-CB 3.87Å; S452-R456 WeakPolarHBondContact O-CB 3.35Å; S452-R456 VanDerWaalsContact O-CG 3.29Å; S452-R456 WeakPolarHBondContact O-CG 3.22Å; S452-R456 PolarHBondContact O-N 2.93Å; C453-R456 PolarHBondContact O-N 3.49Å; R456-N458 PolarHBondContact O-N 3.42Å; R456-K459 PolarHBondContact O-N 3.39Å; R456-L460 PolarHBondContact O-N 3.03Å
457	L	89.7	Confident	86.9	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-38.6	179.2	-170.9	65.1	0	0	0	112.1	L407 C453 L454 K459 L460 R461 F478 I481	L407-L457 HydrophobicContact CD2-CD1 3.64Å; C453-L457 VanDerWaalsContact O-CB 3.29Å; C453-L457 WeakPolarHBondContact O-CB 3.5Å; C453-L457 PolarHBondContact O-N 3.25Å; L454-L457 HydrophobicContact CD2-CD2 4.43Å; L454-L457 PolarHBondContact O-N 3.34Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 3.46Å; L457-L460 PolarHBondContact O-N 2.92Å; L457-R461 PolarHBondContact O-N 3.32Å; L457-F478 HydrophobicContact CB-CE1 4.47Å; L457-F478 HydrophobicContact CD1-CE1 4.21Å; L457-F478 HydrophobicContact CD1-CE2 4.04Å; L457-F478 HydrophobicContact CD1-CZ 3.71Å; L457-F478 HydrophobicContact CD2-CD1 4.03Å; L457-F478 HydrophobicContact CD2-CE1 3.96Å; L457-F478 HydrophobicContact CD2-CE2 4.49Å; L457-F478 HydrophobicContact CD2-CG 4.36Å; L457-F478 HydrophobicContact CD2-CZ 4.2Å; L457-F478 HydrophobicContact CG-CD1 4.1Å; L457-F478 HydrophobicContact CG-CE1 3.5Å; L457-F478 VanDerWaalsContact CG-CE1 3.5Å; L457-F478 HydrophobicContact CG-CE2 4.16Å; L457-F478 HydrophobicContact CG-CZ 3.53Å; L457-F478 WeakPolarHBondContact O-CZ 3.37Å; L457-I481 HydrophobicContact CD2-CD1 4.02Å; L457-I481 HydrophobicContact CD2-CG2 4.06Å
458	N	87.2	Confident	86.6	Confident	91 Å²	91	44.3 Å²	44.3	49%	0.487	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-35.7	175.7	-78.9	-26.5	0	0	0	112.6	L454 R456 L460 R461	L454-N458 WeakPolarHBondContact O-CB 3.3Å; L454-N458 VanDerWaalsContact O-CG 3.29Å; L454-N458 PolarHBondContact O-N 3.07Å; L454-N458 PolarHBondContact O-ND2 3.11Å; R456-N458 PolarHBondContact O-N 3.42Å; N458-L460 VanDerWaalsContact C-N 3.33Å; N458-R461 VanDerWaalsContact O-CB 3.26Å; N458-R461 WeakPolarHBondContact O-CB 3.42Å; N458-R461 PolarHBondContact O-N 2.89Å
459	K	86.5	Confident	86.5	Confident	172 Å²	172	43.1 Å²	43.1	75%	0.748	22%	0.22	S	C	*	.	H	α-helix	trans	-64.8	-39	173.3	-67.5	176.9	-177.7	-177.6	0	111.9	G455 R456 L457 R461	G455-K459 PolarHBondContact O-N 2.99Å; R456-K459 PolarHBondContact O-N 3.39Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 3.46Å; K459-R461 VanDerWaalsContact C-N 3.33Å
460	L	85.4	Confident	86.3	Confident	30 Å²	30	40.1 Å²	40.1	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-75.4	-21.5	178.1	-66.3	175.6	0	0	0	112.9	F403 I441 R456 L457 N458 N462 V463 L464	F403-L460 HydrophobicContact CE1-CD1 4.01Å; F403-L460 HydrophobicContact CE1-CD2 4.27Å; I441-L460 HydrophobicContact CD1-CD1 3.49Å; I441-L460 VanDerWaalsContact CD1-CD1 3.49Å; R456-L460 PolarHBondContact O-N 3.03Å; L457-L460 PolarHBondContact O-N 2.92Å; N458-L460 VanDerWaalsContact C-N 3.33Å; L460-N462 PolarHBondContact O-N 3.35Å; L460-N462 VanDerWaalsContact O-N 3.13Å; L460-V463 WeakPolarHBondContact O-CA 3.29Å; L460-V463 WeakPolarHBondContact O-CB 3.42Å; L460-V463 PolarHBondContact O-N 2.9Å; L460-L464 HydrophobicContact CB-CD1 4.04Å; L460-L464 HydrophobicContact CB-CG 4.28Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.22Å; L460-L464 PolarHBondContact O-N 2.97Å
461	R	85.1	Confident	86	Confident	108 Å²	108	40.2 Å²	40.2	41%	0.408	21%	0.206	S	C	.	.	H	α-helix	trans	-48.8	-45.1	-176.7	-171.2	179.1	176.3	-170.7	-3.8	113	L457 N458 K459 R465 V474 F478	L457-R461 PolarHBondContact O-N 3.32Å; N458-R461 VanDerWaalsContact O-CB 3.26Å; N458-R461 WeakPolarHBondContact O-CB 3.42Å; N458-R461 PolarHBondContact O-N 2.89Å; K459-R461 VanDerWaalsContact C-N 3.33Å; R461-R465 WeakPolarHBondContact O-CB 3.24Å; R461-R465 PolarHBondContact O-N 3.18Å; R461-V474 HydrophobicContact CG-CG1 4.18Å; R461-F478 HydrophobicContact CB-CE1 3.67Å; R461-F478 HydrophobicContact CB-CZ 3.76Å; R461-F478 HydrophobicContact CG-CD1 4.41Å; R461-F478 HydrophobicContact CG-CE1 3.76Å; R461-F478 HydrophobicContact CG-CZ 3.95Å
462	N	80.5	Confident	85.9	Confident	42 Å²	42	41.8 Å²	41.8	23%	0.225	21%	0.21	C	C	.	.	H	α-helix	trans	-70.2	-36.2	-177.9	-66.7	-6.1	0	0	0	111.7	V25 V29 L460 L466	V25-N462 HydrophobicContact CG1-CB 4.23Å; V29-N462 HydrophobicContact CG2-CB 3.81Å; L460-N462 PolarHBondContact O-N 3.35Å; L460-N462 VanDerWaalsContact O-N 3.13Å; N462-L466 WeakPolarHBondContact O-CG 3.3Å
463	V	84.7	Confident	85.8	Confident	54 Å²	54	40.1 Å²	40.1	33%	0.327	20%	0.196	S	C	.	.	H	α-helix	trans	-67	-47.9	175.5	-178.1	0	0	0	0	110.8	V29 I31 L460 R465 L466	V29-V463 HydrophobicContact CG1-CG2 4.47Å; I31-V463 HydrophobicContact CD1-CB 4.22Å; I31-V463 HydrophobicContact CD1-CG1 3.85Å; I31-V463 HydrophobicContact CD1-CG2 4.02Å; I31-V463 HydrophobicContact CG1-CG1 4.49Å; I31-V463 HydrophobicContact CG1-CG2 4.24Å; L460-V463 WeakPolarHBondContact O-CA 3.29Å; L460-V463 WeakPolarHBondContact O-CB 3.42Å; L460-V463 PolarHBondContact O-N 2.9Å; V463-R465 PolarHBondContact O-N 3.36Å; V463-L466 WeakPolarHBondContact O-CB 3.27Å; V463-L466 PolarHBondContact O-N 2.98Å
464	L	83.9	Confident	85.7	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-26.7	-177.2	-64.6	173.5	0	0	0	112.8	F403 L407 L460 L466 D467 L470 V474 F478	F403-L464 HydrophobicContact CB-CD2 4.12Å; F403-L464 HydrophobicContact CD1-CD2 3.87Å; F403-L464 HydrophobicContact CG-CD2 3.98Å; L407-L464 HydrophobicContact CD1-CD1 3.76Å; L407-L464 HydrophobicContact CD1-CD2 4.14Å; L407-L464 HydrophobicContact CD1-CG 4.5Å; L407-L464 HydrophobicContact CD2-CD1 4.15Å; L460-L464 HydrophobicContact CB-CD1 4.04Å; L460-L464 HydrophobicContact CB-CG 4.28Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.22Å; L460-L464 PolarHBondContact O-N 2.97Å; L464-L466 VanDerWaalsContact C-N 3.29Å; L464-D467 PolarHBondContact O-N 3.34Å; L464-L470 HydrophobicContact CB-CD2 3.64Å; L464-L470 HydrophobicContact CD1-CD2 4.32Å; L464-L470 HydrophobicContact CD2-CD2 3.46Å; L464-L470 VanDerWaalsContact CD2-CD2 3.46Å; L464-L470 HydrophobicContact CG-CD2 3.95Å; L464-V474 HydrophobicContact CB-CG2 4.06Å; L464-F478 HydrophobicContact CD1-CE2 4Å; L464-F478 HydrophobicContact CD1-CZ 4.1Å
465	R	85	Confident	85.7	Confident	41 Å²	41	43.6 Å²	43.6	16%	0.155	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.7	176.8	-171.9	164.7	175.6	140	36.5	113.5	E23 V25 R461 V463 D467	E23-R465 PolarHBondContact O-NE 2.87Å; E23-R465 PolarHBondContact O-NH2 3.44Å; E23-R465 VanDerWaalsContact O-NH2 3.14Å; E23-R465 IonicContact OE2-CZ 3.63Å; E23-R465 IonicContact OE2-NH1 3.52Å; E23-R465 PolarHBondContact OE2-NH1 3.2Å; E23-R465 IonicContact OE2-NH2 3.86Å; E23-R465 PolarHBondContact OE2-NH2 3.34Å; V25-R465 HydrophobicContact CG2-CB 4.33Å; V25-R465 HydrophobicContact CG2-CG 3.85Å; R461-R465 WeakPolarHBondContact O-CB 3.24Å; R461-R465 PolarHBondContact O-N 3.18Å; V463-R465 PolarHBondContact O-N 3.36Å; R465-D467 VanDerWaalsContact C-N 3.33Å
466	L	83.1	Confident	85.8	Confident	9 Å²	9	43 Å²	43	5%	0.047	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8	176.8	-61.7	174.2	0	0	0	113	V29 I31 F51 I52 R55 C56 N462 V463 L464	V29-L466 HydrophobicContact CB-CD1 4.27Å; V29-L466 HydrophobicContact CG1-CD1 3.85Å; V29-L466 HydrophobicContact CG2-CD1 4.27Å; I31-L466 HydrophobicContact CD1-CD1 3.63Å; F51-L466 WeakPolarHBondContact CD1-O 3.38Å; I52-L466 HydrophobicContact CG1-CB 4.36Å; R55-L466 HydrophobicContact CB-CD2 4.13Å; C56-L466 HydrophobicContact CB-CD2 3.74Å; N462-L466 WeakPolarHBondContact O-CG 3.3Å; V463-L466 WeakPolarHBondContact O-CB 3.27Å; V463-L466 PolarHBondContact O-N 2.98Å; L464-L466 VanDerWaalsContact C-N 3.29Å
467	D	84.7	Confident	85.9	Confident	11 Å²	11	38 Å²	38	6%	0.059	20%	0.195	C	C	.	.	S	Bend	trans	-82.7	142.1	176.7	-174.9	23.1	0	0	0	111.7	R48 F51 F404 L464 R465 F469 L470 S471	R48-D467 IonicContact CZ-OD1 3.18Å; R48-D467 IonicContact NH1-OD1 2.76Å; R48-D467 PolarHBondContact NH1-OD1 3.25Å; R48-D467 IonicContact NH2-OD1 2.8Å; F51-D467 WeakPolarHBondContact CE1-O 3.49Å; F404-D467 WeakPolarHBondContact CE1-OD2 3.39Å; F404-D467 WeakPolarHBondContact CZ-OD2 3.28Å; L464-D467 PolarHBondContact O-N 3.34Å; R465-D467 VanDerWaalsContact C-N 3.33Å; D467-F469 PolarHBondContact O-N 3.45Å; D467-L470 HydrophobicContact CB-CB 4.12Å; D467-S471 VanDerWaalsContact O-CB 3.29Å; D467-S471 WeakPolarHBondContact O-CB 3.22Å; D467-S471 PolarHBondContact O-N 3.06Å; D467-S471 VanDerWaalsContact O-N 3.13Å
468	I	83.5	Confident	86	Confident	8 Å²	8	39.1 Å²	39.1	4%	0.041	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-37.1	-172.9	-171	174.8	0	0	0	113.2	Q47 R48 F51	Q47-I468 HydrophobicContact CG-CD1 3.71Å; R48-I468 HydrophobicContact CG-CG2 4.42Å; F51-I468 HydrophobicContact CD1-CB 4.5Å
469	F	83.7	Confident	86.1	Confident	16 Å²	16	43 Å²	43	7%	0.07	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-38	-177.3	-61.7	-63.9	0	0	0	111	I44 I249 W254 L365 L368 I395 V396 F404 D467 H473	I44-F469 HydrophobicContact CD1-CZ 4.48Å; I249-F469 HydrophobicContact CG2-CE1 3.93Å; I249-F469 HydrophobicContact CG2-CZ 3.77Å; W254-F469 AromaticContact CH2-CD1 3.82Å; W254-F469 HydrophobicContact CH2-CD1 3.82Å; W254-F469 AromaticContact CH2-CE1 3.77Å; W254-F469 HydrophobicContact CH2-CE1 3.77Å; W254-F469 HydrophobicContact CZ2-CD1 4.19Å; W254-F469 HydrophobicContact CZ2-CE1 4.31Å; L365-F469 HydrophobicContact CD2-CD2 4.37Å; L365-F469 HydrophobicContact CD2-CG 4.23Å; L368-F469 HydrophobicContact CD2-CB 4.27Å; I395-F469 HydrophobicContact CG2-CE2 4.3Å; I395-F469 HydrophobicContact CG2-CZ 4.19Å; V396-F469 HydrophobicContact CG2-CE2 4.39Å; F404-F469 HydrophobicContact CZ-CB 4.17Å; F404-F469 HydrophobicContact CZ-CD2 4.32Å; D467-F469 PolarHBondContact O-N 3.45Å; F469-H473 PolarHBondContact O-CD2 3.44Å
470	L	85.6	Confident	86.3	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-24.9	-171.4	-164.5	60.3	0	0	0	113.5	F404 L407 L464 D467 D472 H473 V474 L477	F404-L470 HydrophobicContact CD1-CD1 4.37Å; F404-L470 HydrophobicContact CE1-CB 4.14Å; F404-L470 HydrophobicContact CE1-CD2 4.49Å; L407-L470 HydrophobicContact CD1-CD1 3.96Å; L407-L470 HydrophobicContact CD1-CD2 3.43Å; L407-L470 VanDerWaalsContact CD1-CD2 3.43Å; L407-L470 HydrophobicContact CD1-CG 4.26Å; L464-L470 HydrophobicContact CB-CD2 3.64Å; L464-L470 HydrophobicContact CD1-CD2 4.32Å; L464-L470 HydrophobicContact CD2-CD2 3.46Å; L464-L470 VanDerWaalsContact CD2-CD2 3.46Å; L464-L470 HydrophobicContact CG-CD2 3.95Å; D467-L470 HydrophobicContact CB-CB 4.12Å; L470-D472 PolarHBondContact O-N 3.04Å; L470-H473 HydrophobicContact CD1-CB 4.48Å; L470-H473 PolarHBondContact O-N 3.49Å; L470-V474 HydrophobicContact CG-CG2 3.96Å; L470-V474 VanDerWaalsContact O-CG2 3.29Å; L470-V474 WeakPolarHBondContact O-CG2 3.43Å; L470-V474 PolarHBondContact O-N 3.32Å; L470-L477 HydrophobicContact CD1-CD1 3.68Å
471	S	82.3	Confident	86.7	Confident	14 Å²	14	36.7 Å²	36.7	10%	0.098	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-41.4	-173.4	63.6	0	0	0	0	114.3	F51 D467 H473	F51-S471 VanDerWaalsContact CZ-OG 3.3Å; F51-S471 WeakPolarHBondContact CZ-OG 3.05Å; D467-S471 VanDerWaalsContact O-CB 3.29Å; D467-S471 WeakPolarHBondContact O-CB 3.22Å; D467-S471 PolarHBondContact O-N 3.06Å; D467-S471 VanDerWaalsContact O-N 3.13Å; S471-H473 VanDerWaalsContact C-N 3.31Å
472	D	85.4	Confident	87	Confident	63 Å²	63	33.9 Å²	33.9	34%	0.337	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-17.7	-173.3	-58.1	-14.7	0	0	0	111.4	R55 R252 L470	R55-D472 IonicContact NH2-OD1 3.78Å; R252-D472 IonicContact NH2-OD2 3.71Å; R252-D472 PolarHBondContact NH2-OD2 2.79Å; L470-D472 PolarHBondContact O-N 3.04Å
473	H	87.7	Confident	87.5	Confident	14 Å²	14	32.9 Å²	32.9	7%	0.065	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-16.7	-176	-56.9	-65.7	0	0	0	113.6	L368 Y373 F469 L470 S471 S475 A476 L477	L368-H473 PolarHBondContact O-CE1 3.18Å; L368-H473 PolarHBondContact O-NE2 3.07Å; Y373-H473 HydrophobicContact CE1-CB 4.22Å; F469-H473 PolarHBondContact O-CD2 3.44Å; L470-H473 HydrophobicContact CD1-CB 4.48Å; L470-H473 PolarHBondContact O-N 3.49Å; S471-H473 VanDerWaalsContact C-N 3.31Å; H473-S475 VanDerWaalsContact C-N 3.33Å; H473-S475 PolarHBondContact O-N 2.78Å; H473-A476 PolarHBondContact O-N 3.02Å; H473-L477 HydrophobicContact CB-CD1 3.91Å; H473-L477 HydrophobicContact CB-CG 4.39Å; H473-L477 WeakPolarHBondContact O-CB 2.98Å; H473-L477 WeakPolarHBondContact O-CG 3.11Å; H473-L477 PolarHBondContact O-N 3.48Å
474	V	88.1	Confident	87.7	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-52.2	-49.3	-176.7	179.6	0	0	0	0	111.6	R461 L464 L470 A476 L477 F478	R461-V474 HydrophobicContact CG-CG1 4.18Å; L464-V474 HydrophobicContact CB-CG2 4.06Å; L470-V474 HydrophobicContact CG-CG2 3.96Å; L470-V474 VanDerWaalsContact O-CG2 3.29Å; L470-V474 WeakPolarHBondContact O-CG2 3.43Å; L470-V474 PolarHBondContact O-N 3.32Å; V474-A476 PolarHBondContact O-N 3.34Å; V474-L477 PolarHBondContact O-N 3.28Å; V474-F478 HydrophobicContact CG1-CD2 3.68Å; V474-F478 HydrophobicContact CG1-CE2 3.55Å; V474-F478 HydrophobicContact CG1-CG 4.41Å; V474-F478 HydrophobicContact CG1-CZ 4.18Å; V474-F478 WeakPolarHBondContact O-CB 3.33Å; V474-F478 WeakPolarHBondContact O-CD2 3.46Å; V474-F478 PolarHBondContact O-N 2.98Å
475	S	88.9	Confident	88.1	Confident	85 Å²	85	33 Å²	33	59%	0.594	16%	0.161	S	C	*	.	H	α-helix	trans	-63	-42.4	-177.2	56.5	0	0	0	0	112.5	H473 R479	H473-S475 VanDerWaalsContact C-N 3.33Å; H473-S475 PolarHBondContact O-N 2.78Å; S475-R479 WeakPolarHBondContact O-CB 3.47Å; S475-R479 PolarHBondContact O-N 3.42Å
476	A	91	Very high	88.3	Confident	23 Å²	23	31.1 Å²	31.1	19%	0.19	15%	0.153	C	C	.	.	H	α-helix	trans	-68	-49.2	177.9	0	0	0	0	0	111.5	Y373 H473 V474 F478 R479 E480	Y373-A476 WeakPolarHBondContact OH-CB 2.94Å; H473-A476 PolarHBondContact O-N 3.02Å; V474-A476 PolarHBondContact O-N 3.34Å; A476-F478 VanDerWaalsContact C-N 3.35Å; A476-F478 PolarHBondContact O-N 3.16Å; A476-R479 PolarHBondContact O-N 2.95Å; A476-E480 WeakPolarHBondContact O-CG 3.18Å; A476-E480 PolarHBondContact O-N 3.39Å
477	L	91.9	Very high	88.6	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-43.7	179.4	-76	167.2	0	0	0	111.7	Y373 L407 A411 L470 H473 V474 R479 E480 I481	Y373-L477 HydrophobicContact CD1-CD2 3.6Å; Y373-L477 HydrophobicContact CD1-CG 4.25Å; Y373-L477 HydrophobicContact CD2-CD2 3.93Å; Y373-L477 HydrophobicContact CE1-CD1 4.4Å; Y373-L477 HydrophobicContact CE1-CD2 3.81Å; Y373-L477 HydrophobicContact CE1-CG 3.96Å; Y373-L477 HydrophobicContact CE2-CD2 4.12Å; Y373-L477 HydrophobicContact CE2-CG 4.5Å; Y373-L477 HydrophobicContact CG-CD2 3.66Å; L407-L477 HydrophobicContact CB-CD1 4.22Å; A411-L477 HydrophobicContact CB-CD2 3.79Å; L470-L477 HydrophobicContact CD1-CD1 3.68Å; H473-L477 HydrophobicContact CB-CD1 3.91Å; H473-L477 HydrophobicContact CB-CG 4.39Å; H473-L477 WeakPolarHBondContact O-CB 2.98Å; H473-L477 WeakPolarHBondContact O-CG 3.11Å; H473-L477 PolarHBondContact O-N 3.48Å; V474-L477 PolarHBondContact O-N 3.28Å; L477-R479 VanDerWaalsContact C-N 3.33Å; L477-R479 PolarHBondContact O-N 2.97Å; L477-E480 PolarHBondContact O-N 3.49Å; L477-I481 WeakPolarHBondContact O-CB 3.3Å; L477-I481 WeakPolarHBondContact O-CG1 3.49Å; L477-I481 PolarHBondContact O-N 3.41Å
478	F	91	Very high	88.8	Confident	26 Å²	26	32.7 Å²	32.7	11%	0.114	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-38	179	-84.7	-123.8	0	0	0	112	L407 L457 R461 L464 V474 A476 R482	L407-F478 HydrophobicContact CD2-CE2 4.42Å; L457-F478 HydrophobicContact CB-CE1 4.47Å; L457-F478 HydrophobicContact CD1-CE1 4.21Å; L457-F478 HydrophobicContact CD1-CE2 4.04Å; L457-F478 HydrophobicContact CD1-CZ 3.71Å; L457-F478 HydrophobicContact CD2-CD1 4.03Å; L457-F478 HydrophobicContact CD2-CE1 3.96Å; L457-F478 HydrophobicContact CD2-CE2 4.49Å; L457-F478 HydrophobicContact CD2-CG 4.36Å; L457-F478 HydrophobicContact CD2-CZ 4.2Å; L457-F478 HydrophobicContact CG-CD1 4.1Å; L457-F478 HydrophobicContact CG-CE1 3.5Å; L457-F478 VanDerWaalsContact CG-CE1 3.5Å; L457-F478 HydrophobicContact CG-CE2 4.16Å; L457-F478 HydrophobicContact CG-CZ 3.53Å; L457-F478 WeakPolarHBondContact O-CZ 3.37Å; R461-F478 HydrophobicContact CB-CE1 3.67Å; R461-F478 HydrophobicContact CB-CZ 3.76Å; R461-F478 HydrophobicContact CG-CD1 4.41Å; R461-F478 HydrophobicContact CG-CE1 3.76Å; R461-F478 HydrophobicContact CG-CZ 3.95Å; L464-F478 HydrophobicContact CD1-CE2 4Å; L464-F478 HydrophobicContact CD1-CZ 4.1Å; V474-F478 HydrophobicContact CG1-CD2 3.68Å; V474-F478 HydrophobicContact CG1-CE2 3.55Å; V474-F478 HydrophobicContact CG1-CG 4.41Å; V474-F478 HydrophobicContact CG1-CZ 4.18Å; V474-F478 WeakPolarHBondContact O-CB 3.33Å; V474-F478 WeakPolarHBondContact O-CD2 3.46Å; V474-F478 PolarHBondContact O-N 2.98Å; A476-F478 VanDerWaalsContact C-N 3.35Å; A476-F478 PolarHBondContact O-N 3.16Å; F478-R482 VanDerWaalsContact O-CB 3.31Å; F478-R482 WeakPolarHBondContact O-CB 3.33Å; F478-R482 PolarHBondContact O-N 2.92Å
479	R	90.4	Very high	89.2	Confident	171 Å²	171	33.8 Å²	33.8	65%	0.645	17%	0.167	S	C	*	.	H	α-helix	trans	-64.7	-44	175.1	-170.9	179.3	68.3	177.3	3.1	111.5	S475 A476 L477 R482 S483	S475-R479 WeakPolarHBondContact O-CB 3.47Å; S475-R479 PolarHBondContact O-N 3.42Å; A476-R479 PolarHBondContact O-N 2.95Å; L477-R479 VanDerWaalsContact C-N 3.33Å; L477-R479 PolarHBondContact O-N 2.97Å; R479-R482 PolarHBondContact O-N 3.19Å; R479-S483 WeakPolarHBondContact O-CB 3.44Å; R479-S483 PolarHBondContact O-N 3.37Å; R479-S483 PolarHBondContact O-OG 3.26Å
480	E	90.8	Very high	89.4	Confident	70 Å²	70	33.8 Å²	33.8	33%	0.327	17%	0.167	S	C	.	.	H	α-helix	trans	-67.5	-39.8	177.6	-65.1	-49.8	134.8	0	0	112.7	A411 A476 L477 R482 S483 R484	A411-E480 HydrophobicContact CB-CB 4.12Å; A476-E480 WeakPolarHBondContact O-CG 3.18Å; A476-E480 PolarHBondContact O-N 3.39Å; L477-E480 PolarHBondContact O-N 3.49Å; E480-R482 VanDerWaalsContact C-N 3.29Å; E480-R482 PolarHBondContact O-N 3.06Å; E480-S483 WeakPolarHBondContact CA-OG 3.32Å; E480-S483 PolarHBondContact O-N 3.41Å; E480-S483 PolarHBondContact O-OG 2.94Å; E480-R484 WeakPolarHBondContact O-CB 3.47Å; E480-R484 PolarHBondContact O-N 2.81Å
481	I	92.6	Very high	89.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-41.8	175	-67.6	165.4	0	0	0	110.1	L407 L410 A411 L457 L477 R484 A485	L407-I481 HydrophobicContact CD2-CD1 4.07Å; L410-I481 HydrophobicContact CB-CD1 4Å; L410-I481 HydrophobicContact CB-CG1 3.86Å; L410-I481 HydrophobicContact CB-CG2 4.46Å; A411-I481 HydrophobicContact CB-CG1 4.04Å; L457-I481 HydrophobicContact CD2-CD1 4.02Å; L457-I481 HydrophobicContact CD2-CG2 4.06Å; L477-I481 WeakPolarHBondContact O-CB 3.3Å; L477-I481 WeakPolarHBondContact O-CG1 3.49Å; L477-I481 PolarHBondContact O-N 3.41Å; I481-R484 PolarHBondContact O-N 3.39Å; I481-A485 WeakPolarHBondContact O-CB 3.41Å; I481-A485 PolarHBondContact O-N 2.77Å
482	R	91.6	Very high	89.9	Confident	50 Å²	50	42.7 Å²	42.7	19%	0.189	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-46.7	178.8	-174.1	171.9	174.7	84.5	5.6	112	F478 R479 E480 R484 A485 L486 E515	F478-R482 VanDerWaalsContact O-CB 3.31Å; F478-R482 WeakPolarHBondContact O-CB 3.33Å; F478-R482 PolarHBondContact O-N 2.92Å; R479-R482 PolarHBondContact O-N 3.19Å; E480-R482 VanDerWaalsContact C-N 3.29Å; E480-R482 PolarHBondContact O-N 3.06Å; R482-R484 VanDerWaalsContact C-N 3.27Å; R482-R484 PolarHBondContact O-N 2.98Å; R482-A485 PolarHBondContact O-N 3.01Å; R482-L486 HydrophobicContact CG-CD1 4.36Å; R482-L486 VanDerWaalsContact O-CG 3.31Å; R482-L486 WeakPolarHBondContact O-CG 3.3Å; R482-L486 PolarHBondContact O-N 2.96Å; R482-E515 IonicContact CZ-OE1 2.88Å; R482-E515 IonicContact CZ-OE2 3.57Å; R482-E515 VanDerWaalsContact CZ-OE2 3.25Å; R482-E515 IonicContact NE-OE1 3.96Å; R482-E515 PolarHBondContact NE-OE1 2.87Å; R482-E515 IonicContact NE-OE2 2.74Å; R482-E515 PolarHBondContact NE-OE2 3.28Å; R482-E515 VanDerWaalsContact NH2-CD 3.31Å; R482-E515 IonicContact NH2-OE1 3.84Å; R482-E515 PolarHBondContact NH2-OE1 3.49Å; R482-E515 IonicContact NH2-OE2 2.81Å; R482-E515 PolarHBondContact NH2-OE2 3.37Å
483	S	90.5	Very high	90.1	Very high	21 Å²	21	44.6 Å²	44.6	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-42	175.3	64.8	0	0	0	0	111.2	R479 E480 L486 C487 L519	R479-S483 WeakPolarHBondContact O-CB 3.44Å; R479-S483 PolarHBondContact O-N 3.37Å; R479-S483 PolarHBondContact O-OG 3.26Å; E480-S483 WeakPolarHBondContact CA-OG 3.32Å; E480-S483 PolarHBondContact O-N 3.41Å; E480-S483 PolarHBondContact O-OG 2.94Å; S483-L486 PolarHBondContact O-N 2.82Å; S483-C487 PolarHBondContact O-N 2.92Å; S483-C487 PolarHBondContact O-SG 3.12Å; S483-L519 VanDerWaalsContact CB-CD2 3.47Å
484	R	90.2	Very high	90.3	Very high	61 Å²	61	47.7 Å²	47.7	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-43.1	178.5	-167.6	63	168.5	166.8	-1.1	112.4	E414 F445 E480 I481 R482 L486 C487 Q488	E414-R484 IonicContact OE1-CZ 3.99Å; E414-R484 IonicContact OE1-NH1 3.14Å; E414-R484 IonicContact OE1-NH2 3.34Å; E414-R484 PolarHBondContact OE1-NH2 3.3Å; F445-R484 HydrophobicContact CZ-CG 4.27Å; E480-R484 WeakPolarHBondContact O-CB 3.47Å; E480-R484 PolarHBondContact O-N 2.81Å; I481-R484 PolarHBondContact O-N 3.39Å; R482-R484 VanDerWaalsContact C-N 3.27Å; R482-R484 PolarHBondContact O-N 2.98Å; R484-L486 VanDerWaalsContact C-N 3.31Å; R484-L486 PolarHBondContact O-N 3.3Å; R484-C487 PolarHBondContact O-N 3.25Å; R484-Q488 WeakPolarHBondContact O-CG 3.46Å; R484-Q488 PolarHBondContact O-N 3Å
485	A	91.1	Very high	90.4	Very high	2 Å²	2	50.7 Å²	50.7	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-43.5	175.2	0	0	0	0	0	111.4	F445 Y450 I481 R482 Q488 Y489 F505	F445-A485 HydrophobicContact CE2-CB 4.12Å; Y450-A485 HydrophobicContact CD1-CB 3.69Å; Y450-A485 HydrophobicContact CE1-CB 4.11Å; Y450-A485 HydrophobicContact CG-CB 4.23Å; I481-A485 WeakPolarHBondContact O-CB 3.41Å; I481-A485 PolarHBondContact O-N 2.77Å; R482-A485 PolarHBondContact O-N 3.01Å; A485-Q488 PolarHBondContact O-N 2.91Å; A485-Y489 VanDerWaalsContact O-CB 3.31Å; A485-Y489 WeakPolarHBondContact O-CB 3.48Å; A485-Y489 PolarHBondContact O-N 3.34Å; A485-F505 HydrophobicContact CB-CE1 3.99Å; A485-F505 HydrophobicContact CB-CZ 4.41Å
486	L	90.8	Very high	90.6	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-42.9	176.1	-67	166	0	0	0	111.7	R482 S483 R484 F490 M501 F505 L512 L519	R482-L486 HydrophobicContact CG-CD1 4.36Å; R482-L486 VanDerWaalsContact O-CG 3.31Å; R482-L486 WeakPolarHBondContact O-CG 3.3Å; R482-L486 PolarHBondContact O-N 2.96Å; S483-L486 PolarHBondContact O-N 2.82Å; R484-L486 VanDerWaalsContact C-N 3.31Å; R484-L486 PolarHBondContact O-N 3.3Å; L486-F490 PolarHBondContact O-N 2.66Å; L486-F490 VanDerWaalsContact O-N 3.12Å; L486-M501 HydrophobicContact CB-CE 4.35Å; L486-M501 HydrophobicContact CD2-CE 3.37Å; L486-M501 HydrophobicContact CG-CE 4.47Å; L486-F505 HydrophobicContact CD2-CD1 4.23Å; L486-F505 HydrophobicContact CD2-CD2 3.88Å; L486-F505 HydrophobicContact CD2-CE1 3.97Å; L486-F505 HydrophobicContact CD2-CE2 3.62Å; L486-F505 HydrophobicContact CD2-CG 4.2Å; L486-F505 HydrophobicContact CD2-CZ 3.67Å; L486-F505 HydrophobicContact CG-CE1 4.34Å; L486-F505 HydrophobicContact CG-CZ 4.24Å; L486-L512 HydrophobicContact CD2-CD1 3.84Å; L486-L519 HydrophobicContact CB-CD1 3.97Å; L486-L519 HydrophobicContact CD1-CD1 3.6Å; L486-L519 HydrophobicContact CG-CD1 4.44Å
487	C	89.7	Confident	90.8	Very high	26 Å²	26	49.1 Å²	49.1	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-45.1	176.2	-65.4	0	0	0	0	112.2	S483 R484 F490 S491 I525	S483-C487 PolarHBondContact O-N 2.92Å; S483-C487 PolarHBondContact O-SG 3.12Å; R484-C487 PolarHBondContact O-N 3.25Å; C487-F490 PolarHBondContact O-N 2.73Å; C487-S491 PolarHBondContact O-N 3.07Å; C487-S491 VanDerWaalsContact O-N 3.11Å; C487-I525 VanDerWaalsContact SG-CG1 3.51Å
488	Q	88.7	Confident	90.8	Very high	27 Å²	27	49.1 Å²	49.1	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-70.1	-35.4	179.8	-70.4	-170.9	8.4	0	0	112.4	F445 Y450 R484 A485 F490 S491	F445-Q488 VanDerWaalsContact CE1-OE1 3.22Å; Y450-Q488 VanDerWaalsContact OH-CB 3.27Å; Y450-Q488 WeakPolarHBondContact OH-CB 3.42Å; R484-Q488 WeakPolarHBondContact O-CG 3.46Å; R484-Q488 PolarHBondContact O-N 3Å; A485-Q488 PolarHBondContact O-N 2.91Å; Q488-F490 VanDerWaalsContact C-N 3.33Å; Q488-S491 PolarHBondContact O-N 3.31Å
489	Y	90.3	Very high	90.8	Very high	31 Å²	31	51.2 Å²	51.2	12%	0.122	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.2	-177	-94.5	0	0	0	111.5	Y450 A485 P492 Y493 M501 A504 F505	Y450-Y489 AromaticContact CD2-CD2 3.85Å; Y450-Y489 HydrophobicContact CD2-CD2 3.85Å; Y450-Y489 HydrophobicContact CD2-CG 4.45Å; Y450-Y489 AromaticContact CE2-CD2 3.77Å; Y450-Y489 HydrophobicContact CE2-CD2 3.77Å; Y450-Y489 HydrophobicContact CE2-CG 4.24Å; A485-Y489 VanDerWaalsContact O-CB 3.31Å; A485-Y489 WeakPolarHBondContact O-CB 3.48Å; A485-Y489 PolarHBondContact O-N 3.34Å; Y489-P492 WeakPolarHBondContact O-CD 3.07Å; Y489-Y493 HydrophobicContact CD1-CE2 4.42Å; Y489-Y493 HydrophobicContact CE1-CE2 4.09Å; Y489-Y493 HydrophobicContact CE2-CE2 4.44Å; Y489-Y493 WeakPolarHBondContact O-CD2 3.43Å; Y489-Y493 WeakPolarHBondContact O-CE2 3.49Å; Y489-M501 HydrophobicContact CD1-CE 3.94Å; Y489-M501 HydrophobicContact CD1-CG 3.97Å; Y489-M501 HydrophobicContact CD1-SD 3.94Å; Y489-M501 HydrophobicContact CE1-CB 4.07Å; Y489-M501 HydrophobicContact CE1-CG 3.72Å; Y489-M501 HydrophobicContact CE1-SD 4.02Å; Y489-A504 HydrophobicContact CE2-CB 4.42Å; Y489-F505 HydrophobicContact CD1-CE2 4.26Å; Y489-F505 HydrophobicContact CD2-CE2 4.36Å; Y489-F505 HydrophobicContact CG-CE2 4Å; Y489-F505 HydrophobicContact CG-CZ 4.35Å
490	F	89.7	Confident	90.9	Very high	16 Å²	16	47.9 Å²	47.9	7%	0.07	26%	0.264	C	S	.	.	H	α-helix	trans	-77.2	-26	-178.7	-175.8	-113.9	0	0	0	114.1	L486 C487 Q488 P492 Y493 A496 I525 A527 L536 V538	L486-F490 PolarHBondContact O-N 2.66Å; L486-F490 VanDerWaalsContact O-N 3.12Å; C487-F490 PolarHBondContact O-N 2.73Å; Q488-F490 VanDerWaalsContact C-N 3.33Å; F490-P492 VanDerWaalsContact C-CD 3.44Å; F490-P492 VanDerWaalsContact O-N 3.14Å; F490-Y493 PolarHBondContact O-N 3.22Å; F490-A496 HydrophobicContact CD2-CB 4.3Å; F490-A496 HydrophobicContact CE2-CB 4.48Å; F490-I525 HydrophobicContact CD1-CG2 3.73Å; F490-I525 HydrophobicContact CE1-CG2 3.89Å; F490-A527 HydrophobicContact CE1-CB 3.83Å; F490-A527 HydrophobicContact CZ-CB 3.74Å; F490-L536 HydrophobicContact CD2-CD2 3.53Å; F490-L536 HydrophobicContact CD2-CG 4.18Å; F490-L536 HydrophobicContact CE2-CB 4.29Å; F490-L536 HydrophobicContact CE2-CD2 3.57Å; F490-L536 HydrophobicContact CE2-CG 3.68Å; F490-L536 HydrophobicContact CG-CD2 4.11Å; F490-L536 HydrophobicContact CZ-CD2 4.16Å; F490-L536 HydrophobicContact CZ-CG 4.1Å; F490-V538 HydrophobicContact CE1-CG2 3.6Å; F490-V538 HydrophobicContact CE2-CG2 4.16Å; F490-V538 HydrophobicContact CZ-CB 4.2Å; F490-V538 HydrophobicContact CZ-CG2 3.28Å
491	S	87.5	Confident	90.9	Very high	101 Å²	101	44.6 Å²	44.6	71%	0.706	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-39.3	-174.9	-176.3	0	0	0	0	116.7	C487 Q488	C487-S491 PolarHBondContact O-N 3.07Å; C487-S491 VanDerWaalsContact O-N 3.11Å; Q488-S491 PolarHBondContact O-N 3.31Å
492	P	89.5	Confident	90.9	Very high	102 Å²	102	44.8 Å²	44.8	66%	0.662	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.9	178.1	32.2	-35.6	0	0	0	114.7	Y489 F490	Y489-P492 WeakPolarHBondContact O-CD 3.07Å; F490-P492 VanDerWaalsContact C-CD 3.44Å; F490-P492 VanDerWaalsContact O-N 3.14Å
493	Y	91.1	Very high	90.8	Very high	102 Å²	102	49.9 Å²	49.9	40%	0.4	27%	0.274	S	S	.	.			trans	-100.4	133.9	-173.9	-61.8	-75.3	0	0	0	112	Y489 F490 A496 V538	Y489-Y493 HydrophobicContact CD1-CE2 4.42Å; Y489-Y493 HydrophobicContact CE1-CE2 4.09Å; Y489-Y493 HydrophobicContact CE2-CE2 4.44Å; Y489-Y493 WeakPolarHBondContact O-CD2 3.43Å; Y489-Y493 WeakPolarHBondContact O-CE2 3.49Å; F490-Y493 PolarHBondContact O-N 3.22Å; Y493-A496 HydrophobicContact CG-CB 4.42Å; Y493-V538 VanDerWaalsContact O-CG2 3.23Å; Y493-V538 WeakPolarHBondContact O-CG2 2.99Å
494	S	90.6	Very high	90.7	Very high	80 Å²	80	50.4 Å²	50.4	56%	0.559	28%	0.28	S	S	*	.	S	Bend	trans	-81.1	-34.2	166.9	176	0	0	0	0	111.9	V538	S494-V538 WeakPolarHBondContact O-CG2 3.24Å; S494-V538 PolarHBondContact O-N 3.25Å
495	S	91.4	Very high	90.6	Very high	70 Å²	70	47.9 Å²	47.9	49%	0.49	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	127.5	171.9	60.7	0	0	0	0	109.6	L536	S495-L536 CarbonylContact C-O 3.54Å; S495-L536 VanDerWaalsContact CA-O 3.3Å; S495-L536 WeakPolarHBondContact CA-O 3.28Å
496	A	92.2	Very high	90.4	Very high	5 Å²	5	54.1 Å²	54.1	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.1	178.4	0	0	0	0	0	110.9	F490 Y493 L535 L536	F490-A496 HydrophobicContact CD2-CB 4.3Å; F490-A496 HydrophobicContact CE2-CB 4.48Å; Y493-A496 HydrophobicContact CG-CB 4.42Å; A496-L535 CarbonylContact O-C 3.48Å; A496-L535 WeakPolarHBondContact O-CA 3.47Å; A496-L536 PolarHBondContact N-O 3.4Å; A496-L536 PolarHBondContact O-N 3.44Å
497	D	94.3	Very high	90.3	Very high	69 Å²	69	55.9 Å²	55.9	37%	0.369	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.4	172.3	-179.7	4.8	0	0	0	110.3	N499 L500 M501 L535	D497-N499 PolarHBondContact O-N 3.28Å; D497-N499 WeakPolarHBondContact OD1-CB 3.49Å; D497-N499 PolarHBondContact OD1-N 3.29Å; D497-N499 PolarHBondContact OD1-ND2 3Å; D497-L500 HydrophobicContact CB-CB 4.32Å; D497-L500 PolarHBondContact O-N 3.32Å; D497-M501 WeakPolarHBondContact O-CB 3.18Å; D497-M501 PolarHBondContact O-N 3.37Å; D497-M501 VanDerWaalsContact O-N 3.1Å; D497-L535 HydrophobicContact CB-CD2 4.28Å
498	L	92.3	Very high	90.4	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-30	179.4	-68.1	177.2	0	0	0	111.7	M501 A502 V509 L512 E513 L516 I529 Q534 L536	L498-M501 PolarHBondContact O-N 3.22Å; L498-A502 WeakPolarHBondContact O-CB 3.48Å; L498-A502 PolarHBondContact O-N 3.45Å; L498-V509 HydrophobicContact CB-CG1 4.43Å; L498-L512 HydrophobicContact CD2-CD2 4.33Å; L498-E513 HydrophobicContact CD1-CG 3.89Å; L498-L516 HydrophobicContact CD2-CD1 3.57Å; L498-I529 HydrophobicContact CD1-CG2 4.24Å; L498-Q534 HydrophobicContact CB-CB 4.42Å; L498-Q534 WeakPolarHBondContact CB-O 3.46Å; L498-Q534 WeakPolarHBondContact CG-O 3.41Å; L498-Q534 PolarHBondContact N-O 3.46Å; L498-L536 HydrophobicContact CD2-CB 4.13Å
499	N	92.4	Very high	90.6	Very high	69 Å²	69	59.8 Å²	59.8	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-69.2	-41.6	178.6	-64	-77.3	0	0	0	112	D497 K503	D497-N499 PolarHBondContact O-N 3.28Å; D497-N499 WeakPolarHBondContact OD1-CB 3.49Å; D497-N499 PolarHBondContact OD1-N 3.29Å; D497-N499 PolarHBondContact OD1-ND2 3Å; N499-K503 WeakPolarHBondContact O-CG 3.42Å; N499-K503 PolarHBondContact O-N 3.31Å; N499-K503 VanDerWaalsContact O-N 3.13Å
500	L	91.3	Very high	90.6	Very high	102 Å²	102	60.6 Å²	60.6	53%	0.534	35%	0.348	S	S	.	.	H	α-helix	trans	-67.9	-40.7	176.7	-173.7	67.4	0	0	0	110.7	D497 K503 A504	D497-L500 HydrophobicContact CB-CB 4.32Å; D497-L500 PolarHBondContact O-N 3.32Å; L500-K503 PolarHBondContact O-N 3.01Å; L500-A504 PolarHBondContact O-N 3.39Å
501	M	91.3	Very high	90.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-65.1	-44.1	176.6	-168	168.1	176.8	0	0	111.5	L486 Y489 D497 L498 K503 A504 F505 L512 L516	L486-M501 HydrophobicContact CB-CE 4.35Å; L486-M501 HydrophobicContact CD2-CE 3.37Å; L486-M501 HydrophobicContact CG-CE 4.47Å; Y489-M501 HydrophobicContact CD1-CE 3.94Å; Y489-M501 HydrophobicContact CD1-CG 3.97Å; Y489-M501 HydrophobicContact CD1-SD 3.94Å; Y489-M501 HydrophobicContact CE1-CB 4.07Å; Y489-M501 HydrophobicContact CE1-CG 3.72Å; Y489-M501 HydrophobicContact CE1-SD 4.02Å; D497-M501 WeakPolarHBondContact O-CB 3.18Å; D497-M501 PolarHBondContact O-N 3.37Å; D497-M501 VanDerWaalsContact O-N 3.1Å; L498-M501 PolarHBondContact O-N 3.22Å; M501-K503 VanDerWaalsContact C-N 3.29Å; M501-K503 PolarHBondContact O-N 3.48Å; M501-A504 PolarHBondContact O-N 3.29Å; M501-F505 HydrophobicContact CE-CE2 4.02Å; M501-F505 HydrophobicContact CG-CD2 3.9Å; M501-F505 HydrophobicContact CG-CE2 3.99Å; M501-F505 WeakPolarHBondContact O-CD2 3.19Å; M501-F505 PolarHBondContact O-N 3.22Å; M501-F505 VanDerWaalsContact O-N 3.08Å; M501-L512 HydrophobicContact CB-CD2 3.87Å; M501-L512 HydrophobicContact CE-CD1 4.44Å; M501-L512 HydrophobicContact CG-CD2 3.8Å; M501-L512 HydrophobicContact SD-CD2 4.31Å; M501-L516 HydrophobicContact CE-CD2 4.02Å; M501-L516 HydrophobicContact SD-CD1 4.44Å
502	A	92.1	Very high	90.9	Very high	5 Å²	5	57.9 Å²	57.9	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-41.9	176	0	0	0	0	0	111.8	L498 F505 D506 T507 V509 L512	L498-A502 WeakPolarHBondContact O-CB 3.48Å; L498-A502 PolarHBondContact O-N 3.45Å; A502-F505 PolarHBondContact O-N 3.49Å; A502-D506 PolarHBondContact O-N 3.25Å; A502-D506 VanDerWaalsContact O-N 3.15Å; A502-T507 WeakPolarHBondContact CB-O 3.47Å; A502-T507 PolarHBondContact O-N 3.02Å; A502-V509 HydrophobicContact CB-CG2 3.86Å; A502-L512 HydrophobicContact CB-CD2 4.07Å
503	K	89.7	Confident	91.1	Very high	157 Å²	157	55 Å²	55	68%	0.683	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-39.3	173	-71.7	173.3	-176.8	177.9	0	113	N499 L500 M501 F505 D506	N499-K503 WeakPolarHBondContact O-CG 3.42Å; N499-K503 PolarHBondContact O-N 3.31Å; N499-K503 VanDerWaalsContact O-N 3.13Å; L500-K503 PolarHBondContact O-N 3.01Å; M501-K503 VanDerWaalsContact C-N 3.29Å; M501-K503 PolarHBondContact O-N 3.48Å; K503-F505 VanDerWaalsContact C-N 3.26Å; K503-F505 PolarHBondContact O-N 3.27Å; K503-D506 PolarHBondContact O-N 3.18Å
504	A	88.9	Confident	91.1	Very high	32 Å²	32	55.5 Å²	55.5	26%	0.264	32%	0.318	S	S	.	.	H	α-helix	trans	-70.1	-22.3	179.4	0	0	0	0	0	113.5	A451 Y489 L500 M501	A451-A504 WeakPolarHBondContact CB-O 3.42Å; Y489-A504 HydrophobicContact CE2-CB 4.42Å; L500-A504 PolarHBondContact O-N 3.39Å; M501-A504 PolarHBondContact O-N 3.29Å
505	F	88.7	Confident	91.1	Very high	7 Å²	7	54.5 Å²	54.5	3%	0.031	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	6.5	179.6	-75.6	-79.9	0	0	0	113.6	Y450 L454 A485 L486 Y489 M501 A502 K503 T507	Y450-F505 HydrophobicContact CD2-CZ 4.13Å; Y450-F505 HydrophobicContact CG-CE1 4.28Å; Y450-F505 HydrophobicContact CG-CZ 4.22Å; L454-F505 HydrophobicContact CD1-CD1 3.61Å; L454-F505 HydrophobicContact CD1-CE1 4.02Å; A485-F505 HydrophobicContact CB-CE1 3.99Å; A485-F505 HydrophobicContact CB-CZ 4.41Å; L486-F505 HydrophobicContact CD2-CD1 4.23Å; L486-F505 HydrophobicContact CD2-CD2 3.88Å; L486-F505 HydrophobicContact CD2-CE1 3.97Å; L486-F505 HydrophobicContact CD2-CE2 3.62Å; L486-F505 HydrophobicContact CD2-CG 4.2Å; L486-F505 HydrophobicContact CD2-CZ 3.67Å; L486-F505 HydrophobicContact CG-CE1 4.34Å; L486-F505 HydrophobicContact CG-CZ 4.24Å; Y489-F505 HydrophobicContact CD1-CE2 4.26Å; Y489-F505 HydrophobicContact CD2-CE2 4.36Å; Y489-F505 HydrophobicContact CG-CE2 4Å; Y489-F505 HydrophobicContact CG-CZ 4.35Å; M501-F505 HydrophobicContact CE-CE2 4.02Å; M501-F505 HydrophobicContact CG-CD2 3.9Å; M501-F505 HydrophobicContact CG-CE2 3.99Å; M501-F505 WeakPolarHBondContact O-CD2 3.19Å; M501-F505 PolarHBondContact O-N 3.22Å; M501-F505 VanDerWaalsContact O-N 3.08Å; A502-F505 PolarHBondContact O-N 3.49Å; K503-F505 VanDerWaalsContact C-N 3.26Å; K503-F505 PolarHBondContact O-N 3.27Å; F505-T507 HydrophobicContact CB-CG2 4.46Å; F505-T507 WeakPolarHBondContact O-CG2 3.33Å; F505-T507 PolarHBondContact O-N 3.27Å
506	D	85.9	Confident	91.2	Very high	134 Å²	134	51.1 Å²	51.1	72%	0.717	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	43.2	-174.2	-65.9	-42.8	0	0	0	113	A502 K503	A502-D506 PolarHBondContact O-N 3.25Å; A502-D506 VanDerWaalsContact O-N 3.15Å; K503-D506 PolarHBondContact O-N 3.18Å
507	T	88.4	Confident	91.2	Very high	37 Å²	37	52.4 Å²	52.4	23%	0.227	29%	0.292	C	S	.	.			trans	-125	162.4	-177.7	54.2	0	0	0	0	113.1	A502 F505	A502-T507 WeakPolarHBondContact CB-O 3.47Å; A502-T507 PolarHBondContact O-N 3.02Å; F505-T507 HydrophobicContact CB-CG2 4.46Å; F505-T507 WeakPolarHBondContact O-CG2 3.33Å; F505-T507 PolarHBondContact O-N 3.27Å
508	N	92.3	Very high	91.1	Very high	106 Å²	106	52.8 Å²	52.8	57%	0.567	30%	0.296	S	S	*	.			trans	-77.7	146.1	170.8	-171.4	9.8	0	0	0	110.3	A510 S511 L512	N508-A510 VanDerWaalsContact C-N 3.3Å; N508-A510 PolarHBondContact O-N 3.11Å; N508-S511 PolarHBondContact O-N 3.21Å; N508-S511 VanDerWaalsContact O-N 3.12Å; N508-L512 PolarHBondContact O-N 3.41Å
509	V	92.1	Very high	91.1	Very high	29 Å²	29	53.4 Å²	53.4	18%	0.176	30%	0.3	C	S	.	.	H	α-helix	trans	-55.4	-44.4	178.1	177.9	0	0	0	0	111.3	L498 A502 S511 L512 E513	L498-V509 HydrophobicContact CB-CG1 4.43Å; A502-V509 HydrophobicContact CB-CG2 3.86Å; V509-S511 PolarHBondContact O-N 3.4Å; V509-L512 PolarHBondContact O-N 2.97Å; V509-E513 WeakPolarHBondContact O-CG 3.48Å; V509-E513 PolarHBondContact O-N 3.44Å
510	A	91.6	Very high	91	Very high	48 Å²	48	51.8 Å²	51.8	40%	0.397	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-37.8	178.7	0	0	0	0	0	113	N508 N514	N508-A510 VanDerWaalsContact C-N 3.3Å; N508-A510 PolarHBondContact O-N 3.11Å; A510-N514 PolarHBondContact O-N 3Å; A510-N514 PolarHBondContact O-ND2 3.47Å; A510-N514 VanDerWaalsContact O-ND2 3.14Å
511	S	91.6	Very high	91.1	Very high	59 Å²	59	54.5 Å²	54.5	41%	0.413	30%	0.3	S	S	.	.	H	α-helix	trans	-69	-42.3	175.9	-57.9	0	0	0	0	110.9	N508 V509 N514 E515	N508-S511 PolarHBondContact O-N 3.21Å; N508-S511 VanDerWaalsContact O-N 3.12Å; V509-S511 PolarHBondContact O-N 3.4Å; S511-N514 PolarHBondContact O-N 2.94Å; S511-E515 WeakPolarHBondContact O-CG 3.45Å; S511-E515 PolarHBondContact O-N 3.26Å
512	L	92.2	Very high	91	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-42	176.7	-176.4	68.2	0	0	0	111.7	L486 L498 M501 A502 N508 V509 N514 E515 L516	L486-L512 HydrophobicContact CD2-CD1 3.84Å; L498-L512 HydrophobicContact CD2-CD2 4.33Å; M501-L512 HydrophobicContact CB-CD2 3.87Å; M501-L512 HydrophobicContact CE-CD1 4.44Å; M501-L512 HydrophobicContact CG-CD2 3.8Å; M501-L512 HydrophobicContact SD-CD2 4.31Å; A502-L512 HydrophobicContact CB-CD2 4.07Å; N508-L512 PolarHBondContact O-N 3.41Å; V509-L512 PolarHBondContact O-N 2.97Å; L512-N514 VanDerWaalsContact C-N 3.34Å; L512-N514 PolarHBondContact O-N 3.37Å; L512-E515 PolarHBondContact O-N 2.98Å; L512-L516 HydrophobicContact CD1-CD1 4.31Å; L512-L516 HydrophobicContact CD1-CG 4.3Å; L512-L516 HydrophobicContact CD2-CD1 4.4Å; L512-L516 HydrophobicContact CG-CD1 3.89Å; L512-L516 HydrophobicContact CG-CG 4.3Å; L512-L516 WeakPolarHBondContact O-CB 3.31Å; L512-L516 VanDerWaalsContact O-CG 3.24Å; L512-L516 WeakPolarHBondContact O-CG 3.33Å; L512-L516 PolarHBondContact O-N 2.87Å
513	E	92.3	Very high	90.7	Very high	42 Å²	42	61.9 Å²	61.9	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-44	175.4	-78.2	-176.9	165.9	0	0	111.7	L498 V509 L516 A517 Q534	L498-E513 HydrophobicContact CD1-CG 3.89Å; V509-E513 WeakPolarHBondContact O-CG 3.48Å; V509-E513 PolarHBondContact O-N 3.44Å; E513-L516 PolarHBondContact O-N 3.4Å; E513-A517 VanDerWaalsContact O-CB 3.3Å; E513-A517 WeakPolarHBondContact O-CB 3.48Å; E513-A517 PolarHBondContact O-N 3.43Å; E513-Q534 PolarHBondContact OE1-NE2 3.48Å; E513-Q534 PolarHBondContact OE1-OE1 3.19Å
514	N	92.3	Very high	90.5	Very high	113 Å²	113	58.3 Å²	58.3	60%	0.604	35%	0.345	S	S	*	.	H	α-helix	trans	-64.7	-43.7	177	-70.9	-33.3	0	0	0	112	A510 S511 L512 A517 V518	A510-N514 PolarHBondContact O-N 3Å; A510-N514 PolarHBondContact O-ND2 3.47Å; A510-N514 VanDerWaalsContact O-ND2 3.14Å; S511-N514 PolarHBondContact O-N 2.94Å; L512-N514 VanDerWaalsContact C-N 3.34Å; L512-N514 PolarHBondContact O-N 3.37Å; N514-A517 PolarHBondContact O-N 3.41Å; N514-V518 WeakPolarHBondContact O-CG2 3.2Å; N514-V518 PolarHBondContact O-N 3.03Å; N514-V518 VanDerWaalsContact O-N 3.15Å
515	E	90.3	Very high	90.4	Very high	58 Å²	58	57.1 Å²	57.1	27%	0.271	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-44.5	176.6	-72.3	-178.7	-141.2	0	0	111.9	R482 S511 L512 A517 V518 L519	R482-E515 IonicContact CZ-OE1 2.88Å; R482-E515 IonicContact CZ-OE2 3.57Å; R482-E515 VanDerWaalsContact CZ-OE2 3.25Å; R482-E515 IonicContact NE-OE1 3.96Å; R482-E515 PolarHBondContact NE-OE1 2.87Å; R482-E515 IonicContact NE-OE2 2.74Å; R482-E515 PolarHBondContact NE-OE2 3.28Å; R482-E515 VanDerWaalsContact NH2-CD 3.31Å; R482-E515 IonicContact NH2-OE1 3.84Å; R482-E515 PolarHBondContact NH2-OE1 3.49Å; R482-E515 IonicContact NH2-OE2 2.81Å; R482-E515 PolarHBondContact NH2-OE2 3.37Å; S511-E515 WeakPolarHBondContact O-CG 3.45Å; S511-E515 PolarHBondContact O-N 3.26Å; L512-E515 PolarHBondContact O-N 2.98Å; E515-A517 VanDerWaalsContact C-N 3.31Å; E515-A517 PolarHBondContact O-N 3.38Å; E515-V518 PolarHBondContact O-N 3.5Å; E515-L519 WeakPolarHBondContact O-CG 3.44Å; E515-L519 PolarHBondContact O-N 3.46Å; E515-L519 VanDerWaalsContact O-N 3.1Å
516	L	92.5	Very high	90.4	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-36	176.2	-71.2	172.8	0	0	0	111.7	L498 M501 L512 E513 V518 L519 I520 I525 I529 L536	L498-L516 HydrophobicContact CD2-CD1 3.57Å; M501-L516 HydrophobicContact CE-CD2 4.02Å; M501-L516 HydrophobicContact SD-CD1 4.44Å; L512-L516 HydrophobicContact CD1-CD1 4.31Å; L512-L516 HydrophobicContact CD1-CG 4.3Å; L512-L516 HydrophobicContact CD2-CD1 4.4Å; L512-L516 HydrophobicContact CG-CD1 3.89Å; L512-L516 HydrophobicContact CG-CG 4.3Å; L512-L516 WeakPolarHBondContact O-CB 3.31Å; L512-L516 VanDerWaalsContact O-CG 3.24Å; L512-L516 WeakPolarHBondContact O-CG 3.33Å; L512-L516 PolarHBondContact O-N 2.87Å; E513-L516 PolarHBondContact O-N 3.4Å; L516-V518 VanDerWaalsContact C-N 3.34Å; L516-V518 PolarHBondContact O-N 3.24Å; L516-L519 PolarHBondContact O-N 2.97Å; L516-I520 WeakPolarHBondContact O-CB 3.39Å; L516-I520 WeakPolarHBondContact O-CD1 3.26Å; L516-I520 WeakPolarHBondContact O-CG1 3.44Å; L516-I520 PolarHBondContact O-N 3.29Å; L516-I525 HydrophobicContact CD2-CD1 4.13Å; L516-I529 HydrophobicContact CB-CD1 4.04Å; L516-L536 HydrophobicContact CD1-CD2 4.17Å; L516-L536 HydrophobicContact CD2-CD2 4.27Å
517	A	92.1	Very high	90.6	Very high	31 Å²	31	58.1 Å²	58.1	26%	0.256	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-42.8	175.8	0	0	0	0	0	111.6	E513 N514 E515 I520 Q521 I529	E513-A517 VanDerWaalsContact O-CB 3.3Å; E513-A517 WeakPolarHBondContact O-CB 3.48Å; E513-A517 PolarHBondContact O-N 3.43Å; N514-A517 PolarHBondContact O-N 3.41Å; E515-A517 VanDerWaalsContact C-N 3.31Å; E515-A517 PolarHBondContact O-N 3.38Å; A517-I520 PolarHBondContact O-N 2.82Å; A517-Q521 VanDerWaalsContact O-CG 3.28Å; A517-Q521 WeakPolarHBondContact O-CG 3.32Å; A517-Q521 PolarHBondContact O-N 3.17Å; A517-I529 HydrophobicContact CB-CD1 4.41Å
518	V	92.9	Very high	90.7	Very high	77 Å²	77	63 Å²	63	47%	0.467	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-47.1	174	175.8	0	0	0	0	110.6	N514 E515 L516 I520 Q521 D522	N514-V518 WeakPolarHBondContact O-CG2 3.2Å; N514-V518 PolarHBondContact O-N 3.03Å; N514-V518 VanDerWaalsContact O-N 3.15Å; E515-V518 PolarHBondContact O-N 3.5Å; L516-V518 VanDerWaalsContact C-N 3.34Å; L516-V518 PolarHBondContact O-N 3.24Å; V518-I520 VanDerWaalsContact C-N 3.29Å; V518-I520 PolarHBondContact O-N 2.92Å; V518-Q521 WeakPolarHBondContact O-CB 3.48Å; V518-Q521 PolarHBondContact O-N 3.45Å; V518-Q521 VanDerWaalsContact O-N 3.11Å; V518-D522 VanDerWaalsContact O-CG 3.32Å; V518-D522 PolarHBondContact O-N 3.43Å
519	L	91.4	Very high	90.7	Very high	14 Å²	14	60.7 Å²	60.7	7%	0.073	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-29.7	179.7	-66.4	173.1	0	0	0	114.3	S483 L486 E515 L516 G523 S524 I525	S483-L519 VanDerWaalsContact CB-CD2 3.47Å; L486-L519 HydrophobicContact CB-CD1 3.97Å; L486-L519 HydrophobicContact CD1-CD1 3.6Å; L486-L519 HydrophobicContact CG-CD1 4.44Å; E515-L519 WeakPolarHBondContact O-CG 3.44Å; E515-L519 PolarHBondContact O-N 3.46Å; E515-L519 VanDerWaalsContact O-N 3.1Å; L516-L519 PolarHBondContact O-N 2.97Å; L519-G523 PolarHBondContact O-N 3.39Å; L519-S524 PolarHBondContact O-N 3.45Å; L519-S524 VanDerWaalsContact O-N 3.16Å; L519-I525 HydrophobicContact CB-CD1 3.91Å; L519-I525 HydrophobicContact CB-CG1 4.19Å; L519-I525 HydrophobicContact CD1-CD1 3.83Å; L519-I525 HydrophobicContact CG-CD1 4.49Å; L519-I525 PolarHBondContact O-N 3.37Å
520	I	91.9	Very high	90.8	Very high	35 Å²	35	61.3 Å²	61.3	18%	0.179	34%	0.336	C	S	.	.	H	α-helix	trans	-75.9	-37.4	174.7	-68.1	166.1	0	0	0	110.7	L516 A517 V518 G523 I525 A527 I529 L536	L516-I520 WeakPolarHBondContact O-CB 3.39Å; L516-I520 WeakPolarHBondContact O-CD1 3.26Å; L516-I520 WeakPolarHBondContact O-CG1 3.44Å; L516-I520 PolarHBondContact O-N 3.29Å; A517-I520 PolarHBondContact O-N 2.82Å; V518-I520 VanDerWaalsContact C-N 3.29Å; V518-I520 PolarHBondContact O-N 2.92Å; I520-G523 PolarHBondContact O-N 3.11Å; I520-I525 HydrophobicContact CG1-CB 4.37Å; I520-A527 HydrophobicContact CD1-CB 4.31Å; I520-I529 HydrophobicContact CD1-CD1 3.68Å; I520-I529 HydrophobicContact CD1-CG1 3.67Å; I520-L536 HydrophobicContact CD1-CD1 4.27Å
521	Q	92.1	Very high	90.7	Very high	159 Å²	159	62.6 Å²	62.6	74%	0.743	34%	0.342	S	S	*	.	H	α-helix	trans	-65.5	-41.3	174.7	-72.5	173.6	20.3	0	0	111.5	A517 V518 G523	A517-Q521 VanDerWaalsContact O-CG 3.28Å; A517-Q521 WeakPolarHBondContact O-CG 3.32Å; A517-Q521 PolarHBondContact O-N 3.17Å; V518-Q521 WeakPolarHBondContact O-CB 3.48Å; V518-Q521 PolarHBondContact O-N 3.45Å; V518-Q521 VanDerWaalsContact O-N 3.11Å; Q521-G523 PolarHBondContact O-N 2.86Å
522	D	90.4	Very high	90.6	Very high	113 Å²	113	67.8 Å²	67.8	60%	0.604	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.9	174.9	-66.8	-17.3	0	0	0	112.6	V518 S524	V518-D522 VanDerWaalsContact O-CG 3.32Å; V518-D522 PolarHBondContact O-N 3.43Å; D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 2.9Å
523	G	84.7	Confident	90.5	Very high	48 Å²	48	73.7 Å²	73.7	50%	0.495	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	5.3	178.7	0	0	0	0	0	114.7	L519 I520 Q521 I525	L519-G523 PolarHBondContact O-N 3.39Å; I520-G523 PolarHBondContact O-N 3.11Å; Q521-G523 PolarHBondContact O-N 2.86Å; G523-I525 VanDerWaalsContact C-N 3.32Å
524	S	85	Confident	90.4	Very high	81 Å²	81	73.8 Å²	73.8	57%	0.566	39%	0.386	S	S	*	.	S	Bend	trans	-65.1	-36.6	176.1	-67.4	0	0	0	0	111.7	L519 D522	L519-S524 PolarHBondContact O-N 3.45Å; L519-S524 VanDerWaalsContact O-N 3.16Å; D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 2.9Å
525	I	87.7	Confident	90.4	Very high	8 Å²	8	70.4 Å²	70.4	4%	0.041	37%	0.367	C	S	.	.	S	Bend	trans	-116.1	119.1	178.2	-57.4	179.6	0	0	0	110.1	C487 F490 L516 L519 I520 G523 A527	C487-I525 VanDerWaalsContact SG-CG1 3.51Å; F490-I525 HydrophobicContact CD1-CG2 3.73Å; F490-I525 HydrophobicContact CE1-CG2 3.89Å; L516-I525 HydrophobicContact CD2-CD1 4.13Å; L519-I525 HydrophobicContact CB-CD1 3.91Å; L519-I525 HydrophobicContact CB-CG1 4.19Å; L519-I525 HydrophobicContact CD1-CD1 3.83Å; L519-I525 HydrophobicContact CG-CD1 4.49Å; L519-I525 PolarHBondContact O-N 3.37Å; I520-I525 HydrophobicContact CG1-CB 4.37Å; G523-I525 VanDerWaalsContact C-N 3.32Å; I525-A527 HydrophobicContact CG2-CB 3.67Å; I525-A527 PolarHBondContact O-N 3.43Å; I525-A527 VanDerWaalsContact O-N 3.14Å
526	K	87.5	Confident	90.5	Very high	161 Å²	161	67.7 Å²	67.7	70%	0.7	36%	0.355	S	S	*	.			trans	-86.5	75.9	173.4	-65.5	178.7	-174.4	169.3	0	110.5	L539	K526-L539 PolarHBondContact O-N 2.84Å
527	A	91	Very high	90.5	Very high	0 Å²	0	73 Å²	73	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	170.2	-179.4	0	0	0	0	0	113	F490 I520 I525 L536 R537	F490-A527 HydrophobicContact CE1-CB 3.83Å; F490-A527 HydrophobicContact CZ-CB 3.74Å; I520-A527 HydrophobicContact CD1-CB 4.31Å; I525-A527 HydrophobicContact CG2-CB 3.67Å; I525-A527 PolarHBondContact O-N 3.43Å; I525-A527 VanDerWaalsContact O-N 3.14Å; A527-L536 HydrophobicContact CB-CD1 3.58Å; A527-L536 HydrophobicContact CB-CD2 4.42Å; A527-L536 HydrophobicContact CB-CG 3.9Å; A527-R537 CarbonylContact C-O 3.54Å; A527-R537 VanDerWaalsContact CA-O 3.24Å; A527-R537 WeakPolarHBondContact CA-O 3.45Å; A527-R537 WeakPolarHBondContact CB-O 3.15Å
528	R	90.9	Very high	90.5	Very high	140 Å²	140	73.6 Å²	73.6	53%	0.528	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130	170.1	-69.7	-69.6	179.9	-99.5	5.5	108.6	R537 L539	R528-R537 PolarHBondContact N-O 2.99Å; R528-R537 PolarHBondContact O-N 3.49Å; R528-L539 HydrophobicContact CG-CB 4.39Å; R528-L539 HydrophobicContact CG-CD1 3.83Å
529	I	92.6	Very high	90.2	Very high	57 Å²	57	72.7 Å²	72.7	29%	0.292	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.7	177	-60.2	167.6	0	0	0	107.9	L498 L516 A517 I520 L536	L498-I529 HydrophobicContact CD1-CG2 4.24Å; L516-I529 HydrophobicContact CB-CD1 4.04Å; A517-I529 HydrophobicContact CB-CD1 4.41Å; I520-I529 HydrophobicContact CD1-CD1 3.68Å; I520-I529 HydrophobicContact CD1-CG1 3.67Å; I529-L536 HydrophobicContact CG1-CD1 3.64Å
530	D	93	Very high	89.9	Confident	42 Å²	42	78.4 Å²	78.4	23%	0.225	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	93.6	167.8	-177.6	-15	0	0	0	107.9	H532 K533 Q534 L535	D530-H532 VanDerWaalsContact C-N 3.31Å; D530-H532 PolarHBondContact O-N 2.99Å; D530-H532 PolarHBondContact OD1-N 2.88Å; D530-K533 PolarHBondContact OD1-N 3.03Å; D530-K533 WeakPolarHBondContact OD2-CD 3.17Å; D530-K533 WeakPolarHBondContact OD2-CG 3.37Å; D530-Q534 VanDerWaalsContact O-CA 3.29Å; D530-Q534 WeakPolarHBondContact O-CA 3.44Å; D530-Q534 PolarHBondContact O-N 3.43Å; D530-L535 HydrophobicContact CB-CB 4.44Å; D530-L535 WeakPolarHBondContact CB-O 3.24Å; D530-L535 PolarHBondContact N-O 3.18Å; D530-L535 PolarHBondContact O-N 3.2Å
531	S	90.1	Very high	89.4	Confident	76 Å²	76	80.6 Å²	80.6	53%	0.531	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-26.1	-178	57.3	0	0	0	0	113.1	Q534	S531-Q534 PolarHBondContact O-NE2 3.38Å
532	H	90.2	Very high	89.3	Confident	168 Å²	168	77.2 Å²	77.2	78%	0.778	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-43	177.5	-178.9	-80.3	0	0	0	111	D530	D530-H532 VanDerWaalsContact C-N 3.31Å; D530-H532 PolarHBondContact O-N 2.99Å; D530-H532 PolarHBondContact OD1-N 2.88Å
533	K	89.5	Confident	89.2	Confident	124 Å²	124	77.8 Å²	77.8	54%	0.539	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.9	178	-61.4	-173.7	-176.7	173.8	0	113.7	D530 L535	D530-K533 PolarHBondContact OD1-N 3.03Å; D530-K533 WeakPolarHBondContact OD2-CD 3.17Å; D530-K533 WeakPolarHBondContact OD2-CG 3.37Å; K533-L535 VanDerWaalsContact C-N 3.31Å; K533-L535 HydrophobicContact CB-CB 4.49Å; K533-L535 HydrophobicContact CB-CD1 3.88Å; K533-L535 HydrophobicContact CB-CG 4.12Å; K533-L535 HydrophobicContact CD-CD1 4.42Å; K533-L535 PolarHBondContact O-N 3.49Å
534	Q	90.3	Very high	89.6	Confident	44 Å²	44	83.5 Å²	83.5	21%	0.206	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	43	-175.4	-67.3	-66.6	-37.8	0	0	112.4	L498 E513 D530 S531	L498-Q534 HydrophobicContact CB-CB 4.42Å; L498-Q534 WeakPolarHBondContact CB-O 3.46Å; L498-Q534 WeakPolarHBondContact CG-O 3.41Å; L498-Q534 PolarHBondContact N-O 3.46Å; E513-Q534 PolarHBondContact OE1-NE2 3.48Å; E513-Q534 PolarHBondContact OE1-OE1 3.19Å; D530-Q534 VanDerWaalsContact O-CA 3.29Å; D530-Q534 WeakPolarHBondContact O-CA 3.44Å; D530-Q534 PolarHBondContact O-N 3.43Å; S531-Q534 PolarHBondContact O-NE2 3.38Å
535	L	93.3	Very high	90	Very high	42 Å²	42	83.2 Å²	83.2	22%	0.22	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136	-177.6	-69.5	170.3	0	0	0	111.3	A496 D497 D530 K533	A496-L535 CarbonylContact O-C 3.48Å; A496-L535 WeakPolarHBondContact O-CA 3.47Å; D497-L535 HydrophobicContact CB-CD2 4.28Å; D530-L535 HydrophobicContact CB-CB 4.44Å; D530-L535 WeakPolarHBondContact CB-O 3.24Å; D530-L535 PolarHBondContact N-O 3.18Å; D530-L535 PolarHBondContact O-N 3.2Å; K533-L535 VanDerWaalsContact C-N 3.31Å; K533-L535 HydrophobicContact CB-CB 4.49Å; K533-L535 HydrophobicContact CB-CD1 3.88Å; K533-L535 HydrophobicContact CB-CG 4.12Å; K533-L535 HydrophobicContact CD-CD1 4.42Å; K533-L535 PolarHBondContact O-N 3.49Å
536	L	92.4	Very high	90.2	Very high	1 Å²	1	85.3 Å²	85.3	1%	0.005	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	113.2	167.4	-173.4	68.6	0	0	0	109	F490 S495 A496 L498 L516 I520 A527 I529	F490-L536 HydrophobicContact CD2-CD2 3.53Å; F490-L536 HydrophobicContact CD2-CG 4.18Å; F490-L536 HydrophobicContact CE2-CB 4.29Å; F490-L536 HydrophobicContact CE2-CD2 3.57Å; F490-L536 HydrophobicContact CE2-CG 3.68Å; F490-L536 HydrophobicContact CG-CD2 4.11Å; F490-L536 HydrophobicContact CZ-CD2 4.16Å; F490-L536 HydrophobicContact CZ-CG 4.1Å; S495-L536 CarbonylContact C-O 3.54Å; S495-L536 VanDerWaalsContact CA-O 3.3Å; S495-L536 WeakPolarHBondContact CA-O 3.28Å; A496-L536 PolarHBondContact N-O 3.4Å; A496-L536 PolarHBondContact O-N 3.44Å; L498-L536 HydrophobicContact CD2-CB 4.13Å; L516-L536 HydrophobicContact CD1-CD2 4.17Å; L516-L536 HydrophobicContact CD2-CD2 4.27Å; I520-L536 HydrophobicContact CD1-CD1 4.27Å; A527-L536 HydrophobicContact CB-CD1 3.58Å; A527-L536 HydrophobicContact CB-CD2 4.42Å; A527-L536 HydrophobicContact CB-CG 3.9Å; I529-L536 HydrophobicContact CG1-CD1 3.64Å
537	R	91.2	Very high	90.5	Very high	113 Å²	113	80.9 Å²	80.9	43%	0.426	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.3	180	-63.9	179.1	179.7	-164.6	-7.2	110.6	A527 R528 L539	A527-R537 CarbonylContact C-O 3.54Å; A527-R537 VanDerWaalsContact CA-O 3.24Å; A527-R537 WeakPolarHBondContact CA-O 3.45Å; A527-R537 WeakPolarHBondContact CB-O 3.15Å; R528-R537 PolarHBondContact N-O 2.99Å; R528-R537 PolarHBondContact O-N 3.49Å; R537-L539 PolarHBondContact O-N 2.99Å
538	V	91.6	Very high	90.7	Very high	43 Å²	43	86.4 Å²	86.4	26%	0.261	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	136.4	172.3	176.8	0	0	0	0	109.4	F490 Y493 S494 D540	F490-V538 HydrophobicContact CE1-CG2 3.6Å; F490-V538 HydrophobicContact CE2-CG2 4.16Å; F490-V538 HydrophobicContact CZ-CB 4.2Å; F490-V538 HydrophobicContact CZ-CG2 3.28Å; Y493-V538 VanDerWaalsContact O-CG2 3.23Å; Y493-V538 WeakPolarHBondContact O-CG2 2.99Å; S494-V538 WeakPolarHBondContact O-CG2 3.24Å; S494-V538 PolarHBondContact O-N 3.25Å; V538-D540 WeakPolarHBondContact CG1-OD1 3.44Å; V538-D540 PolarHBondContact O-N 3.14Å
539	L	88.2	Confident	90.9	Very high	57 Å²	57	82.1 Å²	82.1	30%	0.298	42%	0.419	S	S	.	.			trans	-82.9	90.4	171.8	-178.7	72.8	0	0	0	108.8	K526 R528 R537 V541	K526-L539 PolarHBondContact O-N 2.84Å; R528-L539 HydrophobicContact CG-CB 4.39Å; R528-L539 HydrophobicContact CG-CD1 3.83Å; R537-L539 PolarHBondContact O-N 2.99Å; L539-V541 HydrophobicContact CD1-CG2 4.41Å; L539-V541 HydrophobicContact CD2-CG2 3.65Å; L539-V541 HydrophobicContact CG-CG2 3.67Å; L539-V541 PolarHBondContact O-N 2.77Å
540	D	83.4	Confident	91	Very high	134 Å²	134	87 Å²	87	72%	0.717	43%	0.434	S	S	*	.			trans	-76.1	90.8	170.1	-66.6	-34.3	0	0	0	109.2	V538	V538-D540 WeakPolarHBondContact CG1-OD1 3.44Å; V538-D540 PolarHBondContact O-N 3.14Å
541	V	82.9	Confident	91.2	Very high	81 Å²	81	87.3 Å²	87.3	49%	0.491	44%	0.442	S	S	.	.			trans	-80.6	124	168.7	-173.8	0	0	0	0	107.9	L539 Q543 L546	L539-V541 HydrophobicContact CD1-CG2 4.41Å; L539-V541 HydrophobicContact CD2-CG2 3.65Å; L539-V541 HydrophobicContact CG-CG2 3.67Å; L539-V541 PolarHBondContact O-N 2.77Å; V541-Q543 PolarHBondContact O-N 3.34Å; V541-L546 HydrophobicContact CG1-CB 4.36Å
542	D	88.6	Confident	91.5	Very high	88 Å²	88	87.7 Å²	87.7	47%	0.471	44%	0.441	S	S	.	.			trans	-54.5	115.7	173.3	177.9	12.8	0	0	0	110.4	R544 C545 L546	D542-R544 PolarHBondContact O-N 3.47Å; D542-R544 WeakPolarHBondContact OD1-CB 3.35Å; D542-R544 PolarHBondContact OD1-N 3.44Å; D542-C545 HydrophobicContact CB-CB 4.14Å; D542-C545 PolarHBondContact O-N 3.35Å; D542-C545 VanDerWaalsContact O-N 3.11Å; D542-C545 PolarHBondContact OD2-SG 2.94Å; D542-L546 PolarHBondContact O-N 3Å
543	Q	89.8	Confident	91.8	Very high	125 Å²	125	89 Å²	89	58%	0.584	44%	0.439	S	S	*	.	H	α-helix	trans	-56.2	-34	-179.2	-175.2	66.7	7.1	0	0	110.9	V541 L546 T547	V541-Q543 PolarHBondContact O-N 3.34Å; Q543-L546 PolarHBondContact O-N 2.95Å; Q543-T547 VanDerWaalsContact O-CG2 3.25Å; Q543-T547 WeakPolarHBondContact O-CG2 3.34Å; Q543-T547 PolarHBondContact O-N 3.34Å; Q543-T547 PolarHBondContact O-OG1 3.24Å
544	R	93.1	Very high	92.2	Very high	168 Å²	168	88.4 Å²	88.4	63%	0.634	44%	0.441	S	S	*	.	H	α-helix	trans	-63	-55.1	176.4	-175.1	177.1	176.9	133.9	4.4	110.4	D542 L546 T547 F548	D542-R544 PolarHBondContact O-N 3.47Å; D542-R544 WeakPolarHBondContact OD1-CB 3.35Å; D542-R544 PolarHBondContact OD1-N 3.44Å; R544-L546 VanDerWaalsContact C-N 3.28Å; R544-L546 PolarHBondContact O-N 3.38Å; R544-T547 PolarHBondContact O-N 2.95Å; R544-T547 PolarHBondContact O-OG1 3.35Å; R544-F548 HydrophobicContact CG-CD2 3.72Å; R544-F548 HydrophobicContact CG-CE2 3.46Å; R544-F548 VanDerWaalsContact CG-CE2 3.46Å; R544-F548 WeakPolarHBondContact O-CD2 3.09Å; R544-F548 PolarHBondContact O-N 2.81Å
545	C	93	Very high	92.5	Very high	76 Å²	76	90.8 Å²	90.8	51%	0.514	46%	0.459	S	S	.	.	H	α-helix	trans	-56	-41.6	177.2	-67.6	0	0	0	0	112.4	D542 F548 A549	D542-C545 HydrophobicContact CB-CB 4.14Å; D542-C545 PolarHBondContact O-N 3.35Å; D542-C545 VanDerWaalsContact O-N 3.11Å; D542-C545 PolarHBondContact OD2-SG 2.94Å; C545-F548 PolarHBondContact O-N 3.17Å; C545-A549 WeakPolarHBondContact O-CB 3.26Å; C545-A549 PolarHBondContact O-N 2.83Å
546	L	91.4	Very high	92.8	Very high	52 Å²	52	92.7 Å²	92.7	27%	0.272	47%	0.469	S	S	.	.	H	α-helix	trans	-63.4	-44.8	177.2	-177.6	65.4	0	0	0	112.5	V541 D542 Q543 R544 A549 R550	V541-L546 HydrophobicContact CG1-CB 4.36Å; D542-L546 PolarHBondContact O-N 3Å; Q543-L546 PolarHBondContact O-N 2.95Å; R544-L546 VanDerWaalsContact C-N 3.28Å; R544-L546 PolarHBondContact O-N 3.38Å; L546-A549 PolarHBondContact O-N 3.33Å; L546-R550 HydrophobicContact CD1-CG 4.44Å; L546-R550 WeakPolarHBondContact O-CB 3.04Å; L546-R550 WeakPolarHBondContact O-CG 3.29Å; L546-R550 PolarHBondContact O-N 3.14Å
547	T	93.5	Very high	93	Very high	67 Å²	67	96.9 Å²	96.9	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-42.6	177.7	56	0	0	0	0	112	Q543 R544 R550 A551	Q543-T547 VanDerWaalsContact O-CG2 3.25Å; Q543-T547 WeakPolarHBondContact O-CG2 3.34Å; Q543-T547 PolarHBondContact O-N 3.34Å; Q543-T547 PolarHBondContact O-OG1 3.24Å; R544-T547 PolarHBondContact O-N 2.95Å; R544-T547 PolarHBondContact O-OG1 3.35Å; T547-R550 PolarHBondContact O-N 3.07Å; T547-A551 WeakPolarHBondContact O-CB 3.5Å; T547-A551 PolarHBondContact O-N 3.43Å
548	F	95.9	Very high	93.3	Very high	116 Å²	116	99.3 Å²	99.3	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-47.2	174.6	-80.2	-66.6	0	0	0	112.1	R544 C545 R550 A551 V552	R544-F548 HydrophobicContact CG-CD2 3.72Å; R544-F548 HydrophobicContact CG-CE2 3.46Å; R544-F548 VanDerWaalsContact CG-CE2 3.46Å; R544-F548 WeakPolarHBondContact O-CD2 3.09Å; R544-F548 PolarHBondContact O-N 2.81Å; C545-F548 PolarHBondContact O-N 3.17Å; F548-R550 VanDerWaalsContact C-N 3.34Å; F548-R550 PolarHBondContact O-N 2.78Å; F548-A551 PolarHBondContact O-N 2.91Å; F548-V552 WeakPolarHBondContact O-CG2 3.35Å; F548-V552 PolarHBondContact O-N 3.01Å
549	A	95.1	Very high	93.5	Very high	50 Å²	50	102.6 Å²	102.6	41%	0.413	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-41	178.7	0	0	0	0	0	112.3	C545 L546 R553	C545-A549 WeakPolarHBondContact O-CB 3.26Å; C545-A549 PolarHBondContact O-N 2.83Å; L546-A549 PolarHBondContact O-N 3.33Å; A549-R553 WeakPolarHBondContact O-CG 3.31Å; A549-R553 PolarHBondContact O-N 3.25Å; A549-R553 VanDerWaalsContact O-N 3.07Å
550	R	94.8	Very high	93.9	Very high	159 Å²	159	104.7 Å²	104.7	60%	0.6	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-42.6	174.4	-74.9	177.9	-179.6	-178.1	-0.8	112.1	L546 T547 F548 R553 L554	L546-R550 HydrophobicContact CD1-CG 4.44Å; L546-R550 WeakPolarHBondContact O-CB 3.04Å; L546-R550 WeakPolarHBondContact O-CG 3.29Å; L546-R550 PolarHBondContact O-N 3.14Å; T547-R550 PolarHBondContact O-N 3.07Å; F548-R550 VanDerWaalsContact C-N 3.34Å; F548-R550 PolarHBondContact O-N 2.78Å; R550-R553 PolarHBondContact O-N 3.41Å; R550-L554 WeakPolarHBondContact O-CB 3.47Å; R550-L554 PolarHBondContact O-N 2.99Å
551	A	97	Very high	94.6	Very high	49 Å²	49	105.6 Å²	105.6	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-44.5	177.4	0	0	0	0	0	111.7	T547 F548 L554 V555	T547-A551 WeakPolarHBondContact O-CB 3.5Å; T547-A551 PolarHBondContact O-N 3.43Å; F548-A551 PolarHBondContact O-N 2.91Å; A551-L554 PolarHBondContact O-N 3.48Å; A551-V555 VanDerWaalsContact O-CG2 3.28Å; A551-V555 WeakPolarHBondContact O-CG2 3.35Å; A551-V555 PolarHBondContact O-N 2.52Å
552	V	96.9	Very high	95.3	Very high	84 Å²	84	103.9 Å²	103.9	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-47	176.2	173.3	0	0	0	0	111.1	F548 L554 V555 D556	F548-V552 WeakPolarHBondContact O-CG2 3.35Å; F548-V552 PolarHBondContact O-N 3.01Å; V552-L554 VanDerWaalsContact C-N 3.34Å; V552-L554 PolarHBondContact O-N 3.42Å; V552-V555 PolarHBondContact O-N 2.91Å; V552-D556 PolarHBondContact O-N 2.98Å
553	R	96.7	Very high	95.7	Very high	196 Å²	196	105.1 Å²	105.1	74%	0.74	51%	0.507	S	S	*	.	H	α-helix	trans	-58.8	-43.2	176.3	-74.3	-178.8	-179.2	-167.9	0.2	112.7	A549 R550 V555 D556 E557	A549-R553 WeakPolarHBondContact O-CG 3.31Å; A549-R553 PolarHBondContact O-N 3.25Å; A549-R553 VanDerWaalsContact O-N 3.07Å; R550-R553 PolarHBondContact O-N 3.41Å; R553-V555 VanDerWaalsContact C-N 3.34Å; R553-D556 PolarHBondContact O-N 3.16Å; R553-E557 WeakPolarHBondContact O-CB 3.4Å; R553-E557 PolarHBondContact O-N 2.98Å
554	L	97.3	Very high	96	Very high	111 Å²	111	102.8 Å²	102.8	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-63.6	-40.6	177.5	-177.9	67.8	0	0	0	111.6	R550 A551 V552 E557 Y558	R550-L554 WeakPolarHBondContact O-CB 3.47Å; R550-L554 PolarHBondContact O-N 2.99Å; A551-L554 PolarHBondContact O-N 3.48Å; V552-L554 VanDerWaalsContact C-N 3.34Å; V552-L554 PolarHBondContact O-N 3.42Å; L554-E557 PolarHBondContact O-N 3.15Å; L554-Y558 VanDerWaalsContact O-CB 3.23Å; L554-Y558 WeakPolarHBondContact O-CB 3.26Å; L554-Y558 PolarHBondContact O-N 2.86Å
555	V	97.4	Very high	96.1	Very high	94 Å²	94	99 Å²	99	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-64.2	-44.2	176.8	168.8	0	0	0	0	111	A551 V552 R553 Y558 K559	A551-V555 VanDerWaalsContact O-CG2 3.28Å; A551-V555 WeakPolarHBondContact O-CG2 3.35Å; A551-V555 PolarHBondContact O-N 2.52Å; V552-V555 PolarHBondContact O-N 2.91Å; R553-V555 VanDerWaalsContact C-N 3.34Å; V555-Y558 PolarHBondContact O-N 3.39Å; V555-K559 VanDerWaalsContact O-CB 3.3Å; V555-K559 WeakPolarHBondContact O-CB 3Å; V555-K559 PolarHBondContact O-N 3.36Å
556	D	97.6	Very high	96.3	Very high	83 Å²	83	100.4 Å²	100.4	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-64.6	-42.9	177.6	-73.9	-28.8	0	0	0	111.9	V552 R553 K559 N560	V552-D556 PolarHBondContact O-N 2.98Å; R553-D556 PolarHBondContact O-N 3.16Å; D556-K559 PolarHBondContact O-N 3.43Å; D556-N560 WeakPolarHBondContact O-CB 3.12Å; D556-N560 VanDerWaalsContact O-CG 3.27Å; D556-N560 PolarHBondContact O-N 3.2Å; D556-N560 PolarHBondContact O-ND2 3.26Å
557	E	97.1	Very high	96.4	Very high	88 Å²	88	103.1 Å²	103.1	41%	0.411	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-44.9	174.9	-176.6	174.9	-158.6	0	0	111.6	R553 L554 K559 N560 R561	R553-E557 WeakPolarHBondContact O-CB 3.4Å; R553-E557 PolarHBondContact O-N 2.98Å; L554-E557 PolarHBondContact O-N 3.15Å; E557-K559 PolarHBondContact O-N 3.42Å; E557-N560 PolarHBondContact O-N 3.03Å; E557-R561 HydrophobicContact CG-CG 4.46Å; E557-R561 WeakPolarHBondContact O-CB 3.35Å; E557-R561 WeakPolarHBondContact O-CG 3.36Å; E557-R561 PolarHBondContact O-N 2.83Å; E557-R561 IonicContact OE1-CZ 3.51Å; E557-R561 IonicContact OE1-NE 2.8Å; E557-R561 PolarHBondContact OE1-NE 2.75Å; E557-R561 IonicContact OE1-NH2 3.56Å; E557-R561 PolarHBondContact OE1-NH2 2.74Å; E557-R561 IonicContact OE2-NH2 3.41Å
558	Y	97	Very high	96.4	Very high	164 Å²	164	109 Å²	109	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-63.3	-41.4	177.7	-174.5	-96.2	0	0	0	111.9	L554 V555 R561 T562	L554-Y558 VanDerWaalsContact O-CB 3.23Å; L554-Y558 WeakPolarHBondContact O-CB 3.26Å; L554-Y558 PolarHBondContact O-N 2.86Å; V555-Y558 PolarHBondContact O-N 3.39Å; Y558-R561 PolarHBondContact O-N 3.18Å; Y558-T562 WeakPolarHBondContact O-CB 3.38Å; Y558-T562 PolarHBondContact O-N 3.03Å; Y558-T562 PolarHBondContact O-OG1 3.36Å
559	K	97.4	Very high	96.2	Very high	112 Å²	112	108.3 Å²	108.3	49%	0.487	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-48.7	174.4	179.8	-176.4	173.8	-175.8	0	111	V555 D556 E557 T562 H563	V555-K559 VanDerWaalsContact O-CB 3.3Å; V555-K559 WeakPolarHBondContact O-CB 3Å; V555-K559 PolarHBondContact O-N 3.36Å; D556-K559 PolarHBondContact O-N 3.43Å; E557-K559 PolarHBondContact O-N 3.42Å; K559-T562 PolarHBondContact O-N 2.99Å; K559-H563 WeakPolarHBondContact O-CB 3.49Å; K559-H563 PolarHBondContact O-CD2 2.89Å; K559-H563 PolarHBondContact O-N 2.86Å
560	N	96.7	Very high	96.1	Very high	101 Å²	101	108 Å²	108	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-46	178.2	-71.6	-20.8	0	0	0	111.8	D556 E557 T562 H563 S564	D556-N560 WeakPolarHBondContact O-CB 3.12Å; D556-N560 VanDerWaalsContact O-CG 3.27Å; D556-N560 PolarHBondContact O-N 3.2Å; D556-N560 PolarHBondContact O-ND2 3.26Å; E557-N560 PolarHBondContact O-N 3.03Å; N560-T562 VanDerWaalsContact C-N 3.34Å; N560-T562 PolarHBondContact O-N 2.95Å; N560-H563 PolarHBondContact O-N 3.49Å; N560-S564 PolarHBondContact O-N 3.5Å; N560-S564 PolarHBondContact O-OG 2.71Å
561	R	97.1	Very high	95.9	Very high	154 Å²	154	104 Å²	104	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-60.3	-41.9	175.8	-73.3	176.2	-179	-178.3	-1.8	112	E557 Y558 S564 L565	E557-R561 HydrophobicContact CG-CG 4.46Å; E557-R561 WeakPolarHBondContact O-CB 3.35Å; E557-R561 WeakPolarHBondContact O-CG 3.36Å; E557-R561 PolarHBondContact O-N 2.83Å; E557-R561 IonicContact OE1-CZ 3.51Å; E557-R561 IonicContact OE1-NE 2.8Å; E557-R561 PolarHBondContact OE1-NE 2.75Å; E557-R561 IonicContact OE1-NH2 3.56Å; E557-R561 PolarHBondContact OE1-NH2 2.74Å; E557-R561 IonicContact OE2-NH2 3.41Å; Y558-R561 PolarHBondContact O-N 3.18Å; R561-S564 PolarHBondContact O-N 3.19Å; R561-L565 WeakPolarHBondContact O-CB 3.47Å; R561-L565 PolarHBondContact O-N 3.33Å
562	T	97.5	Very high	95.6	Very high	44 Å²	44	104.7 Å²	104.7	27%	0.27	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-44.6	178.4	-57.7	0	0	0	0	111.6	Y558 K559 N560 S564 L565 I566	Y558-T562 WeakPolarHBondContact O-CB 3.38Å; Y558-T562 PolarHBondContact O-N 3.03Å; Y558-T562 PolarHBondContact O-OG1 3.36Å; K559-T562 PolarHBondContact O-N 2.99Å; N560-T562 VanDerWaalsContact C-N 3.34Å; N560-T562 PolarHBondContact O-N 2.95Å; T562-S564 PolarHBondContact O-N 3.28Å; T562-L565 PolarHBondContact O-N 2.68Å; T562-I566 HydrophobicContact CG2-CD1 3.89Å; T562-I566 HydrophobicContact CG2-CG1 4.42Å; T562-I566 VanDerWaalsContact O-CG1 3.29Å; T562-I566 WeakPolarHBondContact O-CG1 3.24Å; T562-I566 PolarHBondContact O-N 3.27Å
563	H	97.5	Very high	95.3	Very high	114 Å²	114	111 Å²	111	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-59.6	-46.2	175.2	-79.9	-144.1	0	0	0	111.5	K559 N560 L565 I566 L567	K559-H563 WeakPolarHBondContact O-CB 3.49Å; K559-H563 PolarHBondContact O-CD2 2.89Å; K559-H563 PolarHBondContact O-N 2.86Å; N560-H563 PolarHBondContact O-N 3.49Å; H563-L565 VanDerWaalsContact C-N 3.32Å; H563-L565 PolarHBondContact O-N 3.21Å; H563-I566 PolarHBondContact O-N 3.11Å; H563-L567 WeakPolarHBondContact O-CB 3.21Å; H563-L567 PolarHBondContact O-N 3.43Å
564	S	96.1	Very high	94.9	Very high	77 Å²	77	108.5 Å²	108.5	54%	0.538	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-39.4	175.3	-65.2	0	0	0	0	112.4	N560 R561 T562 L567 R568	N560-S564 PolarHBondContact O-N 3.5Å; N560-S564 PolarHBondContact O-OG 2.71Å; R561-S564 PolarHBondContact O-N 3.19Å; T562-S564 PolarHBondContact O-N 3.28Å; S564-L567 PolarHBondContact O-N 2.86Å; S564-R568 WeakPolarHBondContact O-CB 3.44Å; S564-R568 PolarHBondContact O-N 3.39Å
565	L	95.8	Very high	94.3	Very high	89 Å²	89	111.8 Å²	111.8	47%	0.466	54%	0.541	S	S	.	.	H	α-helix	trans	-66.5	-45.4	177.2	-174.9	66.5	0	0	0	112	R561 T562 H563 L567 R568 M569	R561-L565 WeakPolarHBondContact O-CB 3.47Å; R561-L565 PolarHBondContact O-N 3.33Å; T562-L565 PolarHBondContact O-N 2.68Å; H563-L565 VanDerWaalsContact C-N 3.32Å; H563-L565 PolarHBondContact O-N 3.21Å; L565-L567 PolarHBondContact O-N 2.96Å; L565-L567 VanDerWaalsContact C-N 3.31Å; L565-R568 PolarHBondContact O-N 3.46Å; L565-R568 WeakPolarHBondContact O-CB 3.42Å; L565-M569 HydrophobicContact CD1-CE 4.14Å; L565-M569 HydrophobicContact CD2-CE 3.97Å; L565-M569 HydrophobicContact CG-CE 3.87Å; L565-M569 HydrophobicContact CG-SD 4.48Å; L565-M569 WeakPolarHBondContact O-CG 2.95Å; L565-M569 PolarHBondContact O-N 2.87Å
566	I	96.3	Very high	93.5	Very high	104 Å²	104	112.3 Å²	112.3	53%	0.533	54%	0.54	S	S	.	.	H	α-helix	trans	-59.9	-44.4	176.6	-69.3	166.9	0	0	0	110.1	T562 H563 M569 A570	T562-I566 HydrophobicContact CG2-CD1 3.89Å; T562-I566 HydrophobicContact CG2-CG1 4.42Å; T562-I566 VanDerWaalsContact O-CG1 3.29Å; T562-I566 WeakPolarHBondContact O-CG1 3.24Å; T562-I566 PolarHBondContact O-N 3.27Å; H563-I566 PolarHBondContact O-N 3.11Å; I566-M569 PolarHBondContact O-N 3.42Å; I566-A570 WeakPolarHBondContact O-CB 3.31Å; I566-A570 PolarHBondContact O-N 2.92Å
567	L	93.8	Very high	92.5	Very high	110 Å²	110	113.4 Å²	113.4	58%	0.576	55%	0.549	S	S	*	.	H	α-helix	trans	-61.3	-45.7	176	-174.5	67.8	0	0	0	111.1	H563 S564 L565 M569 A570 L571	H563-L567 WeakPolarHBondContact O-CB 3.21Å; H563-L567 PolarHBondContact O-N 3.43Å; S564-L567 PolarHBondContact O-N 2.86Å; L565-L567 PolarHBondContact O-N 2.96Å; L565-L567 VanDerWaalsContact C-N 3.31Å; L567-M569 PolarHBondContact O-N 3.29Å; L567-M569 VanDerWaalsContact C-N 3.32Å; L567-A570 PolarHBondContact O-N 3.17Å; L567-L571 HydrophobicContact CG-CD1 4.36Å; L567-L571 WeakPolarHBondContact O-CG 3.39Å; L567-L571 PolarHBondContact O-N 3.23Å
568	R	94	Very high	91.5	Very high	189 Å²	189	116 Å²	116	71%	0.713	57%	0.571	S	S	*	*	H	α-helix	trans	-59.5	-41.4	176	-171.7	178.9	-179.7	113.3	-1.4	111.9	S564 L565 A572	S564-R568 WeakPolarHBondContact O-CB 3.44Å; S564-R568 PolarHBondContact O-N 3.39Å; L565-R568 PolarHBondContact O-N 3.46Å; L565-R568 WeakPolarHBondContact O-CB 3.42Å; R568-A572 WeakPolarHBondContact O-CB 3.44Å; R568-A572 PolarHBondContact O-N 2.97Å
569	M	92.1	Very high	90.1	Very high	103 Å²	103	116.9 Å²	116.9	51%	0.507	58%	0.578	S	S	.	*	H	α-helix	trans	-66	-39.6	175.4	-72	-179.9	176.9	0	0	112.2	L565 I566 L567 A572 R573	L565-M569 HydrophobicContact CD1-CE 4.14Å; L565-M569 HydrophobicContact CD2-CE 3.97Å; L565-M569 HydrophobicContact CG-CE 3.87Å; L565-M569 HydrophobicContact CG-SD 4.48Å; L565-M569 WeakPolarHBondContact O-CG 2.95Å; L565-M569 PolarHBondContact O-N 2.87Å; I566-M569 PolarHBondContact O-N 3.42Å; L567-M569 PolarHBondContact O-N 3.29Å; L567-M569 VanDerWaalsContact C-N 3.32Å; M569-A572 PolarHBondContact O-N 3.11Å; M569-R573 WeakPolarHBondContact O-CG 3.28Å; M569-R573 PolarHBondContact O-N 3.09Å
570	A	93	Very high	88.2	Confident	43 Å²	43	116 Å²	116	36%	0.355	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-43.8	176.9	0	0	0	0	0	112	I566 L567 R573 Q574	I566-A570 WeakPolarHBondContact O-CB 3.31Å; I566-A570 PolarHBondContact O-N 2.92Å; L567-A570 PolarHBondContact O-N 3.17Å; A570-R573 PolarHBondContact O-N 3.04Å; A570-Q574 VanDerWaalsContact O-N 3.12Å; A570-Q574 PolarHBondContact O-N 2.8Å
571	L	90.7	Very high	85.7	Confident	74 Å²	74	116.6 Å²	116.6	39%	0.387	59%	0.593	S	S	.	*	H	α-helix	trans	-61.5	-43.4	174	-67.5	173.3	0	0	0	111.5	L567 R573 Q574 K575 L576	L567-L571 HydrophobicContact CG-CD1 4.36Å; L567-L571 WeakPolarHBondContact O-CG 3.39Å; L567-L571 PolarHBondContact O-N 3.23Å; L571-R573 PolarHBondContact O-N 3.21Å; L571-Q574 CarbonylContact O-C 3.59Å; L571-Q574 PolarHBondContact O-N 3.49Å; L571-K575 PolarHBondContact O-N 2.76Å; L571-L576 HydrophobicContact CB-CB 4.41Å; L571-L576 HydrophobicContact CD2-CB 4.37Å; L571-L576 HydrophobicContact CD2-CD1 3.56Å; L571-L576 PolarHBondContact O-N 2.72Å
572	A	89.3	Confident	83.1	Confident	64 Å²	64	120 Å²	120	53%	0.529	61%	0.606	S	S	.	*	H	α-helix	trans	-62.5	-39.6	176.3	0	0	0	0	0	112.5	R568 M569 Q574 K575	R568-A572 WeakPolarHBondContact O-CB 3.44Å; R568-A572 PolarHBondContact O-N 2.97Å; M569-A572 PolarHBondContact O-N 3.11Å; A572-Q574 VanDerWaalsContact C-N 3.31Å; A572-Q574 PolarHBondContact O-N 2.82Å; A572-K575 PolarHBondContact O-N 3.22Å; A572-K575 VanDerWaalsContact O-N 3.08Å
573	R	90.3	Very high	80.4	Confident	217 Å²	217	125.3 Å²	125.3	82%	0.819	63%	0.633	S	S	*	*	H	α-helix	trans	-62.8	-36	174.6	-76.8	175.9	179.4	-175.2	0.7	112.6	M569 A570 L571 K575	M569-R573 WeakPolarHBondContact O-CG 3.28Å; M569-R573 PolarHBondContact O-N 3.09Å; A570-R573 PolarHBondContact O-N 3.04Å; L571-R573 PolarHBondContact O-N 3.21Å; R573-K575 PolarHBondContact O-N 3.43Å
574	Q	89.6	Confident	77.7	Confident	144 Å²	144	126.2 Å²	126.2	67%	0.673	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	6.8	175.8	-68.1	-176.8	-8.3	0	0	113.3	A570 L571 A572 L576	A570-Q574 VanDerWaalsContact O-N 3.12Å; A570-Q574 PolarHBondContact O-N 2.8Å; L571-Q574 CarbonylContact O-C 3.59Å; L571-Q574 PolarHBondContact O-N 3.49Å; A572-Q574 VanDerWaalsContact C-N 3.31Å; A572-Q574 PolarHBondContact O-N 2.82Å; Q574-L576 HydrophobicContact CB-CD1 4.1Å; Q574-L576 HydrophobicContact CB-CG 4.07Å; Q574-L576 PolarHBondContact O-N 2.65Å; Q574-L576 VanDerWaalsContact O-N 3.15Å
575	K	83.7	Confident	75.1	Confident	180 Å²	180	130.6 Å²	130.6	78%	0.783	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.7	28.3	-175.3	-59.2	-178.5	179	178.7	0	113	L571 A572 R573 T577	L571-K575 PolarHBondContact O-N 2.76Å; A572-K575 PolarHBondContact O-N 3.22Å; A572-K575 VanDerWaalsContact O-N 3.08Å; R573-K575 PolarHBondContact O-N 3.43Å; K575-T577 PolarHBondContact O-N 3.19Å
576	L	80.8	Confident	72.5	Confident	105 Å²	105	133.1 Å²	133.1	55%	0.55	67%	0.671	S	S	.	*			trans	-78.2	68.4	171	-66.4	171	0	0	0	108.5	L571 Q574	L571-L576 HydrophobicContact CB-CB 4.41Å; L571-L576 HydrophobicContact CD2-CB 4.37Å; L571-L576 HydrophobicContact CD2-CD1 3.56Å; L571-L576 PolarHBondContact O-N 2.72Å; Q574-L576 HydrophobicContact CB-CD1 4.1Å; Q574-L576 HydrophobicContact CB-CG 4.07Å; Q574-L576 PolarHBondContact O-N 2.65Å; Q574-L576 VanDerWaalsContact O-N 3.15Å
577	T	77.5	Confident	69.6	Low	105 Å²	105	134.2 Å²	134.2	64%	0.644	69%	0.685	S	S	*	*			trans	-87.1	127.8	172.4	55	0	0	0	0	108.4	K575 K579	K575-T577 PolarHBondContact O-N 3.19Å; T577-K579 PolarHBondContact O-N 3.27Å
578	V	75.2	Confident	66.8	Low	142 Å²	142	136.1 Å²	136.1	86%	0.861	69%	0.693	S	S	*	*			trans	-61.4	111	165	178.9	0	0	0	0	106.5	S580	V578-S580 VanDerWaalsContact C-N 3.32Å; V578-S580 PolarHBondContact O-N 3.45Å
579	K	68.7	Low	64.3	Low	183 Å²	183	137.5 Å²	137.5	80%	0.796	70%	0.7	S	S	*	*			trans	-64.5	104.3	163.7	-71.5	-178.9	-179.8	178.3	0	104.8	T577 T581	T577-K579 PolarHBondContact O-N 3.27Å; K579-T581 PolarHBondContact O-N 3.38Å
580	S	56.3	Low	61.6	Low	93 Å²	93	141.5 Å²	141.5	65%	0.65	72%	0.717	S	S	*	*			trans	-54.4	109.5	164.4	170.5	0	0	0	0	105.7	V578 R582	V578-S580 VanDerWaalsContact C-N 3.32Å; V578-S580 PolarHBondContact O-N 3.45Å; S580-R582 PolarHBondContact O-N 2.8Å
581	T	45.1	Very low	59.1	Low	114 Å²	114	150.7 Å²	150.7	70%	0.699	74%	0.744	S	S	*	*			trans	-64.4	89	165.2	42	0	0	0	0	105.4	K579 D583	K579-T581 PolarHBondContact O-N 3.38Å; T581-D583 PolarHBondContact O-N 3.34Å
582	R	41.9	Very low	56.5	Low	226 Å²	226	156.1 Å²	156.1	85%	0.853	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	76	167.7	-78.4	179.8	165.5	165.9	-5.2	107.6	S580	S580-R582 PolarHBondContact O-N 2.8Å
583	D	41.3	Very low	54.1	Low	155 Å²	155	162.6 Å²	162.6	83%	0.829	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.7	-6.3	159.4	-82.4	-38.5	0	0	0	112.3	T581	T581-D583 PolarHBondContact O-N 3.34Å
584	D	40.7	Very low	52.3	Low	133 Å²	133	159.9 Å²	159.9	71%	0.711	81%	0.81	S	S	*	*	S	Bend	trans	-126.8	128.1	171.7	-62.3	-54.7	0	0	0	109.9
585	I	41.5	Very low	50.3	Low	169 Å²	169	160.7 Å²	160.7	87%	0.867	82%	0.818	S	S	*	*			trans	106.4	103.5	162	-50.3	154.4	0	0	0	116.2
586	D	41.6	Very low	48.4	Very low	143 Å²	143	159.6 Å²	159.6	77%	0.765	82%	0.82	S	S	*	*			trans	-15.6	148.3	159.2	-82	-48.7	0	0	0	120	M588	D586-M588 PolarHBondContact O-N 2.84Å
587	P	34.7	Very low	46.5	Very low	127 Å²	127	162.8 Å²	162.8	83%	0.825	84%	0.836	S	S	*	*			trans	-80.1	89.7	178.1	34.9	-31.9	0	0	0	110.7
588	M	35.5	Very low	44.6	Very low	150 Å²	150	166.4 Å²	166.4	74%	0.739	85%	0.847	S	S	*	*			trans	-127.8	138.4	162	-94.5	-86.8	-84.9	0	0	108.4	D586	D586-M588 PolarHBondContact O-N 2.84Å
589	Y	40	Very low	42.6	Very low	217 Å²	217	168.1 Å²	168.1	85%	0.851	85%	0.847	S	S	*	*			trans	92.5	64.2	-172.1	-52.2	-68.7	0	0	0	116.9
590	H	35.9	Very low	40.7	Very low	188 Å²	188	167 Å²	167	87%	0.87	85%	0.85	S	S	*	*			trans	-118.7	88.4	149.7	-145.8	31.2	0	0	0	108.9
591	Y	39.9	Very low	39.5	Very low	235 Å²	235	172.7 Å²	172.7	92%	0.922	87%	0.866	S	S	*	*			trans	-158	98.1	160.7	-103.2	-79	0	0	0	108.5
592	M	37.8	Very low	39	Very low	189 Å²	189	177.6 Å²	177.6	93%	0.931	88%	0.879	S	S	*	*			trans	172.9	90.1	142.9	-95.2	-177.3	147.9	0	0	109.8
593	S	37.9	Very low	38.8	Very low	199 Å²	199	173.2 Å²	173.2	100%	1.392	88%	0.882	S	S	*	*			trans	-136.5	0	146.3	-65.8	0	0	0	0	106.7

Retrieved 593 of 593 residues in 1196.4 ms (Link to these results)

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