A0A2K5YAV3_MANLE Loading...

Glutamine rich 1

AlphaFold DB , UniProt , Accession A0A2K5YAV3, Species MANLE (Mandrillus leucophaeus, Drill), Gene QRICH1, Length 777 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	44.6	Very low	236 Å²	236	144.7 Å²	144.7	100%	1.163	77%	0.774	S	S	*	*				0	173.3	0	-77.9	175.6	167.3	0	0	108.7
2	N	31.8	Very low	46.4	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	75%	0.752	S	S	*	*			trans	68.5	77.9	178.1	-58.6	16.3	0	0	0	114.4
3	N	33.4	Very low	47.9	Very low	164 Å²	164	135.3 Å²	135.3	88%	0.877	72%	0.715	S	S	*	*			trans	-98.1	155.6	153	-127.1	-13.4	0	0	0	107.8
4	S	35.1	Very low	49.4	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	69%	0.691	S	S	*	*			trans	66.5	118.8	167.7	-159	0	0	0	0	118.6
5	L	39.7	Very low	51	Low	159 Å²	159	124.7 Å²	124.7	83%	0.832	65%	0.65	S	S	*	*				170.7	86.1	113.2	-93	166.3	0	0	0	111.1
6	E	37.8	Very low	52.5	Low	191 Å²	191	120.8 Å²	120.8	89%	0.893	62%	0.624	S	S	*	*			trans	-155.4	75.7	163	-139.8	167.7	-132.9	0	0	110.3
7	N	44.3	Very low	53.7	Low	158 Å²	158	118.2 Å²	118.2	85%	0.845	62%	0.615	S	S	*	*			trans	-153.5	45.7	174.1	-129	-5.7	0	0	0	110.3	I9	N7-I9 PolarHBondContact O-N 2.8Å; N7-I9 VanDerWaalsContact O-N 3.1Å
8	T	47.9	Very low	54.9	Low	132 Å²	132	113.1 Å²	113.1	81%	0.81	59%	0.587	S	S	*	*			trans	-80.2	90.4	-174.6	-42.4	0	0	0	0	109.8	S10	T8-S10 PolarHBondContact O-N 3.38Å
9	I	57.9	Low	55.9	Low	110 Å²	110	107.6 Å²	107.6	56%	0.564	56%	0.56	S	S	*	*			trans	-55.2	132.8	170.2	-60.5	175.9	0	0	0	108.3	N7 E13	N7-I9 PolarHBondContact O-N 2.8Å; N7-I9 VanDerWaalsContact O-N 3.1Å; I9-E13 HydrophobicContact CG2-CB 3.87Å; I9-E13 HydrophobicContact CG2-CG 4.07Å
10	S	61.1	Low	56.6	Low	62 Å²	62	109 Å²	109	43%	0.434	56%	0.557	S	S	.	*			trans	-64.4	149.2	179.2	68.3	0	0	0	0	110.6	T8 E12 E13 Y14	T8-S10 PolarHBondContact O-N 3.38Å; S10-E12 PolarHBondContact O-N 3.41Å; S10-E13 PolarHBondContact O-N 3.31Å; S10-E13 WeakPolarHBondContact OG-CB 3.47Å; S10-E13 PolarHBondContact OG-N 3.46Å; S10-Y14 PolarHBondContact O-N 3.28Å
11	F	64.6	Low	57.3	Low	111 Å²	111	107.7 Å²	107.7	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-55.9	-40.2	-179.3	179.1	-120	0	0	0	112.3	Y14 I15 P39 L42	F11-Y14 PolarHBondContact O-N 2.8Å; F11-I15 HydrophobicContact CD1-CD1 3.9Å; F11-I15 HydrophobicContact CD2-CD1 4.4Å; F11-I15 HydrophobicContact CE1-CD1 3.5Å; F11-I15 VanDerWaalsContact CE1-CD1 3.5Å; F11-I15 HydrophobicContact CE2-CD1 4.03Å; F11-I15 HydrophobicContact CE2-CG1 4.33Å; F11-I15 HydrophobicContact CG-CD1 4.34Å; F11-I15 HydrophobicContact CZ-CD1 3.57Å; F11-I15 HydrophobicContact CZ-CG1 4.32Å; F11-I15 WeakPolarHBondContact O-CG1 3.4Å; F11-I15 PolarHBondContact O-N 2.78Å; F11-P39 HydrophobicContact CE2-CB 3.62Å; F11-P39 HydrophobicContact CZ-CB 3.73Å; F11-L42 HydrophobicContact CE2-CD1 3.82Å
12	E	66	Low	59.1	Low	109 Å²	109	97.2 Å²	97.2	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-43.6	174.8	-169.3	-164.3	134.4	0	0	112.9	S10 I15 R16	S10-E12 PolarHBondContact O-N 3.41Å; E12-I15 PolarHBondContact O-N 2.88Å; E12-R16 PolarHBondContact O-N 3.33Å; E12-R16 IonicContact OE1-CZ 3.57Å; E12-R16 VanDerWaalsContact OE1-CZ 3.3Å; E12-R16 IonicContact OE1-NH1 2.87Å; E12-R16 PolarHBondContact OE1-NH1 3.1Å; E12-R16 IonicContact OE1-NH2 3.76Å; E12-R16 PolarHBondContact OE1-NH2 2.81Å
13	E	66.4	Low	60.9	Low	58 Å²	58	92.5 Å²	92.5	27%	0.271	49%	0.486	S	S	.	.	H	α-helix	trans	-70.9	-34.6	176.2	-170.2	58.9	-148.9	0	0	111.5	I9 S10 I15 R16 V17 R20	I9-E13 HydrophobicContact CG2-CB 3.87Å; I9-E13 HydrophobicContact CG2-CG 4.07Å; S10-E13 PolarHBondContact O-N 3.31Å; S10-E13 WeakPolarHBondContact OG-CB 3.47Å; S10-E13 PolarHBondContact OG-N 3.46Å; E13-I15 VanDerWaalsContact C-N 3.34Å; E13-R16 PolarHBondContact O-N 3.06Å; E13-R16 IonicContact OE2-CZ 3.22Å; E13-R16 IonicContact OE2-NE 2.82Å; E13-R16 PolarHBondContact OE2-NE 3.17Å; E13-R16 IonicContact OE2-NH2 2.8Å; E13-R16 PolarHBondContact OE2-NH2 2.87Å; E13-V17 WeakPolarHBondContact O-CB 3.38Å; E13-V17 WeakPolarHBondContact O-CG2 3.33Å; E13-V17 PolarHBondContact O-N 3.14Å; E13-R20 IonicContact OE1-NH1 3.21Å
14	Y	68.9	Low	62.5	Low	97 Å²	97	92.8 Å²	92.8	38%	0.38	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-38.8	173.1	-173.5	-113.1	0	0	0	111.8	S10 F11 K18 L42	S10-Y14 PolarHBondContact O-N 3.28Å; F11-Y14 PolarHBondContact O-N 2.8Å; Y14-K18 HydrophobicContact CE1-CG 4.39Å; Y14-K18 WeakPolarHBondContact O-CB 3.48Å; Y14-K18 PolarHBondContact O-N 3.45Å; Y14-L42 HydrophobicContact CD1-CD1 3.71Å; Y14-L42 HydrophobicContact CE1-CB 4.37Å; Y14-L42 HydrophobicContact CE1-CD1 3.73Å
15	I	73.6	Confident	64	Low	15 Å²	15	95.1 Å²	95.1	8%	0.077	48%	0.481	C	S	.	.	H	α-helix	trans	-64.9	-46.2	170.4	-68.6	164.5	0	0	0	111	F11 E12 E13 V17 K18 A19 L34 L42 L74	F11-I15 HydrophobicContact CD1-CD1 3.9Å; F11-I15 HydrophobicContact CD2-CD1 4.4Å; F11-I15 HydrophobicContact CE1-CD1 3.5Å; F11-I15 VanDerWaalsContact CE1-CD1 3.5Å; F11-I15 HydrophobicContact CE2-CD1 4.03Å; F11-I15 HydrophobicContact CE2-CG1 4.33Å; F11-I15 HydrophobicContact CG-CD1 4.34Å; F11-I15 HydrophobicContact CZ-CD1 3.57Å; F11-I15 HydrophobicContact CZ-CG1 4.32Å; F11-I15 WeakPolarHBondContact O-CG1 3.4Å; F11-I15 PolarHBondContact O-N 2.78Å; E12-I15 PolarHBondContact O-N 2.88Å; E13-I15 VanDerWaalsContact C-N 3.34Å; I15-V17 VanDerWaalsContact C-N 3.31Å; I15-V17 PolarHBondContact O-N 3.07Å; I15-K18 PolarHBondContact O-N 3.19Å; I15-K18 VanDerWaalsContact O-N 3.11Å; I15-A19 WeakPolarHBondContact O-CB 3.23Å; I15-A19 PolarHBondContact O-N 2.74Å; I15-L34 HydrophobicContact CD1-CD1 4.11Å; I15-L34 HydrophobicContact CD1-CD2 4.34Å; I15-L34 HydrophobicContact CG1-CD1 4.34Å; I15-L34 HydrophobicContact CG2-CD2 3.85Å; I15-L42 HydrophobicContact CG1-CD1 4.14Å; I15-L42 HydrophobicContact CG1-CD2 4.34Å; I15-L74 HydrophobicContact CG2-CD1 4.04Å; I15-L74 HydrophobicContact CG2-CD2 3.48Å; I15-L74 VanDerWaalsContact CG2-CD2 3.48Å; I15-L74 HydrophobicContact CG2-CG 4.45Å
16	R	74.6	Confident	65.6	Low	62 Å²	62	92.2 Å²	92.2	23%	0.234	46%	0.459	C	S	.	.	H	α-helix	trans	-57.3	-42.9	176.1	-80.6	-163.9	-74.7	-100.7	-7.1	112.3	E12 E13 R20 L74	E12-R16 PolarHBondContact O-N 3.33Å; E12-R16 IonicContact OE1-CZ 3.57Å; E12-R16 VanDerWaalsContact OE1-CZ 3.3Å; E12-R16 IonicContact OE1-NH1 2.87Å; E12-R16 PolarHBondContact OE1-NH1 3.1Å; E12-R16 IonicContact OE1-NH2 3.76Å; E12-R16 PolarHBondContact OE1-NH2 2.81Å; E13-R16 PolarHBondContact O-N 3.06Å; E13-R16 IonicContact OE2-CZ 3.22Å; E13-R16 IonicContact OE2-NE 2.82Å; E13-R16 PolarHBondContact OE2-NE 3.17Å; E13-R16 IonicContact OE2-NH2 2.8Å; E13-R16 PolarHBondContact OE2-NH2 2.87Å; R16-R20 WeakPolarHBondContact O-CG 3.37Å; R16-R20 PolarHBondContact O-N 3.26Å; R16-L74 HydrophobicContact CB-CD1 4.47Å; R16-L74 HydrophobicContact CG-CD1 3.62Å
17	V	73.4	Confident	67.7	Low	77 Å²	77	85.1 Å²	85.1	47%	0.467	43%	0.426	S	S	.	.	H	α-helix	trans	-65.6	-40.3	175.2	170	0	0	0	0	111.4	E13 I15	E13-V17 WeakPolarHBondContact O-CB 3.38Å; E13-V17 WeakPolarHBondContact O-CG2 3.33Å; E13-V17 PolarHBondContact O-N 3.14Å; I15-V17 VanDerWaalsContact C-N 3.31Å; I15-V17 PolarHBondContact O-N 3.07Å
18	K	74	Confident	69.3	Low	25 Å²	25	83.9 Å²	83.9	11%	0.109	41%	0.413	C	S	.	.	H	α-helix	trans	-66.8	-45.9	176.6	-89	-82.9	-179	155	0	112.8	Y14 I15 R20 S21 V22 F30 L42 F45	Y14-K18 HydrophobicContact CE1-CG 4.39Å; Y14-K18 WeakPolarHBondContact O-CB 3.48Å; Y14-K18 PolarHBondContact O-N 3.45Å; I15-K18 PolarHBondContact O-N 3.19Å; I15-K18 VanDerWaalsContact O-N 3.11Å; K18-R20 VanDerWaalsContact C-N 3.29Å; K18-R20 PolarHBondContact O-N 3.3Å; K18-S21 WeakPolarHBondContact O-CA 3.44Å; K18-S21 PolarHBondContact O-N 3.49Å; K18-S21 PolarHBondContact O-OG 3.47Å; K18-V22 PolarHBondContact O-N 2.78Å; K18-F30 HydrophobicContact CB-CZ 4.16Å; K18-L42 HydrophobicContact CB-CD2 4.28Å; K18-L42 HydrophobicContact CG-CD2 4.32Å; K18-L42 PolarHBondContact NZ-O 3.25Å; K18-F45 PolarHBondContact NZ-O 3.39Å
19	A	75.6	Confident	70.7	Confident	9 Å²	9	82.2 Å²	82.2	7%	0.074	40%	0.396	C	S	.	.	H	α-helix	trans	-56.8	-41.7	178	0	0	0	0	0	111.8	I15 S21 V22 M27 F30	I15-A19 WeakPolarHBondContact O-CB 3.23Å; I15-A19 PolarHBondContact O-N 2.74Å; A19-S21 PolarHBondContact O-N 3.41Å; A19-V22 PolarHBondContact O-N 3.33Å; A19-M27 WeakPolarHBondContact O-CE 3.32Å; A19-F30 HydrophobicContact CB-CE1 4.07Å
20	R	69.1	Low	71.9	Confident	136 Å²	136	77 Å²	77	51%	0.513	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-12.6	174	-68.7	170.5	-171.5	150.4	7.2	114.7	E13 R16 K18	E13-R20 IonicContact OE1-NH1 3.21Å; R16-R20 WeakPolarHBondContact O-CG 3.37Å; R16-R20 PolarHBondContact O-N 3.26Å; K18-R20 VanDerWaalsContact C-N 3.29Å; K18-R20 PolarHBondContact O-N 3.3Å
21	S	71.9	Confident	72.9	Confident	82 Å²	82	76 Å²	76	57%	0.573	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-1.7	177.1	68.8	0	0	0	0	114.6	K18 A19	K18-S21 WeakPolarHBondContact O-CA 3.44Å; K18-S21 PolarHBondContact O-N 3.49Å; K18-S21 PolarHBondContact O-OG 3.47Å; A19-S21 PolarHBondContact O-N 3.41Å
22	V	74.4	Confident	73.6	Confident	15 Å²	15	74.8 Å²	74.8	9%	0.091	36%	0.358	C	S	.	.	S	Bend	trans	-92.1	126.5	179.6	175	0	0	0	0	110.1	K18 A19 R26 M27 F30 F45	K18-V22 PolarHBondContact O-N 2.78Å; A19-V22 PolarHBondContact O-N 3.33Å; V22-R26 HydrophobicContact CG1-CB 4.19Å; V22-M27 HydrophobicContact CB-CE 4.01Å; V22-M27 HydrophobicContact CG1-CE 4.26Å; V22-F30 HydrophobicContact CG1-CB 3.89Å; V22-F30 HydrophobicContact CG1-CG 4.3Å; V22-F30 HydrophobicContact CG2-CB 4.25Å; V22-F30 HydrophobicContact CG2-CD1 4.18Å; V22-F30 HydrophobicContact CG2-CD2 3.78Å; V22-F30 HydrophobicContact CG2-CE2 4.13Å; V22-F30 HydrophobicContact CG2-CG 3.8Å; V22-F30 HydrophobicContact CG2-CZ 4.49Å; V22-F45 HydrophobicContact CG1-CD1 4.49Å; V22-F45 HydrophobicContact CG1-CE1 4.44Å; V22-F45 HydrophobicContact CG2-CD1 4.28Å
23	P	69.2	Low	74.2	Confident	67 Å²	67	70.1 Å²	70.1	44%	0.435	34%	0.337	S	S	.	.			trans	-57.8	138.5	173.5	-24.7	34.6	0	0	0	111.9	H25 R26 M27	P23-H25 VanDerWaalsContact C-N 3.26Å; P23-H25 PolarHBondContact O-N 3.09Å; P23-H25 VanDerWaalsContact O-N 3.13Å; P23-R26 CarbonylContact O-C 3.6Å; P23-R26 WeakPolarHBondContact O-CA 3.26Å; P23-R26 PolarHBondContact O-N 3.26Å; P23-M27 PolarHBondContact O-N 3.44Å
24	Q	67.1	Low	74.8	Confident	169 Å²	169	68.3 Å²	68.3	79%	0.79	33%	0.329	S	S	*	.	H	α-helix	trans	-54.5	-38.2	-172.8	-75.3	179.5	-29	0	0	113.7	R26 M27	Q24-R26 PolarHBondContact O-N 3.41Å; Q24-M27 VanDerWaalsContact O-CB 3.23Å; Q24-M27 WeakPolarHBondContact O-CB 3.47Å; Q24-M27 PolarHBondContact O-N 2.77Å
25	H	66.8	Low	75.2	Confident	154 Å²	154	67.8 Å²	67.8	71%	0.713	35%	0.345	S	S	*	.	H	α-helix	trans	-64.2	-23.3	177.4	67.2	-101.2	0	0	0	113.7	P23	P23-H25 VanDerWaalsContact C-N 3.26Å; P23-H25 PolarHBondContact O-N 3.09Å; P23-H25 VanDerWaalsContact O-N 3.13Å
26	R	73.9	Confident	75.1	Confident	97 Å²	97	71.4 Å²	71.4	37%	0.366	37%	0.372	S	S	.	.	H	α-helix	trans	-100.1	2.2	172.8	-52.8	-160.9	66.9	-154.5	-6.5	113.7	V22 P23 Q24 K28 E29 F30 F45	V22-R26 HydrophobicContact CG1-CB 4.19Å; P23-R26 CarbonylContact O-C 3.6Å; P23-R26 WeakPolarHBondContact O-CA 3.26Å; P23-R26 PolarHBondContact O-N 3.26Å; Q24-R26 PolarHBondContact O-N 3.41Å; R26-K28 VanDerWaalsContact C-N 3.26Å; R26-K28 PolarHBondContact O-N 3.24Å; R26-E29 IonicContact CZ-OE2 2.68Å; R26-E29 IonicContact NE-OE2 3.87Å; R26-E29 PolarHBondContact NE-OE2 3.48Å; R26-E29 IonicContact NH2-OE2 2.73Å; R26-E29 PolarHBondContact NH2-OE2 2.93Å; R26-E29 PolarHBondContact O-N 2.91Å; R26-F30 WeakPolarHBondContact O-CB 3.36Å; R26-F30 PolarHBondContact O-N 3.36Å; R26-F45 HydrophobicContact CB-CE1 4.14Å
27	M	80.6	Confident	75.1	Confident	43 Å²	43	72.9 Å²	72.9	21%	0.212	38%	0.38	C	S	.	.	H	α-helix	trans	-60.6	-38.2	-179.9	-173.4	60.7	63.8	0	0	111.5	A19 V22 P23 Q24 F30 L31	A19-M27 WeakPolarHBondContact O-CE 3.32Å; V22-M27 HydrophobicContact CB-CE 4.01Å; V22-M27 HydrophobicContact CG1-CE 4.26Å; P23-M27 PolarHBondContact O-N 3.44Å; Q24-M27 VanDerWaalsContact O-CB 3.23Å; Q24-M27 WeakPolarHBondContact O-CB 3.47Å; Q24-M27 PolarHBondContact O-N 2.77Å; M27-F30 PolarHBondContact O-N 2.65Å; M27-F30 HydrophobicContact SD-CD1 4.15Å; M27-L31 HydrophobicContact CG-CD1 4.07Å; M27-L31 VanDerWaalsContact O-CG 3.31Å; M27-L31 WeakPolarHBondContact O-CG 3.09Å; M27-L31 PolarHBondContact O-N 3.18Å; M27-L31 HydrophobicContact SD-CD1 4.43Å; M27-L31 HydrophobicContact SD-CG 4.39Å
28	K	77.4	Confident	75	Confident	132 Å²	132	70.3 Å²	70.3	57%	0.574	37%	0.369	S	S	*	.	H	α-helix	trans	-60.8	-53.3	173.9	-173.3	-176.5	175.1	-172.9	0	111.2	R26 F30 L31 D32	R26-K28 VanDerWaalsContact C-N 3.26Å; R26-K28 PolarHBondContact O-N 3.24Å; K28-F30 PolarHBondContact O-N 2.91Å; K28-L31 PolarHBondContact O-N 2.87Å; K28-L31 VanDerWaalsContact O-N 3.14Å; K28-D32 WeakPolarHBondContact CE-OD2 3.3Å; K28-D32 WeakPolarHBondContact CG-OD2 3.47Å; K28-D32 WeakPolarHBondContact O-CB 3.49Å; K28-D32 VanDerWaalsContact O-CG 3.26Å; K28-D32 PolarHBondContact O-N 3.43Å
29	E	78.8	Confident	74.5	Confident	97 Å²	97	73 Å²	73	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-57.7	-37	178.3	-58.9	177.5	-179.6	0	0	112.9	R26 S33 F45	R26-E29 IonicContact CZ-OE2 2.68Å; R26-E29 IonicContact NE-OE2 3.87Å; R26-E29 PolarHBondContact NE-OE2 3.48Å; R26-E29 IonicContact NH2-OE2 2.73Å; R26-E29 PolarHBondContact NH2-OE2 2.93Å; R26-E29 PolarHBondContact O-N 2.91Å; E29-S33 VanDerWaalsContact O-CB 3.22Å; E29-S33 WeakPolarHBondContact O-CB 3.5Å; E29-S33 PolarHBondContact O-N 2.8Å; E29-F45 HydrophobicContact CB-CZ 4.14Å
30	F	81.8	Confident	73.9	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-66.8	-45.4	176.3	173.9	-103.7	0	0	0	112	K18 A19 V22 R26 M27 K28 L34 L42 F45	K18-F30 HydrophobicContact CB-CZ 4.16Å; A19-F30 HydrophobicContact CB-CE1 4.07Å; V22-F30 HydrophobicContact CG1-CB 3.89Å; V22-F30 HydrophobicContact CG1-CG 4.3Å; V22-F30 HydrophobicContact CG2-CB 4.25Å; V22-F30 HydrophobicContact CG2-CD1 4.18Å; V22-F30 HydrophobicContact CG2-CD2 3.78Å; V22-F30 HydrophobicContact CG2-CE2 4.13Å; V22-F30 HydrophobicContact CG2-CG 3.8Å; V22-F30 HydrophobicContact CG2-CZ 4.49Å; R26-F30 WeakPolarHBondContact O-CB 3.36Å; R26-F30 PolarHBondContact O-N 3.36Å; M27-F30 PolarHBondContact O-N 2.65Å; M27-F30 HydrophobicContact SD-CD1 4.15Å; K28-F30 PolarHBondContact O-N 2.91Å; F30-L34 HydrophobicContact CE1-CD2 4.47Å; F30-L34 WeakPolarHBondContact O-CB 3.28Å; F30-L34 PolarHBondContact O-N 3.32Å; F30-L42 HydrophobicContact CE2-CD2 3.8Å; F30-L42 HydrophobicContact CZ-CD2 3.82Å; F30-F45 HydrophobicContact CB-CE1 4.1Å; F30-F45 HydrophobicContact CB-CE2 4.17Å; F30-F45 HydrophobicContact CB-CZ 3.91Å; F30-F45 HydrophobicContact CD2-CB 4.26Å; F30-F45 HydrophobicContact CD2-CD1 4.29Å; F30-F45 AromaticContact CD2-CD2 3.77Å; F30-F45 HydrophobicContact CD2-CD2 3.77Å; F30-F45 HydrophobicContact CD2-CE2 4.15Å; F30-F45 AromaticContact CD2-CG 3.85Å; F30-F45 HydrophobicContact CD2-CG 3.85Å
31	L	83.2	Confident	73.7	Confident	40 Å²	40	73.2 Å²	73.2	21%	0.209	39%	0.394	C	S	.	.	H	α-helix	trans	-68.4	-41	177.3	-67.9	171.4	0	0	0	111.7	M27 K28 L34 A35 L74	M27-L31 HydrophobicContact CG-CD1 4.07Å; M27-L31 VanDerWaalsContact O-CG 3.31Å; M27-L31 WeakPolarHBondContact O-CG 3.09Å; M27-L31 PolarHBondContact O-N 3.18Å; M27-L31 HydrophobicContact SD-CD1 4.43Å; M27-L31 HydrophobicContact SD-CG 4.39Å; K28-L31 PolarHBondContact O-N 2.87Å; K28-L31 VanDerWaalsContact O-N 3.14Å; L31-L34 PolarHBondContact O-N 2.67Å; L31-A35 WeakPolarHBondContact O-CB 3.15Å; L31-A35 PolarHBondContact O-N 2.93Å; L31-L74 HydrophobicContact CD2-CD2 4.4Å
32	D	78.4	Confident	73.5	Confident	87 Å²	87	69.6 Å²	69.6	47%	0.465	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-39.5	176	-67.7	-13.8	0	0	0	111.3	K28 S36	K28-D32 WeakPolarHBondContact CE-OD2 3.3Å; K28-D32 WeakPolarHBondContact CG-OD2 3.47Å; K28-D32 WeakPolarHBondContact O-CB 3.49Å; K28-D32 VanDerWaalsContact O-CG 3.26Å; K28-D32 PolarHBondContact O-N 3.43Å; D32-S36 WeakPolarHBondContact O-CB 3.38Å; D32-S36 PolarHBondContact O-N 3.31Å; D32-S36 VanDerWaalsContact O-N 3.14Å; D32-S36 PolarHBondContact O-OG 2.94Å
33	S	78.3	Confident	73	Confident	10 Å²	10	75.7 Å²	75.7	7%	0.07	40%	0.396	C	S	.	.	H	α-helix	trans	-69.7	-40.8	173.5	-164.4	0	0	0	0	111.6	E29 A35 S36 K37 A41 E44	E29-S33 VanDerWaalsContact O-CB 3.22Å; E29-S33 WeakPolarHBondContact O-CB 3.5Å; E29-S33 PolarHBondContact O-N 2.8Å; S33-A35 VanDerWaalsContact C-N 3.35Å; S33-A35 PolarHBondContact O-N 3.37Å; S33-S36 WeakPolarHBondContact CA-OG 3.37Å; S33-S36 PolarHBondContact O-N 2.88Å; S33-S36 PolarHBondContact O-OG 3.48Å; S33-K37 WeakPolarHBondContact O-CB 3.49Å; S33-K37 PolarHBondContact O-N 2.98Å; S33-K37 PolarHBondContact OG-NZ 3.44Å; S33-A41 WeakPolarHBondContact O-CB 3.48Å; S33-A41 WeakPolarHBondContact OG-CB 3.46Å; S33-E44 PolarHBondContact OG-OE2 2.9Å
34	L	80.4	Confident	72.7	Confident	20 Å²	20	77.7 Å²	77.7	11%	0.105	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-39	175.8	-174.9	69.2	0	0	0	112	I15 F30 L31 G38 L42 L74	I15-L34 HydrophobicContact CD1-CD1 4.11Å; I15-L34 HydrophobicContact CD1-CD2 4.34Å; I15-L34 HydrophobicContact CG1-CD1 4.34Å; I15-L34 HydrophobicContact CG2-CD2 3.85Å; F30-L34 HydrophobicContact CE1-CD2 4.47Å; F30-L34 WeakPolarHBondContact O-CB 3.28Å; F30-L34 PolarHBondContact O-N 3.32Å; L31-L34 PolarHBondContact O-N 2.67Å; L34-G38 WeakPolarHBondContact O-CA 3.44Å; L34-G38 PolarHBondContact O-N 3.11Å; L34-L42 HydrophobicContact CD1-CD2 4.12Å; L34-L42 HydrophobicContact CD1-CG 4.48Å; L34-L74 HydrophobicContact CD2-CD2 4.4Å
35	A	75.9	Confident	72.5	Confident	87 Å²	87	71.1 Å²	71.1	72%	0.719	37%	0.369	S	S	*	.	H	α-helix	trans	-70.9	-31.1	176.7	0	0	0	0	0	113.2	L31 S33	L31-A35 WeakPolarHBondContact O-CB 3.15Å; L31-A35 PolarHBondContact O-N 2.93Å; S33-A35 VanDerWaalsContact C-N 3.35Å; S33-A35 PolarHBondContact O-N 3.37Å
36	S	73.3	Confident	72	Confident	90 Å²	90	69.1 Å²	69.1	63%	0.629	36%	0.359	S	S	*	.	H	α-helix	trans	-94.7	-29.9	-176.4	55.2	0	0	0	0	114.9	D32 S33	D32-S36 WeakPolarHBondContact O-CB 3.38Å; D32-S36 PolarHBondContact O-N 3.31Å; D32-S36 VanDerWaalsContact O-N 3.14Å; D32-S36 PolarHBondContact O-OG 2.94Å; S33-S36 WeakPolarHBondContact CA-OG 3.37Å; S33-S36 PolarHBondContact O-N 2.88Å; S33-S36 PolarHBondContact O-OG 3.48Å
37	K	74.3	Confident	70.7	Confident	93 Å²	93	73.2 Å²	73.2	40%	0.404	38%	0.383	S	S	.	.	H	α-helix	trans	-118.2	-4.5	-177.6	-53.5	174.4	-165.2	161	0	113.5	S33 E40 A41 E44	S33-K37 WeakPolarHBondContact O-CB 3.49Å; S33-K37 PolarHBondContact O-N 2.98Å; S33-K37 PolarHBondContact OG-NZ 3.44Å; K37-E40 PolarHBondContact O-N 2.9Å; K37-A41 HydrophobicContact CB-CB 4.34Å; K37-E44 IonicContact NZ-OE1 3.96Å; K37-E44 PolarHBondContact NZ-OE1 3.02Å; K37-E44 IonicContact NZ-OE2 3.98Å; K37-E44 PolarHBondContact NZ-OE2 3.09Å
38	G	70.8	Confident	68.7	Low	24 Å²	24	77.6 Å²	77.6	25%	0.247	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	57.2	-132.5	179.6	0	0	0	0	0	112.6	L34 E40 A41	L34-G38 WeakPolarHBondContact O-CA 3.44Å; L34-G38 PolarHBondContact O-N 3.11Å; G38-E40 PolarHBondContact O-N 3.48Å; G38-E40 VanDerWaalsContact O-N 3.09Å; G38-A41 PolarHBondContact O-N 3.29Å
39	P	62.6	Low	66.7	Low	82 Å²	82	75.5 Å²	75.5	53%	0.532	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-60.6	-22.2	-174.4	26.2	-35.2	0	0	0	114.4	F11 L42	F11-P39 HydrophobicContact CE2-CB 3.62Å; F11-P39 HydrophobicContact CZ-CB 3.73Å; P39-L42 WeakPolarHBondContact O-CB 3.49Å; P39-L42 WeakPolarHBondContact O-CG 3.44Å; P39-L42 PolarHBondContact O-N 2.92Å
40	E	64.7	Low	64.4	Low	148 Å²	148	76.8 Å²	76.8	69%	0.692	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-74.5	-27.5	-175.4	-58.6	-171.8	167.2	0	0	112.5	K37 G38 L42 Q43	K37-E40 PolarHBondContact O-N 2.9Å; G38-E40 PolarHBondContact O-N 3.48Å; G38-E40 VanDerWaalsContact O-N 3.09Å; E40-L42 PolarHBondContact O-N 2.9Å; E40-Q43 PolarHBondContact O-N 3.5Å
41	A	65	Low	62	Low	0 Å²	0	82 Å²	82	0%	0	47%	0.466	C	S	.	.	H	α-helix	trans	-56.4	-25.5	174.4	0	0	0	0	0	113.4	S33 K37 G38 Q43 E44	S33-A41 WeakPolarHBondContact O-CB 3.48Å; S33-A41 WeakPolarHBondContact OG-CB 3.46Å; K37-A41 HydrophobicContact CB-CB 4.34Å; G38-A41 PolarHBondContact O-N 3.29Å; A41-Q43 PolarHBondContact O-N 3.06Å; A41-E44 PolarHBondContact O-N 3.26Å
42	L	66.3	Low	59.4	Low	7 Å²	7	86.2 Å²	86.2	4%	0.037	49%	0.494	C	S	.	.	H	α-helix	trans	-68.4	-15.7	-179.4	-55.8	177.8	0	0	0	113.2	F11 Y14 I15 K18 F30 L34 P39 E40	F11-L42 HydrophobicContact CE2-CD1 3.82Å; Y14-L42 HydrophobicContact CD1-CD1 3.71Å; Y14-L42 HydrophobicContact CE1-CB 4.37Å; Y14-L42 HydrophobicContact CE1-CD1 3.73Å; I15-L42 HydrophobicContact CG1-CD1 4.14Å; I15-L42 HydrophobicContact CG1-CD2 4.34Å; K18-L42 HydrophobicContact CB-CD2 4.28Å; K18-L42 HydrophobicContact CG-CD2 4.32Å; K18-L42 PolarHBondContact NZ-O 3.25Å; F30-L42 HydrophobicContact CE2-CD2 3.8Å; F30-L42 HydrophobicContact CZ-CD2 3.82Å; L34-L42 HydrophobicContact CD1-CD2 4.12Å; L34-L42 HydrophobicContact CD1-CG 4.48Å; P39-L42 WeakPolarHBondContact O-CB 3.49Å; P39-L42 WeakPolarHBondContact O-CG 3.44Å; P39-L42 PolarHBondContact O-N 2.92Å; E40-L42 PolarHBondContact O-N 2.9Å
43	Q	64.3	Low	57.1	Low	143 Å²	143	89.3 Å²	89.3	67%	0.668	51%	0.507	S	S	*	.	H	α-helix	trans	-86.9	-32.3	172.5	-63.4	-170.3	7.8	0	0	113.2	E40 A41 F45 Q46	E40-Q43 PolarHBondContact O-N 3.5Å; A41-Q43 PolarHBondContact O-N 3.06Å; Q43-F45 VanDerWaalsContact C-N 3.26Å; Q43-F45 PolarHBondContact O-N 2.98Å; Q43-Q46 WeakPolarHBondContact O-CB 3.41Å; Q43-Q46 PolarHBondContact O-N 3.31Å; Q43-Q46 VanDerWaalsContact O-N 3.17Å
44	E	63.3	Low	54.7	Low	108 Å²	108	95.1 Å²	95.1	51%	0.505	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-38.1	175.9	-63.9	-173.2	139.5	0	0	111.1	S33 K37 A41 Q46	S33-E44 PolarHBondContact OG-OE2 2.9Å; K37-E44 IonicContact NZ-OE1 3.96Å; K37-E44 PolarHBondContact NZ-OE1 3.02Å; K37-E44 IonicContact NZ-OE2 3.98Å; K37-E44 PolarHBondContact NZ-OE2 3.09Å; A41-E44 PolarHBondContact O-N 3.26Å; E44-Q46 VanDerWaalsContact C-N 3.29Å; E44-Q46 PolarHBondContact O-N 3.1Å
45	F	62.9	Low	52.1	Low	32 Å²	32	104.7 Å²	104.7	14%	0.14	58%	0.578	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	39.9	175	-67.5	-98.5	0	0	0	112.5	K18 V22 R26 E29 F30 Q43	K18-F45 PolarHBondContact NZ-O 3.39Å; V22-F45 HydrophobicContact CG1-CD1 4.49Å; V22-F45 HydrophobicContact CG1-CE1 4.44Å; V22-F45 HydrophobicContact CG2-CD1 4.28Å; R26-F45 HydrophobicContact CB-CE1 4.14Å; E29-F45 HydrophobicContact CB-CZ 4.14Å; F30-F45 HydrophobicContact CB-CE1 4.1Å; F30-F45 HydrophobicContact CB-CE2 4.17Å; F30-F45 HydrophobicContact CB-CZ 3.91Å; F30-F45 HydrophobicContact CD2-CB 4.26Å; F30-F45 HydrophobicContact CD2-CD1 4.29Å; F30-F45 AromaticContact CD2-CD2 3.77Å; F30-F45 HydrophobicContact CD2-CD2 3.77Å; F30-F45 HydrophobicContact CD2-CE2 4.15Å; F30-F45 AromaticContact CD2-CG 3.85Å; F30-F45 HydrophobicContact CD2-CG 3.85Å; Q43-F45 VanDerWaalsContact C-N 3.26Å; Q43-F45 PolarHBondContact O-N 2.98Å
46	Q	56.4	Low	49.8	Very low	111 Å²	111	109.1 Å²	109.1	52%	0.519	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.8	-12.5	-179.9	-163.8	164.4	0.2	0	0	114.5	Q43 E44	Q43-Q46 WeakPolarHBondContact O-CB 3.41Å; Q43-Q46 PolarHBondContact O-N 3.31Å; Q43-Q46 VanDerWaalsContact O-N 3.17Å; E44-Q46 VanDerWaalsContact C-N 3.29Å; E44-Q46 PolarHBondContact O-N 3.1Å
47	Q	45.3	Very low	47.5	Very low	183 Å²	183	114.5 Å²	114.5	86%	0.855	60%	0.599	S	S	*	*	S	Bend	trans	-104.7	53.5	-174.1	-62.8	-167.1	29.2	0	0	115.4
48	T	39.5	Very low	45.3	Very low	135 Å²	135	113.9 Å²	113.9	83%	0.828	62%	0.62	S	S	*	*			trans	-159.9	42.3	159.2	-4.6	0	0	0	0	114.1	T50	T48-T50 PolarHBondContact O-N 3.38Å; T48-T50 VanDerWaalsContact O-N 3.09Å
49	A	35.3	Very low	43.2	Very low	89 Å²	89	116.1 Å²	116.1	74%	0.736	64%	0.643	S	S	*	*			trans	-85.5	71.4	-174.8	0	0	0	0	0	114.3	T51	A49-T51 PolarHBondContact O-N 3.09Å
50	T	31.2	Very low	41.9	Very low	123 Å²	123	120.1 Å²	120.1	76%	0.755	66%	0.66	S	S	*	*			trans	-70	115.5	169.2	-55.8	0	0	0	0	109.9	T48 T52	T48-T50 PolarHBondContact O-N 3.38Å; T48-T50 VanDerWaalsContact O-N 3.09Å; T50-T52 PolarHBondContact O-N 3.4Å
51	T	31.8	Very low	40	Very low	110 Å²	110	118 Å²	118	68%	0.675	66%	0.66	S	S	*	*			trans	-77.9	102.8	-165.8	-39.4	0	0	0	0	113.9	A49	A49-T51 PolarHBondContact O-N 3.09Å
52	T	28.3	Very low	38.1	Very low	129 Å²	129	126 Å²	126	79%	0.791	70%	0.701	S	S	*	*			trans	-84	111.5	169.9	-59.6	0	0	0	0	111	T50	T50-T52 PolarHBondContact O-N 3.4Å
53	M	29.1	Very low	36.2	Very low	152 Å²	152	135 Å²	135	75%	0.749	74%	0.736	S	S	*	*			trans	-90.4	125.6	172.8	-71.1	-80	-102.9	0	0	110.3
54	V	28.3	Very low	34.5	Very low	131 Å²	131	134.5 Å²	134.5	79%	0.794	74%	0.743	S	S	*	*			trans	-85	132.1	175	-179.9	0	0	0	0	110.1
55	Y	25.5	Very low	33	Very low	221 Å²	221	135.2 Å²	135.2	87%	0.867	75%	0.75	S	S	*	*			trans	-124.9	136.6	167.4	-100.5	-92.5	0	0	0	109.4
56	Q	28.3	Very low	32	Very low	180 Å²	180	138.6 Å²	138.6	84%	0.841	78%	0.778	S	S	*	*			trans	-124.5	111.4	-169.9	-176.8	-172.1	75.5	0	0	111.4
57	Q	24.3	Very low	31.2	Very low	203 Å²	203	136 Å²	136	95%	0.949	77%	0.769	S	S	*	*			trans	-170.4	128.1	159.2	-103.9	-177.5	13.3	0	0	106.8
58	G	28.4	Very low	30.9	Very low	81 Å²	81	134.6 Å²	134.6	84%	0.835	76%	0.763	S	S	*	*			cis	177.9	135.5	-11.5	0	0	0	0	0	109.7
59	G	27.6	Very low	31.1	Very low	71 Å²	71	133.1 Å²	133.1	73%	0.732	75%	0.754	S	S	*	*			trans	130.5	88.4	179.3	0	0	0	0	0	114.6
60	N	34	Very low	31.3	Very low	166 Å²	166	130.1 Å²	130.1	89%	0.888	73%	0.729	S	S	*	*			trans	37.8	82.8	157.5	-62.7	10.3	0	0	0	119.6
61	C	25.9	Very low	31.8	Very low	102 Å²	102	125.2 Å²	125.2	69%	0.689	70%	0.702	S	S	*	*			trans	-124.6	121.9	136.5	-73.5	0	0	0	0	107.9	Y63	C61-Y63 HydrophobicContact CB-CD2 4.06Å; C61-Y63 HydrophobicContact CB-CE2 3.82Å; C61-Y63 PolarHBondContact O-N 3.31Å
62	I	25	Very low	32.4	Very low	169 Å²	169	123.1 Å²	123.1	87%	0.867	69%	0.692	S	S	*	*			trans	-87.5	103.6	169.2	-60.9	178.2	0	0	0	106.9
63	Y	26	Very low	33.1	Very low	195 Å²	195	121.1 Å²	121.1	77%	0.765	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-86.5	132.2	162.3	-77	-91.3	0	0	0	108.3	C61 D65	C61-Y63 HydrophobicContact CB-CD2 4.06Å; C61-Y63 HydrophobicContact CB-CE2 3.82Å; C61-Y63 PolarHBondContact O-N 3.31Å; Y63-D65 PolarHBondContact O-N 2.7Å
64	T	28.9	Very low	34.2	Very low	134 Å²	134	114.9 Å²	114.9	82%	0.822	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-68.8	122.5	164.1	46.9	0	0	0	0	108.4
65	D	31.6	Very low	35.3	Very low	122 Å²	122	116.3 Å²	116.3	65%	0.652	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-59.7	141.6	-171.2	-94.9	-50.2	0	0	0	113.5	Y63 T67	Y63-D65 PolarHBondContact O-N 2.7Å; D65-T67 HydrophobicContact CB-CG2 3.87Å; D65-T67 VanDerWaalsContact CB-OG1 3.26Å; D65-T67 WeakPolarHBondContact CB-OG1 3.35Å; D65-T67 PolarHBondContact O-N 2.9Å
66	S	40.9	Very low	36.2	Very low	104 Å²	104	112.9 Å²	112.9	73%	0.727	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	23.9	167.9	-46.8	0	0	0	0	113.2
67	T	40.7	Very low	36.8	Very low	55 Å²	55	107 Å²	107	34%	0.337	62%	0.621	S	S	.	*	H	α-helix	trans	-83	-39.3	-179.9	52	0	0	0	0	111.9	D65 A70 G71	D65-T67 HydrophobicContact CB-CG2 3.87Å; D65-T67 VanDerWaalsContact CB-OG1 3.26Å; D65-T67 WeakPolarHBondContact CB-OG1 3.35Å; D65-T67 PolarHBondContact O-N 2.9Å; T67-A70 PolarHBondContact O-N 3.22Å; T67-G71 PolarHBondContact O-N 2.96Å
68	E	39.4	Very low	37.4	Very low	154 Å²	154	101.3 Å²	101.3	72%	0.72	60%	0.603	S	S	*	*	H	α-helix	trans	-67.6	-42.6	-172	-61.2	-175.6	172	0	0	112.4	G71 S72	E68-G71 PolarHBondContact O-N 3.35Å; E68-S72 WeakPolarHBondContact O-CB 3.44Å; E68-S72 PolarHBondContact O-N 3.06Å; E68-S72 PolarHBondContact O-OG 3.4Å
69	V	42	Very low	37.7	Very low	105 Å²	105	103.1 Å²	103.1	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-65.2	-43.7	177.3	-176.8	0	0	0	0	111.4	L73	V69-L73 HydrophobicContact CG1-CD1 4.38Å; V69-L73 WeakPolarHBondContact O-CG 3.35Å; V69-L73 PolarHBondContact O-N 3.37Å
70	A	40.5	Very low	37.9	Very low	26 Å²	26	106.4 Å²	106.4	22%	0.215	61%	0.606	C	S	.	*	H	α-helix	trans	-70.7	-33.5	178.2	0	0	0	0	0	112.6	T67 L74	T67-A70 PolarHBondContact O-N 3.22Å; A70-L74 WeakPolarHBondContact O-CD1 3.33Å; A70-L74 WeakPolarHBondContact O-CG 3.43Å; A70-L74 PolarHBondContact O-N 3.21Å
71	G	41	Very low	37.8	Very low	19 Å²	19	104.8 Å²	104.8	20%	0.196	60%	0.603	C	S	.	*	H	α-helix	trans	-64.5	-51.5	171.9	0	0	0	0	0	111.8	T67 E68 L73 L74 E75	T67-G71 PolarHBondContact O-N 2.96Å; E68-G71 PolarHBondContact O-N 3.35Å; G71-L73 VanDerWaalsContact C-N 3.26Å; G71-L73 PolarHBondContact O-N 3.06Å; G71-L74 PolarHBondContact O-N 3.43Å; G71-E75 PolarHBondContact O-N 3.06Å
72	S	44.1	Very low	37.9	Very low	67 Å²	67	106.4 Å²	106.4	47%	0.469	61%	0.609	S	S	.	*	H	α-helix	trans	-56.8	-36.9	-179.2	-54.4	0	0	0	0	113.1	E68 L76	E68-S72 WeakPolarHBondContact O-CB 3.44Å; E68-S72 PolarHBondContact O-N 3.06Å; E68-S72 PolarHBondContact O-OG 3.4Å; S72-L76 WeakPolarHBondContact O-CD1 3.36Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å
73	L	44.8	Very low	38	Very low	87 Å²	87	104 Å²	104	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-76	-24	176.8	-70.4	171.2	0	0	0	113.7	V69 G71	V69-L73 HydrophobicContact CG1-CD1 4.38Å; V69-L73 WeakPolarHBondContact O-CG 3.35Å; V69-L73 PolarHBondContact O-N 3.37Å; G71-L73 VanDerWaalsContact C-N 3.26Å; G71-L73 PolarHBondContact O-N 3.06Å
74	L	51.5	Low	38.1	Very low	21 Å²	21	101.5 Å²	101.5	11%	0.11	61%	0.612	C	S	.	*	H	α-helix	trans	-87.5	-32	178.5	-78.6	168.1	0	0	0	113	I15 R16 L31 L34 A70 G71 L76 A77 C78	I15-L74 HydrophobicContact CG2-CD1 4.04Å; I15-L74 HydrophobicContact CG2-CD2 3.48Å; I15-L74 VanDerWaalsContact CG2-CD2 3.48Å; I15-L74 HydrophobicContact CG2-CG 4.45Å; R16-L74 HydrophobicContact CB-CD1 4.47Å; R16-L74 HydrophobicContact CG-CD1 3.62Å; L31-L74 HydrophobicContact CD2-CD2 4.4Å; L34-L74 HydrophobicContact CD2-CD2 4.4Å; A70-L74 WeakPolarHBondContact O-CD1 3.33Å; A70-L74 WeakPolarHBondContact O-CG 3.43Å; A70-L74 PolarHBondContact O-N 3.21Å; G71-L74 PolarHBondContact O-N 3.43Å; L74-L76 PolarHBondContact O-N 3.22Å; L74-A77 PolarHBondContact O-N 3.17Å; L74-A77 VanDerWaalsContact O-N 3.1Å; L74-C78 PolarHBondContact O-SG 3.19Å
75	E	50.1	Low	38	Very low	160 Å²	160	103.6 Å²	103.6	75%	0.748	61%	0.613	S	S	*	*	H	α-helix	trans	-61.6	-33.7	170.6	-69.8	-173.7	150.6	0	0	111.7	G71 A77	G71-E75 PolarHBondContact O-N 3.06Å; E75-A77 VanDerWaalsContact C-N 3.26Å; E75-A77 PolarHBondContact O-N 3.31Å
76	L	45.1	Very low	38	Very low	150 Å²	150	103 Å²	103	79%	0.785	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-13.8	174.6	-69.9	170.6	0	0	0	114.5	S72 L74	S72-L76 WeakPolarHBondContact O-CD1 3.36Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å; L74-L76 PolarHBondContact O-N 3.22Å
77	A	40.4	Very low	37.4	Very low	55 Å²	55	106.9 Å²	106.9	46%	0.455	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.3	-1	-175	0	0	0	0	0	114.1	L74 E75	L74-A77 PolarHBondContact O-N 3.17Å; L74-A77 VanDerWaalsContact O-N 3.1Å; E75-A77 VanDerWaalsContact C-N 3.26Å; E75-A77 PolarHBondContact O-N 3.31Å
78	C	36.8	Very low	36.5	Very low	84 Å²	84	111 Å²	111	57%	0.568	65%	0.647	S	S	*	*	S	Bend	trans	-88.3	132.3	-174.4	-71	0	0	0	0	112.6	L74	L74-C78 PolarHBondContact O-SG 3.19Å
79	P	35.3	Very low	35.9	Very low	119 Å²	119	111.7 Å²	111.7	77%	0.773	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-71	133.5	177.2	28.7	-34.1	0	0	0	111.8	T81	P79-T81 PolarHBondContact O-N 2.75Å
80	V	31.4	Very low	35.1	Very low	140 Å²	140	113.9 Å²	113.9	85%	0.848	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-66	120.3	-178.5	179.5	0	0	0	0	111
81	T	33.5	Very low	34.3	Very low	133 Å²	133	119.3 Å²	119.3	82%	0.816	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-84.8	121.8	172.8	46.2	0	0	0	0	111	P79	P79-T81 PolarHBondContact O-N 2.75Å
82	T	27.6	Very low	33.6	Very low	135 Å²	135	125.2 Å²	125.2	83%	0.828	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-81.1	117.7	179.3	33.3	0	0	0	0	111.6
83	S	26.9	Very low	32.7	Very low	119 Å²	119	128.9 Å²	128.9	83%	0.832	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-81.7	119.5	178	52.9	0	0	0	0	112.1
84	V	28	Very low	31.8	Very low	143 Å²	143	131.1 Å²	131.1	87%	0.867	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-88.8	126.3	169.8	179.8	0	0	0	0	109.1
85	Q	27	Very low	30.6	Very low	177 Å²	177	138.6 Å²	138.6	83%	0.827	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-92	159.3	173.9	-90.4	-166.8	-18.3	0	0	112.8
86	P	31.7	Very low	29.4	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-103.3	149.6	-148.5	37.6	-35.9	0	0	0	117.2
87	Q	26.7	Very low	28.4	Very low	186 Å²	186	138.4 Å²	138.4	87%	0.869	76%	0.757	S	S	*	*			trans	46.9	129.1	145.6	-70.3	-170.4	-35.6	0	0	121.8
88	T	23.1	Very low	27.7	Very low	142 Å²	142	143.4 Å²	143.4	87%	0.871	77%	0.771	S	S	*	*				-132.6	172.1	126.4	-11.4	0	0	0	0	109.6
89	Q	26.4	Very low	27.7	Very low	169 Å²	169	144.8 Å²	144.8	79%	0.79	78%	0.779	S	S	*	*			trans	-75.4	172.5	-171.3	-63.6	158.7	4.7	0	0	111
90	Q	25.4	Very low	27.2	Very low	150 Å²	150	146.6 Å²	146.6	70%	0.701	78%	0.777	S	S	*	*			cis	-167.7	166.5	32	-151.4	158.8	-26.9	0	0	111.9
91	E	24	Very low	26.9	Very low	141 Å²	141	148 Å²	148	66%	0.659	77%	0.774	S	S	*	*			trans	70.4	126.4	159.2	-81.6	165.3	100.9	0	0	120.3
92	Q	26.4	Very low	26.5	Very low	142 Å²	142	147.2 Å²	147.2	66%	0.664	77%	0.769	S	S	*	*				66.8	135.5	95.4	-66.2	-166	84.9	0	0	114.2
93	Q	25.3	Very low	26.3	Very low	145 Å²	145	148.4 Å²	148.4	68%	0.678	77%	0.765	S	S	*	*			cis	-160.9	164.4	10.2	-121.3	-179.6	37.7	0	0	111.5
94	I	25.8	Very low	26.1	Very low	133 Å²	133	148.1 Å²	148.1	68%	0.682	76%	0.758	S	S	*	*			trans	55.5	109.3	148	-61	170.9	0	0	0	121.6
95	Q	26.4	Very low	25.9	Very low	178 Å²	178	148 Å²	148	83%	0.832	75%	0.748	S	S	*	*			trans	-10	127	137.7	174.5	-173.5	64	0	0	119.8
96	V	25	Very low	25.8	Very low	142 Å²	142	145.7 Å²	145.7	86%	0.861	75%	0.746	S	S	*	*			trans	-139.8	153.2	149.1	-177.7	0	0	0	0	109.3
97	Q	23.2	Very low	25.4	Very low	164 Å²	164	147.2 Å²	147.2	77%	0.766	74%	0.743	S	S	*	*			trans	-136.5	130.7	-171.5	179.7	179.7	57.7	0	0	112
98	Q	25.9	Very low	25.5	Very low	160 Å²	160	144.8 Å²	144.8	75%	0.748	74%	0.741	S	S	*	*			trans	65.3	169.8	166.5	-82.9	-170.9	13.1	0	0	117.1
99	P	36.3	Very low	25.5	Very low	113 Å²	113	145.6 Å²	145.6	73%	0.734	74%	0.735	S	S	*	*			cis	-127.9	148.4	9.3	39.6	-23.3	0	0	0	119.2
100	Q	25.3	Very low	25.7	Very low	158 Å²	158	145.3 Å²	145.3	74%	0.738	73%	0.734	S	S	*	*			trans	-2.6	136	133	176.6	-174.3	63.7	0	0	120.1
101	Q	25.5	Very low	25.6	Very low	170 Å²	170	143.2 Å²	143.2	79%	0.794	74%	0.736	S	S	*	*				-172.4	128.1	123.4	-100.8	-176.6	20.7	0	0	110.5
102	V	24.5	Very low	26.4	Very low	116 Å²	116	142 Å²	142	70%	0.703	74%	0.74	S	S	*	*				75.3	129.6	85.6	167.5	0	0	0	0	112.9
103	Q	23.2	Very low	26.5	Very low	159 Å²	159	142 Å²	142	74%	0.743	74%	0.74	S	S	*	*			cis	-133.2	-146.2	-1.5	-135.4	177.4	8	0	0	109.7
104	V	23.7	Very low	26.6	Very low	113 Å²	113	142.9 Å²	142.9	69%	0.685	74%	0.744	S	S	*	*			cis	-146	132.9	8.4	-170.3	0	0	0	0	107
105	Q	22.2	Very low	26.6	Very low	141 Å²	141	142.7 Å²	142.7	66%	0.659	75%	0.749	S	S	*	*				26	145.3	109.8	-82.8	168.3	-4.6	0	0	118.7
106	V	25.3	Very low	26.6	Very low	129 Å²	129	139.5 Å²	139.5	78%	0.782	75%	0.746	S	S	*	*			cis	-137.6	123.4	39.9	170.5	0	0	0	0	108.8
107	Q	24.6	Very low	26.7	Very low	140 Å²	140	137.2 Å²	137.2	65%	0.654	74%	0.742	S	S	*	*				84.3	125.3	65.6	-173.1	-179.9	0.5	0	0	115.1
108	V	27	Very low	27	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	74%	0.744	S	S	*	*			trans	-105.2	147.8	173.2	174.7	0	0	0	0	109.7
109	Q	24.8	Very low	27	Very low	160 Å²	160	137.6 Å²	137.6	75%	0.748	74%	0.744	S	S	*	*			trans	-111.7	141.5	-178.6	-168.6	77.3	49.5	0	0	111.5
110	Q	29.3	Very low	26.5	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	75%	0.748	S	S	*	*			trans	-140.3	169.7	168.6	-84.4	-164.5	-5.2	0	0	111
111	S	24.4	Very low	26.6	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	75%	0.749	S	S	*	*			trans	72.9	163.5	166.1	-52.1	0	0	0	0	116.3
112	P	40.6	Very low	27.4	Very low	115 Å²	115	134.4 Å²	134.4	75%	0.747	75%	0.745	S	S	*	*			cis	-115	-143	3.1	27.9	-2.7	0	0	0	111.1
113	Q	27.7	Very low	27.4	Very low	143 Å²	143	136.7 Å²	136.7	67%	0.668	75%	0.748	S	S	*	*			cis	-162.2	106	6.7	-164.7	170.2	-14.5	0	0	116.3
114	Q	27.2	Very low	27.6	Very low	162 Å²	162	135.7 Å²	135.7	76%	0.757	75%	0.747	S	S	*	*			trans	63	176.7	145.6	-53.6	175	-60	0	0	117.3
115	V	26.3	Very low	27.7	Very low	129 Å²	129	136 Å²	136	78%	0.782	75%	0.749	S	S	*	*			cis	-142.3	162.2	13.4	-169.9	0	0	0	0	112.2
116	S	25.8	Very low	27.9	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	75%	0.749	S	S	*	*			trans	-49.4	-176.5	172.5	-38.4	0	0	0	0	117.5
117	A	28.5	Very low	28	Very low	94 Å²	94	137 Å²	137	78%	0.777	75%	0.752	S	S	*	*			cis	-160.1	177.7	17.4	0	0	0	0	0	116.6
118	Q	27.9	Very low	28.1	Very low	170 Å²	170	138 Å²	138	79%	0.794	76%	0.757	S	S	*	*			trans	-35	169.4	170.9	-65.6	171.2	-25.8	0	0	122.7
119	Q	27.2	Very low	28.6	Very low	161 Å²	161	137.2 Å²	137.2	75%	0.752	76%	0.755	S	S	*	*			trans	98	122.1	141.3	-90.8	172.1	-20.1	0	0	122.7
120	L	26.2	Very low	28.6	Very low	158 Å²	158	134 Å²	134	83%	0.827	75%	0.746	S	S	*	*			trans	51.8	135.7	136.7	-66.7	165.4	0	0	0	123.1
121	S	26.3	Very low	28.6	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	75%	0.754	S	S	*	*			trans	-68.8	173.1	163	-37.1	0	0	0	0	112.2
122	P	42.8	Very low	29	Very low	109 Å²	109	139.1 Å²	139.1	71%	0.708	76%	0.758	S	S	*	*			cis	-146.1	-176.6	15.3	43.1	-22.8	0	0	0	118.7
123	Q	24.1	Very low	28.9	Very low	164 Å²	164	139.2 Å²	139.2	77%	0.766	76%	0.759	S	S	*	*			trans	86.4	144	145.3	-104.2	-170.9	78.4	0	0	123
124	L	27.4	Very low	29.2	Very low	137 Å²	137	139.4 Å²	139.4	72%	0.717	76%	0.763	S	S	*	*			trans	74	108.7	158	-62.7	164.9	0	0	0	120.6
125	T	25.9	Very low	29	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	77%	0.77	S	S	*	*				48.1	139.8	120.6	-2.5	0	0	0	0	119.4
126	V	26.7	Very low	29	Very low	108 Å²	108	140.8 Å²	140.8	66%	0.655	77%	0.769	S	S	*	*			cis	-148.5	130.9	31.1	-175	0	0	0	0	111.9
127	H	28.3	Very low	28.8	Very low	183 Å²	183	144.1 Å²	144.1	85%	0.847	77%	0.773	S	S	*	*				175.4	121.6	123.2	-99	-73.5	0	0	0	112.5
128	Q	26.5	Very low	28.8	Very low	161 Å²	161	145.3 Å²	145.3	75%	0.752	77%	0.77	S	S	*	*			trans	-135.2	178.3	167.8	-111.2	-167.8	24.8	0	0	106.1	T130	Q128-T130 VanDerWaalsContact CD-OG1 3.23Å; Q128-T130 PolarHBondContact OE1-OG1 3.18Å; Q128-T130 VanDerWaalsContact OE1-OG1 3.06Å
129	P	36.8	Very low	28.6	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	77%	0.768	S	S	*	*			cis	-120.5	-165.7	12.6	15.4	11.2	0	0	0	113.1
130	T	25.5	Very low	28.8	Very low	93 Å²	93	143.5 Å²	143.5	57%	0.571	76%	0.764	S	S	*	*			cis	155.2	121.9	-34.4	-69.2	0	0	0	0	106.8	Q128	Q128-T130 VanDerWaalsContact CD-OG1 3.23Å; Q128-T130 PolarHBondContact OE1-OG1 3.18Å; Q128-T130 VanDerWaalsContact OE1-OG1 3.06Å
131	E	28.2	Very low	28.7	Very low	197 Å²	197	144.5 Å²	144.5	92%	0.921	77%	0.765	S	S	*	*			trans	-134.5	95.9	173.8	-80.4	-155.6	112.4	0	0	114.1
132	Q	33.5	Very low	28.8	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	76%	0.761	S	S	*	*			trans	-161.7	161.7	147.4	-68.1	-155.7	3.4	0	0	105.7
133	P	38.3	Very low	28	Very low	117 Å²	117	146.8 Å²	146.8	76%	0.76	77%	0.771	S	S	*	*			cis	-140	-163	13.8	44	-23.7	0	0	0	116.3
134	I	33.8	Very low	28.1	Very low	146 Å²	146	143.3 Å²	143.3	75%	0.749	77%	0.77	S	S	*	*			trans	-43.3	148.6	-180	-60.7	147.5	0	0	0	119.5	V136	I134-V136 HydrophobicContact CG2-CG2 4.49Å
135	Q	22.5	Very low	28.7	Very low	194 Å²	194	141.9 Å²	141.9	91%	0.907	77%	0.769	S	S	*	*			trans	-159.1	167.1	143.4	-116.1	154.8	108.1	0	0	113.5
136	V	26.1	Very low	28.8	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	77%	0.774	S	S	*	*			trans	-151.2	141.6	-164.1	173.3	0	0	0	0	113.8	I134	I134-V136 HydrophobicContact CG2-CG2 4.49Å
137	Q	22.6	Very low	28.8	Very low	182 Å²	182	144.9 Å²	144.9	85%	0.85	78%	0.78	S	S	*	*			trans	-154.5	111.3	165.4	-145.4	146.9	45.7	0	0	110.8
138	V	29.3	Very low	28.7	Very low	119 Å²	119	141 Å²	141	72%	0.721	78%	0.78	S	S	*	*				75.8	131.3	90.5	172.3	0	0	0	0	112.5
139	Q	23.7	Very low	28.8	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.752	78%	0.781	S	S	*	*				-163	137.7	57.6	-155.9	157.8	1.1	0	0	116.4
140	I	30.1	Very low	29.2	Very low	131 Å²	131	137.4 Å²	137.4	67%	0.672	78%	0.778	S	S	*	*			trans	34.6	130.4	142.5	-55.8	170.6	0	0	0	118.9
141	Q	25.5	Very low	29.3	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	78%	0.781	S	S	*	*			cis	-155.6	174.4	29.3	-147.8	149.6	-34.9	0	0	110
142	G	26.7	Very low	29.3	Very low	65 Å²	65	134.7 Å²	134.7	67%	0.67	77%	0.772	S	S	*	*			cis	148	160.1	-13.5	0	0	0	0	0	114.4
143	Q	27.6	Very low	28.9	Very low	200 Å²	200	134 Å²	134	94%	0.935	77%	0.769	S	S	*	*			trans	72	155.5	-179.7	-75.7	-172.6	-16.4	0	0	119.8
144	A	25.8	Very low	28.3	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	77%	0.769	S	S	*	*			trans	-143	-173.4	-171.7	0	0	0	0	0	107.6
145	P	40.3	Very low	29	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	77%	0.767	S	S	*	*			cis	-146.4	-175.2	13.6	45	-24.3	0	0	0	118
146	Q	27.8	Very low	29.2	Very low	177 Å²	177	128.2 Å²	128.2	83%	0.827	76%	0.758	S	S	*	*			trans	58.4	133.1	145.8	-80.4	178.2	4	0	0	123.9
147	S	26.3	Very low	29.4	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	76%	0.759	S	S	*	*			trans	89.2	145.1	134.8	76.7	0	0	0	0	122.7
148	A	27	Very low	29.7	Very low	102 Å²	102	130.1 Å²	130.1	84%	0.843	76%	0.763	S	S	*	*			trans	71.6	159.3	154.9	0	0	0	0	0	121.2
149	A	27.9	Very low	29.7	Very low	92 Å²	92	129.4 Å²	129.4	76%	0.76	76%	0.763	S	S	*	*			trans	-95.7	-174.1	168	0	0	0	0	0	108.9
150	P	44.8	Very low	30.8	Very low	113 Å²	113	126.9 Å²	126.9	73%	0.734	76%	0.76	S	S	*	*			cis	-144	-171.1	9.2	35.9	-11	0	0	0	116.7
151	S	27.2	Very low	30.8	Very low	90 Å²	90	125.9 Å²	125.9	63%	0.629	77%	0.765	S	S	*	*			trans	59.8	124.1	139.2	65.1	0	0	0	0	124.6
152	I	27.8	Very low	31.9	Very low	143 Å²	143	123 Å²	123	73%	0.733	76%	0.762	S	S	*	*				85.2	141.4	125.5	-69.4	173.2	0	0	0	121.3
153	Q	26.5	Very low	32.2	Very low	166 Å²	166	124.4 Å²	124.4	78%	0.776	76%	0.762	S	S	*	*			trans	71.3	115.6	164.3	-79.3	160.5	32	0	0	118.2
154	T	26	Very low	32.4	Very low	124 Å²	124	123.1 Å²	123.1	76%	0.761	76%	0.756	S	S	*	*				77.2	159	65.5	64.1	0	0	0	0	115.2
155	P	47.1	Very low	32.7	Very low	108 Å²	108	125.2 Å²	125.2	70%	0.701	75%	0.754	S	S	*	*			cis	-136.9	-170	-11.2	34.2	-12.7	0	0	0	115.7
156	S	28.3	Very low	32.2	Very low	102 Å²	102	128.8 Å²	128.8	71%	0.713	76%	0.761	S	S	*	*			trans	80.3	152.5	141.9	82.6	0	0	0	0	119.8
157	L	29	Very low	32.5	Very low	152 Å²	152	125 Å²	125	80%	0.796	76%	0.76	S	S	*	*			cis	-166.5	139.1	-15.2	-120.2	171	0	0	0	110.8
158	Q	28.8	Very low	32.5	Very low	197 Å²	197	124.3 Å²	124.3	92%	0.921	76%	0.761	S	S	*	*			trans	-179.8	164.3	137.8	-99.8	164.6	18.5	0	0	112.6
159	S	28.8	Very low	32.5	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	76%	0.759	S	S	*	*			trans	-142	-166.7	-164.1	60.3	0	0	0	0	110.5
160	P	47	Very low	32.6	Very low	108 Å²	108	129.2 Å²	129.2	70%	0.701	75%	0.754	S	S	*	*			cis	-121.1	156.4	-10	13.7	13	0	0	0	114.2
161	S	30.7	Very low	31.6	Very low	111 Å²	111	132.2 Å²	132.2	78%	0.776	76%	0.758	S	S	*	*				69.5	156.5	79.2	-40.4	0	0	0	0	116
162	P	49.2	Very low	31.5	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	76%	0.763	S	S	*	*			cis	-122.2	-168.6	-9.7	40	-20.6	0	0	0	111.9
163	S	33.3	Very low	31.2	Very low	94 Å²	94	135.1 Å²	135.1	66%	0.657	77%	0.766	S	S	*	*			cis	-150.3	135.9	18.2	-62.8	0	0	0	0	113.7
164	Q	31.6	Very low	31.2	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.804	76%	0.763	S	S	*	*				41.9	148	122.3	-56.8	-173.2	-17.1	0	0	122.2
165	L	31.3	Very low	31.2	Very low	134 Å²	134	133.4 Å²	133.4	70%	0.702	76%	0.756	S	S	*	*			cis	-163.8	129.3	-14.5	-95.9	164.8	0	0	0	103.6
166	Q	30.2	Very low	30.3	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	76%	0.764	S	S	*	*			cis	80.7	133.2	50	-159.1	167.4	21.8	0	0	115
167	A	33.2	Very low	30.4	Very low	96 Å²	96	136.8 Å²	136.8	79%	0.793	77%	0.768	S	S	*	*			trans	-96.9	166.6	-174	0	0	0	0	0	113.5
168	A	27.7	Very low	30.2	Very low	99 Å²	99	134.2 Å²	134.2	82%	0.818	77%	0.769	S	S	*	*			trans	-160.8	127.5	154.2	0	0	0	0	0	115.2
169	Q	27.1	Very low	30.2	Very low	172 Å²	172	133.6 Å²	133.6	80%	0.804	77%	0.766	S	S	*	*			trans	-2.3	141.3	138.5	-80.4	-179.7	-16.4	0	0	123
170	I	28.9	Very low	30.2	Very low	126 Å²	126	137 Å²	137	65%	0.646	77%	0.77	S	S	*	*				90.1	132.7	127.2	-71.2	169.8	0	0	0	121.7
171	Q	23.6	Very low	29.4	Very low	175 Å²	175	138 Å²	138	82%	0.818	77%	0.768	S	S	*	*			trans	95.6	143.5	148.2	-98.2	168.3	36.9	0	0	125.3
172	V	25.2	Very low	29.3	Very low	122 Å²	122	141.2 Å²	141.2	74%	0.739	77%	0.771	S	S	*	*			trans	90.6	111.1	143.3	165.2	0	0	0	0	122
173	Q	22.7	Very low	28.3	Very low	172 Å²	172	140 Å²	140	80%	0.804	77%	0.771	S	S	*	*			trans	-3.7	156.5	131.2	-108.3	167.3	-15.9	0	0	118.3
174	H	26.1	Very low	28.1	Very low	151 Å²	151	139.7 Å²	139.7	70%	0.699	77%	0.774	S	S	*	*			cis	-177.3	132.4	22.8	175.8	-115.7	0	0	0	111
175	V	25.8	Very low	27.7	Very low	104 Å²	104	140.6 Å²	140.6	63%	0.63	78%	0.778	S	S	*	*			trans	65.5	151.9	149.8	168.1	0	0	0	0	117
176	Q	28.2	Very low	27.8	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.864	78%	0.781	S	S	*	*			cis	-148.5	164.3	21.5	-149.5	142.3	20.7	0	0	115.7
177	A	28.9	Very low	28.2	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	78%	0.779	S	S	*	*			trans	-45.2	154.3	-179.9	0	0	0	0	0	123.8
178	A	25.8	Very low	28.1	Very low	98 Å²	98	141.7 Å²	141.7	81%	0.81	78%	0.777	S	S	*	*			trans	-178.9	151.8	134.9	0	0	0	0	0	109.4
179	Q	28.8	Very low	28.1	Very low	183 Å²	183	145.3 Å²	145.3	86%	0.855	78%	0.777	S	S	*	*			cis	179.4	165.2	-27.1	-138.3	-175.7	13.3	0	0	106.4
180	Q	29.1	Very low	28.2	Very low	175 Å²	175	144.3 Å²	144.3	82%	0.818	77%	0.773	S	S	*	*			trans	92.6	141.6	174	-55.7	-170.4	0.8	0	0	118.5
181	I	30.9	Very low	28.5	Very low	129 Å²	129	145.7 Å²	145.7	66%	0.662	78%	0.779	S	S	*	*			cis	-166.6	135.4	-33.2	-120	166.2	0	0	0	109.9
182	Q	27.8	Very low	29.1	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	78%	0.779	S	S	*	*			trans	52.9	161.5	155.6	-69.5	168.3	-10.2	0	0	119.8
183	A	28.1	Very low	29.5	Very low	93 Å²	93	146.2 Å²	146.2	77%	0.769	78%	0.784	S	S	*	*			cis	-170.9	168.1	-11.5	0	0	0	0	0	107.8
184	A	28.6	Very low	29.9	Very low	89 Å²	89	146.3 Å²	146.3	74%	0.736	79%	0.785	S	S	*	*			cis	-172.9	-168	-23.3	0	0	0	0	0	109.3
185	E	23.8	Very low	30.1	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	78%	0.783	S	S	*	*			trans	80.6	155.6	163.7	-58.1	-162.9	138.9	0	0	121.2
186	I	32.8	Very low	30.5	Very low	146 Å²	146	146.4 Å²	146.4	75%	0.749	78%	0.781	S	S	*	*			trans	-143.5	171	-168.3	-27.3	176.5	0	0	0	107.4
187	P	39.8	Very low	30.5	Very low	125 Å²	125	145.6 Å²	145.6	81%	0.812	78%	0.777	S	S	*	*				-146.1	173.7	96.8	36.1	-18.2	0	0	0	115.8
188	E	30.1	Very low	30.4	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	77%	0.768	S	S	*	*			trans	-85.3	171.7	-177.5	-59.4	157.5	75.4	0	0	113.6
189	E	27.3	Very low	30.5	Very low	175 Å²	175	147.8 Å²	147.8	82%	0.818	77%	0.767	S	S	*	*				-159.5	128.1	112.8	-104.7	-152	85.6	0	0	114.9
190	H	30.6	Very low	30.5	Very low	152 Å²	152	146.3 Å²	146.3	70%	0.704	76%	0.764	S	S	*	*			trans	34.7	122.3	152.4	-76.4	-64.6	0	0	0	125.6
191	I	34.3	Very low	30.3	Very low	154 Å²	154	144.4 Å²	144.4	79%	0.79	76%	0.764	S	S	*	*			trans	-121.7	137.9	142.8	-61.6	173.3	0	0	0	107.8
192	P	36.9	Very low	30.2	Very low	123 Å²	123	143 Å²	143	80%	0.799	77%	0.772	S	S	*	*			trans	-83.3	147.6	174.2	32.9	-34.1	0	0	0	113.1
193	H	34	Very low	30.1	Very low	185 Å²	185	137.8 Å²	137.8	86%	0.856	77%	0.766	S	S	*	*			trans	-147.6	134.9	-166	-163.6	50.8	0	0	0	112.4
194	Q	29.8	Very low	30	Very low	175 Å²	175	142.8 Å²	142.8	82%	0.818	77%	0.774	S	S	*	*			trans	-167.2	140.7	175.4	-158.5	168.6	103.2	0	0	111.7
195	Q	30.1	Very low	29.9	Very low	140 Å²	140	142.8 Å²	142.8	65%	0.654	77%	0.769	S	S	*	*			cis	-161.9	135	-34.3	-119.4	-176.5	-99.6	0	0	111.6
196	I	35.9	Very low	30.1	Very low	116 Å²	116	141.5 Å²	141.5	60%	0.595	77%	0.767	S	S	*	*				84	135.6	121.7	-130.1	168.7	0	0	0	125.5
197	Q	26.2	Very low	29.8	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	77%	0.771	S	S	*	*			trans	62.9	144.2	147.4	-86.8	152.1	-11.3	0	0	122.6
198	A	28.1	Very low	29.2	Very low	73 Å²	73	137.4 Å²	137.4	60%	0.603	77%	0.773	S	S	*	*			cis	171.1	133.2	-13.7	0	0	0	0	0	110.9
199	Q	26.8	Very low	29	Very low	168 Å²	168	133 Å²	133	79%	0.785	77%	0.773	S	S	*	*				78.1	110.2	119.7	-159.4	162.2	22.4	0	0	123.4
200	L	28.6	Very low	29.1	Very low	151 Å²	151	133.1 Å²	133.1	79%	0.791	77%	0.773	S	S	*	*			trans	39.9	136.6	134.2	-58.8	172.2	0	0	0	122.3
201	V	26.8	Very low	28.8	Very low	136 Å²	136	133.3 Å²	133.3	82%	0.824	77%	0.774	S	S	*	*				180	143.1	103.9	147.5	0	0	0	0	112.5
202	A	27.3	Very low	28.5	Very low	100 Å²	100	132.1 Å²	132.1	83%	0.826	77%	0.768	S	S	*	*			trans	62.3	149.7	165.2	0	0	0	0	0	119.9
203	G	25.5	Very low	27.9	Very low	70 Å²	70	134.4 Å²	134.4	72%	0.722	77%	0.768	S	S	*	*			cis	169.7	149.6	-12.8	0	0	0	0	0	116.2
204	Q	26.6	Very low	27.4	Very low	197 Å²	197	132.6 Å²	132.6	92%	0.921	76%	0.763	S	S	*	*			trans	65.9	115.1	152.2	-73.2	-164.4	34.1	0	0	122.4
205	S	27.4	Very low	27.1	Very low	90 Å²	90	131.4 Å²	131.4	63%	0.629	76%	0.758	S	S	*	*				105.6	103.3	113.6	-160.1	0	0	0	0	121.5
206	L	26.8	Very low	27	Very low	164 Å²	164	130.5 Å²	130.5	86%	0.859	76%	0.762	S	S	*	*				63.1	135.3	127	-70.4	169.6	0	0	0	124.3
207	A	27.6	Very low	26.5	Very low	100 Å²	100	132 Å²	132	83%	0.826	78%	0.776	S	S	*	*			trans	86.6	149.6	135.3	0	0	0	0	0	121.3
208	G	26.5	Very low	26.5	Very low	84 Å²	84	127 Å²	127	87%	0.866	77%	0.769	S	S	*	*			trans	93.1	83.1	155.6	0	0	0	0	0	116.7
209	G	25.8	Very low	26.6	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	78%	0.781	S	S	*	*			trans	-100.2	144.7	163.6	0	0	0	0	0	112
210	Q	29	Very low	26.5	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	79%	0.785	S	S	*	*			trans	-159.9	127.8	154	-120.5	174.2	84.7	0	0	114.1
211	Q	24.6	Very low	26.5	Very low	156 Å²	156	126.2 Å²	126.2	73%	0.729	78%	0.782	S	S	*	*			trans	37.1	126.9	133	-73.2	-175	-19.4	0	0	123.7
212	I	28.3	Very low	27.5	Very low	129 Å²	129	125.3 Å²	125.3	66%	0.662	78%	0.78	S	S	*	*				84.3	116.4	127.7	-64.1	169.5	0	0	0	120.3
213	Q	23.7	Very low	28.6	Very low	171 Å²	171	125.9 Å²	125.9	80%	0.799	78%	0.775	S	S	*	*			trans	21.5	137.8	141.1	-50.9	175.3	-8.1	0	0	121.5
214	I	25.1	Very low	29.9	Very low	146 Å²	146	127.8 Å²	127.8	75%	0.749	78%	0.775	S	S	*	*				-177.5	158.2	106.9	-95.4	166.1	0	0	0	112.6
215	Q	22.9	Very low	30.1	Very low	151 Å²	151	123.6 Å²	123.6	71%	0.706	77%	0.767	S	S	*	*			trans	7.2	122.4	173.3	-97.4	56.9	42.6	0	0	123.2
216	T	27.5	Very low	30.3	Very low	120 Å²	120	127.3 Å²	127.3	74%	0.736	77%	0.774	S	S	*	*				22.9	118.6	110.7	-45.5	0	0	0	0	120.4
217	V	24.9	Very low	30.4	Very low	149 Å²	149	127.9 Å²	127.9	90%	0.903	77%	0.773	S	S	*	*				-148.8	154.4	119.2	-174.1	0	0	0	0	107.6
218	G	26.5	Very low	30.4	Very low	62 Å²	62	126.6 Å²	126.6	64%	0.639	77%	0.769	S	S	*	*			trans	-123.2	175.9	178.1	0	0	0	0	0	114.9
219	A	30.1	Very low	30.8	Very low	102 Å²	102	128.3 Å²	128.3	84%	0.843	77%	0.768	S	S	*	*			trans	70.1	124.2	176	0	0	0	0	0	118
220	L	25.6	Very low	32.2	Very low	169 Å²	169	130 Å²	130	89%	0.885	77%	0.765	S	S	*	*				-168.1	142.9	128.2	-103.3	166.1	0	0	0	111.8
221	S	27.3	Very low	32.3	Very low	104 Å²	104	132 Å²	132	73%	0.727	77%	0.765	S	S	*	*			trans	-158.9	177.2	172	-55.6	0	0	0	0	105.8
222	P	47.8	Very low	32.6	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	77%	0.769	S	S	*	*			cis	-122.2	-121.3	-7.1	33.7	-10.1	0	0	0	108.1
223	P	50.6	Low	32.8	Very low	111 Å²	111	130.2 Å²	130.2	72%	0.721	77%	0.774	S	S	*	*			cis	-118.8	-145.9	-45.1	38.2	-18.2	0	0	0	109.2
224	P	53.5	Low	33.2	Very low	111 Å²	111	128.7 Å²	128.7	72%	0.721	77%	0.767	S	S	*	*			cis	-137.1	171.8	-13.2	41.8	-24.6	0	0	0	117.3
225	S	29.9	Very low	33.6	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	76%	0.764	S	S	*	*				-178.1	121.8	127.2	33.2	0	0	0	0	114.8
226	Q	32.1	Very low	34	Very low	168 Å²	168	132.5 Å²	132.5	79%	0.785	77%	0.766	S	S	*	*			trans	53.3	152.7	151.7	-55.4	-160.5	73	0	0	120.2
227	Q	29.4	Very low	34.1	Very low	176 Å²	176	133.4 Å²	133.4	82%	0.822	77%	0.77	S	S	*	*			cis	-156.2	157	5.7	-139.7	173.9	54	0	0	110.1
228	G	27.7	Very low	34.3	Very low	73 Å²	73	130 Å²	130	75%	0.753	77%	0.765	S	S	*	*			trans	120.1	152	167.2	0	0	0	0	0	117.4
229	S	33.7	Very low	34.4	Very low	120 Å²	120	133.7 Å²	133.7	84%	0.839	78%	0.776	S	S	*	*			trans	-171.9	177.7	-172.4	-117.6	0	0	0	0	112
230	P	55.8	Low	34.5	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	78%	0.776	S	S	*	*			cis	-135.4	-171.3	-20.8	33.8	-13.3	0	0	0	114.4
231	R	31.6	Very low	34.7	Very low	221 Å²	221	131.6 Å²	131.6	83%	0.834	78%	0.775	S	S	*	*			trans	111.4	140.4	157.3	-67.4	-172.5	163	154.6	-0	117.7
232	E	31.4	Very low	34.9	Very low	171 Å²	171	132.7 Å²	132.7	80%	0.799	78%	0.777	S	S	*	*			cis	-167.7	153.8	-28.3	-131.8	172.4	143.5	0	0	109.9
233	G	31.2	Very low	34	Very low	75 Å²	75	135.1 Å²	135.1	77%	0.773	78%	0.783	S	S	*	*			trans	78	112.9	173.3	0	0	0	0	0	115.7
234	E	32.6	Very low	33.1	Very low	139 Å²	139	138.2 Å²	138.2	65%	0.65	79%	0.788	S	S	*	*			cis	117.4	127.6	10	-151.9	-142.4	158.4	0	0	112.4
235	R	32.7	Very low	32.8	Very low	179 Å²	179	138.1 Å²	138.1	68%	0.675	79%	0.787	S	S	*	*			trans	81.3	148.5	166	-49.7	-165.4	178.6	148.6	24.8	119.9
236	R	31.9	Very low	32.7	Very low	199 Å²	199	139.5 Å²	139.5	75%	0.751	79%	0.791	S	S	*	*			cis	-165.4	147.5	-21.6	-108	-177.6	-170.5	174.7	1.8	110.5
237	V	29.7	Very low	32.7	Very low	138 Å²	138	140.4 Å²	140.4	84%	0.836	79%	0.792	S	S	*	*			trans	41.7	131.3	138.9	-177.3	0	0	0	0	120.8
238	G	29.1	Very low	32.8	Very low	77 Å²	77	140.8 Å²	140.8	79%	0.794	79%	0.791	S	S	*	*			trans	-179.1	101.3	160.3	0	0	0	0	0	115.6
239	T	29.4	Very low	33	Very low	141 Å²	141	148.1 Å²	148.1	87%	0.865	80%	0.796	S	S	*	*			trans	-66.8	156.4	-177	43.8	0	0	0	0	116.5
240	A	31.4	Very low	32.7	Very low	101 Å²	101	151.5 Å²	151.5	84%	0.835	80%	0.795	S	S	*	*			trans	-50.7	155.2	177.2	0	0	0	0	0	118.1
241	S	30.1	Very low	31.4	Very low	125 Å²	125	151.6 Å²	151.6	87%	0.874	79%	0.794	S	S	*	*			trans	-158.2	172.4	133.3	-160.1	0	0	0	0	111.5
242	V	31.9	Very low	31.3	Very low	127 Å²	127	148.3 Å²	148.3	77%	0.77	79%	0.793	S	S	*	*			trans	-99.7	143	-177.6	172	0	0	0	0	110.9
243	L	27.9	Very low	31.4	Very low	169 Å²	169	148 Å²	148	89%	0.885	79%	0.793	S	S	*	*			trans	176.2	155.7	136.5	-95.2	164.5	0	0	0	112.1
244	Q	32.5	Very low	31.5	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	79%	0.793	S	S	*	*			trans	-105.7	-177.2	168.8	-50.6	-177.3	-2.2	0	0	109.6
245	P	47.7	Very low	31.3	Very low	108 Å²	108	150.6 Å²	150.6	70%	0.701	80%	0.799	S	S	*	*			cis	-126.3	-174	-19.8	28.5	-7.4	0	0	0	112.2
246	V	26.8	Very low	31	Very low	139 Å²	139	148.3 Å²	148.3	84%	0.842	81%	0.805	S	S	*	*				167.4	147	129.1	154.2	0	0	0	0	113.2
247	K	33.1	Very low	30.7	Very low	187 Å²	187	145 Å²	145	81%	0.813	81%	0.807	S	S	*	*			trans	-57.3	140.1	-178.2	-54.7	160.5	177.2	172.7	0	114.8
248	K	31.7	Very low	30.5	Very low	184 Å²	184	143.6 Å²	143.6	80%	0.8	80%	0.803	S	S	*	*				172.2	154.5	102.3	-96.9	-178.5	-177.8	177.7	0	115.6
249	R	31.7	Very low	30.4	Very low	227 Å²	227	151 Å²	151	86%	0.857	81%	0.809	S	S	*	*			trans	79.8	110.7	154.6	-77.4	171.5	-179.8	160.6	-1.2	120.9
250	K	27.5	Very low	30.3	Very low	190 Å²	190	148.9 Å²	148.9	83%	0.826	81%	0.806	S	S	*	*				63.4	119.6	118.8	-118.9	-161.3	174.5	-162.7	0	119.7
251	V	27.5	Very low	30.1	Very low	110 Å²	110	152.5 Å²	152.5	67%	0.667	81%	0.809	S	S	*	*				52.6	118.3	126.8	171.7	0	0	0	0	116.3
252	D	29.1	Very low	30.1	Very low	152 Å²	152	152.1 Å²	152.1	81%	0.813	81%	0.806	S	S	*	*				-156.7	-179.9	67.2	-131.1	-42.3	0	0	0	115.3
253	M	33.2	Very low	29.9	Very low	163 Å²	163	149.5 Å²	149.5	80%	0.803	81%	0.805	S	S	*	*			trans	-120	124.2	-177.2	-176.2	167.5	70.3	0	0	113.9	I255	M253-I255 PolarHBondContact O-N 2.93Å
254	P	34.8	Very low	30	Very low	120 Å²	120	150 Å²	150	78%	0.779	80%	0.803	S	S	*	*			trans	-91.4	96.2	179.7	34	-32.1	0	0	0	113.8
255	I	28.7	Very low	30.1	Very low	149 Å²	149	147 Å²	147	76%	0.764	80%	0.799	S	S	*	*			trans	26.8	126.4	130.2	-64	171	0	0	0	118.8	M253	M253-I255 PolarHBondContact O-N 2.93Å
256	T	26.2	Very low	29.1	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	81%	0.807	S	S	*	*			trans	-64.4	148.7	165	30	0	0	0	0	113.9
257	V	25.3	Very low	29.1	Very low	131 Å²	131	146.7 Å²	146.7	79%	0.794	81%	0.805	S	S	*	*			trans	-119.3	120.8	168.2	179.3	0	0	0	0	109.5
258	S	25.1	Very low	28.8	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	80%	0.803	S	S	*	*			trans	-109.2	140.6	175.9	-59	0	0	0	0	110.5
259	Y	26.6	Very low	28.6	Very low	233 Å²	233	141.8 Å²	141.8	91%	0.914	81%	0.805	S	S	*	*			trans	-83.5	146.3	167.5	-76.5	-89.1	0	0	0	110.8
260	A	28.1	Very low	28.3	Very low	96 Å²	96	138.7 Å²	138.7	79%	0.793	81%	0.805	S	S	*	*			trans	-136.3	150.3	174.9	0	0	0	0	0	110.5
261	I	26.6	Very low	28.4	Very low	176 Å²	176	134.2 Å²	134.2	90%	0.903	80%	0.803	S	S	*	*			trans	-123.8	149	171.4	-67.3	-179.8	0	0	0	108.3
262	S	29.8	Very low	28.6	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	81%	0.811	S	S	*	*			trans	-86.1	152.4	-154.4	52.9	0	0	0	0	116.6
263	G	29	Very low	28.7	Very low	72 Å²	72	135 Å²	135	74%	0.742	81%	0.809	S	S	*	*			trans	-150.6	-5.8	-177.9	0	0	0	0	0	121.7
264	Q	29.3	Very low	28.5	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	81%	0.814	S	S	*	*			trans	62.4	172.5	178.9	-64.3	-74	-4.1	0	0	115.4
265	P	34.2	Very low	28.1	Very low	113 Å²	113	134.6 Å²	134.6	73%	0.734	82%	0.816	S	S	*	*				-115.1	163.3	-78.5	26.8	-9.3	0	0	0	114.5
266	V	26.6	Very low	28.1	Very low	146 Å²	146	136.3 Å²	136.3	89%	0.885	82%	0.82	S	S	*	*			trans	-92.3	142.8	-178.8	176.6	0	0	0	0	111.9
267	A	26.3	Very low	28.3	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	82%	0.821	S	S	*	*			trans	-107	134.3	167.7	0	0	0	0	0	111.7
268	T	28.3	Very low	28.4	Very low	128 Å²	128	141.7 Å²	141.7	79%	0.785	83%	0.828	S	S	*	*			trans	-57.3	139.7	-167.6	-54	0	0	0	0	116.7
269	V	26.2	Very low	28.4	Very low	139 Å²	139	142 Å²	142	84%	0.842	83%	0.83	S	S	*	*			trans	-77	132.8	164.4	175.4	0	0	0	0	110.5
270	L	26.4	Very low	28.3	Very low	163 Å²	163	141.4 Å²	141.4	85%	0.853	83%	0.828	S	S	*	*			trans	-108.3	158.2	170.7	-91.5	165.3	0	0	0	111.9
271	A	29.2	Very low	28.2	Very low	95 Å²	95	142.4 Å²	142.4	79%	0.785	82%	0.824	S	S	*	*			trans	-87.9	162.4	-161.5	0	0	0	0	0	115.7
272	I	32.5	Very low	28	Very low	163 Å²	163	139.2 Å²	139.2	84%	0.836	82%	0.817	S	S	*	*			trans	-69.4	154.9	175.8	-24.1	178.7	0	0	0	110.9
273	P	31.2	Very low	27.9	Very low	117 Å²	117	141 Å²	141	76%	0.76	82%	0.816	S	S	*	*				-142.1	146	107	36.9	-23.8	0	0	0	116.7
274	Q	28	Very low	27.7	Very low	195 Å²	195	147.7 Å²	147.7	91%	0.911	82%	0.819	S	S	*	*			trans	11.3	131.2	156.1	-61.2	178.4	-16.9	0	0	121.6
275	G	27.1	Very low	27.7	Very low	79 Å²	79	145 Å²	145	81%	0.814	82%	0.818	S	S	*	*			trans	-165.9	85.3	167.6	0	0	0	0	0	115.1
276	Q	28.2	Very low	27.4	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	82%	0.818	S	S	*	*			trans	18.9	130.8	162.9	-66.3	-176.7	-13.7	0	0	123.1
277	Q	30.2	Very low	27.4	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	82%	0.819	S	S	*	*			trans	60.6	104.4	135.7	-67.3	-79.6	-3.5	0	0	120.4
278	Q	28	Very low	27.5	Very low	201 Å²	201	150.8 Å²	150.8	94%	0.939	82%	0.822	S	S	*	*				-156.2	156.9	128.2	-112.6	166.2	39.9	0	0	111.6
279	S	23.7	Very low	27.6	Very low	115 Å²	115	151.6 Å²	151.6	80%	0.804	83%	0.827	S	S	*	*			trans	-86.5	138.9	-164.5	-166	0	0	0	0	113.5
280	Y	25	Very low	27.7	Very low	220 Å²	220	150.4 Å²	150.4	86%	0.863	82%	0.82	S	S	*	*			trans	-96.8	111.6	178.4	-146	-84.6	0	0	0	110.5	S282	Y280-S282 PolarHBondContact O-N 3.47Å
281	V	25.8	Very low	27.7	Very low	117 Å²	117	148 Å²	148	71%	0.709	81%	0.808	S	S	*	*			trans	-80.2	111.3	175.2	179.4	0	0	0	0	109	L283	V281-L283 HydrophobicContact CG1-CD2 4.42Å; V281-L283 HydrophobicContact CG1-CG 4.4Å; V281-L283 PolarHBondContact O-N 2.79Å
282	S	23.8	Very low	27.7	Very low	108 Å²	108	147 Å²	147	76%	0.755	80%	0.795	S	S	*	*			trans	-88.3	102.6	178.5	-171.7	0	0	0	0	110.7	Y280	Y280-S282 PolarHBondContact O-N 3.47Å
283	L	26.2	Very low	27.7	Very low	156 Å²	156	143 Å²	143	82%	0.817	79%	0.786	S	S	*	*			trans	-87	110.4	173.1	-68.8	175.1	0	0	0	110.4	V281	V281-L283 HydrophobicContact CG1-CD2 4.42Å; V281-L283 HydrophobicContact CG1-CG 4.4Å; V281-L283 PolarHBondContact O-N 2.79Å
284	R	25.1	Very low	27.7	Very low	212 Å²	212	143.8 Å²	143.8	80%	0.8	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-71.8	142.3	160.2	-85.9	-178.9	168.5	167.3	-4.3	109.7
285	P	30.2	Very low	27.9	Very low	125 Å²	125	141.3 Å²	141.3	81%	0.812	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-79	120	151.4	0.1	18.7	0	0	0	108.5
286	D	28.1	Very low	28.2	Very low	140 Å²	140	147.5 Å²	147.5	75%	0.749	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-81.1	144.7	168.9	-74.1	-44.1	0	0	0	110.7	L288	D286-L288 PolarHBondContact O-N 3.45Å
287	L	26.1	Very low	28.4	Very low	174 Å²	174	143 Å²	143	91%	0.911	76%	0.761	S	S	*	*			trans	-81.1	108.3	-177.4	-77.5	162.8	0	0	0	111.2
288	L	28	Very low	28.6	Very low	161 Å²	161	138.6 Å²	138.6	84%	0.843	75%	0.754	S	S	*	*			trans	-89.4	111.1	162.8	-73	171.8	0	0	0	109.7	D286 V290	D286-L288 PolarHBondContact O-N 3.45Å; L288-V290 PolarHBondContact O-N 3.24Å
289	T	31.2	Very low	29.1	Very low	145 Å²	145	133.7 Å²	133.7	89%	0.89	74%	0.738	S	S	*	*			trans	-71	113	167.6	49.6	0	0	0	0	109.4
290	V	28	Very low	29.8	Very low	113 Å²	113	129.7 Å²	129.7	69%	0.685	72%	0.715	S	S	*	*			trans	-107.9	129.5	178.4	-179.5	0	0	0	0	109.6	L288 H294	L288-V290 PolarHBondContact O-N 3.24Å; V290-H294 HydrophobicContact CG1-CB 4.36Å
291	D	27.2	Very low	30.4	Very low	112 Å²	112	123.6 Å²	123.6	60%	0.599	70%	0.701	S	S	*	*			trans	-67.9	141.7	177.7	-171.6	2.9	0	0	0	111.7	A293 H294	D291-A293 PolarHBondContact O-N 3.38Å; D291-H294 PolarHBondContact O-N 3.33Å
292	S	29.3	Very low	31.3	Very low	76 Å²	76	122.8 Å²	122.8	53%	0.531	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-57.4	-20	-175.5	63.3	0	0	0	0	114.7	H294	S292-H294 PolarHBondContact O-N 2.84Å
293	A	31.5	Very low	31.8	Very low	78 Å²	78	121.8 Å²	121.8	65%	0.645	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-62.6	-23.6	177.7	0	0	0	0	0	114.3	D291	D291-A293 PolarHBondContact O-N 3.38Å
294	H	30.9	Very low	32.3	Very low	133 Å²	133	115.9 Å²	115.9	62%	0.616	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-86.1	-9.7	-173.7	-73.8	-69.1	0	0	0	115.6	V290 D291 S292 Y296 S297	V290-H294 HydrophobicContact CG1-CB 4.36Å; D291-H294 PolarHBondContact O-N 3.33Å; S292-H294 PolarHBondContact O-N 2.84Å; H294-Y296 PolarHBondContact O-N 2.84Å; H294-Y296 VanDerWaalsContact O-N 3.13Å; H294-S297 PolarHBondContact O-N 3.38Å
295	L	32.5	Very low	32.7	Very low	143 Å²	143	112.8 Å²	112.8	75%	0.749	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-69.4	-10.4	-172.5	-81.3	164.8	0	0	0	115.6
296	Y	34.2	Very low	33.3	Very low	209 Å²	209	112.3 Å²	112.3	82%	0.82	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-117.3	18.4	-179.2	-73.1	-76	0	0	0	114.6	H294	H294-Y296 PolarHBondContact O-N 2.84Å; H294-Y296 VanDerWaalsContact O-N 3.13Å
297	S	32.1	Very low	33.8	Very low	91 Å²	91	108 Å²	108	64%	0.636	64%	0.644	S	S	*	*			trans	-118.6	5.8	179.8	-166.4	0	0	0	0	115.3	H294 T299	H294-S297 PolarHBondContact O-N 3.38Å; S297-T299 PolarHBondContact O-N 2.99Å
298	A	33.3	Very low	34.3	Very low	81 Å²	81	105.4 Å²	105.4	67%	0.669	63%	0.627	S	S	*	*			trans	-81.7	103.1	-178.1	0	0	0	0	0	112.1	G300	A298-G300 PolarHBondContact O-N 3.34Å
299	T	38.4	Very low	34.8	Very low	98 Å²	98	101.4 Å²	101.4	60%	0.601	61%	0.61	S	S	*	*			trans	-67	92.9	169.7	-52.7	0	0	0	0	110.4	S297 T311	S297-T299 PolarHBondContact O-N 2.99Å; T299-T311 HydrophobicContact CG2-CG2 3.82Å
300	G	39.3	Very low	35	Very low	31 Å²	31	101.8 Å²	101.8	32%	0.32	60%	0.595	S	S	.	*			trans	-74.5	123.9	178.6	0	0	0	0	0	112.7	A298 I312	A298-G300 PolarHBondContact O-N 3.34Å; G300-I312 PolarHBondContact O-N 2.68Å
301	T	36.6	Very low	35.4	Very low	92 Å²	92	100.6 Å²	100.6	56%	0.564	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	128.9	160.7	37.7	0	0	0	0	110	T309 W310 T311	T301-T309 HydrophobicContact CG2-CG2 4.25Å; T301-W310 CarbonylContact C-O 3.6Å; T301-W310 WeakPolarHBondContact CA-O 3.4Å; T301-T311 HydrophobicContact CG2-CG2 4.18Å
302	I	45.7	Very low	35.7	Very low	100 Å²	100	99.5 Å²	99.5	51%	0.513	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	112	-178.7	-56.1	179.2	0	0	0	108.9	T309 W310 I312	I302-T309 WeakPolarHBondContact O-CA 3.29Å; I302-W310 PolarHBondContact N-O 3.26Å; I302-W310 PolarHBondContact O-N 2.73Å; I302-I312 HydrophobicContact CD1-CD1 3.95Å
303	T	34.4	Very low	35.8	Very low	88 Å²	88	100.3 Å²	100.3	54%	0.54	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.6	128.7	175.6	-52.2	0	0	0	0	110.6	E308 T309	T303-E308 CarbonylContact C-O 3.6Å; T303-E308 WeakPolarHBondContact CA-O 3.37Å; T303-T309 WeakPolarHBondContact CG2-OG1 3.48Å; T303-T309 PolarHBondContact OG1-OG1 3.46Å
304	S	37.1	Very low	35.8	Very low	31 Å²	31	100.2 Å²	100.2	22%	0.217	58%	0.576	C	S	.	*			trans	-73.5	164.6	175.7	74.9	0	0	0	0	112.2	T306 G307 E308	S304-T306 PolarHBondContact O-N 2.74Å; S304-T306 PolarHBondContact OG-N 3.37Å; S304-T306 VanDerWaalsContact OG-N 3.11Å; S304-T306 PolarHBondContact OG-OG1 3.25Å; S304-G307 PolarHBondContact O-N 2.99Å; S304-G307 PolarHBondContact OG-N 3.14Å; S304-E308 PolarHBondContact N-O 2.8Å; S304-E308 PolarHBondContact OG-N 2.85Å; S304-E308 PolarHBondContact OG-O 3.03Å
305	P	33.4	Very low	35.8	Very low	147 Å²	147	104 Å²	104	96%	0.955	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-9.8	167.5	-23.2	34.9	0	0	0	114.7
306	T	42.9	Very low	35.8	Very low	115 Å²	115	101.8 Å²	101.8	71%	0.706	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	1.8	173.8	54.1	0	0	0	0	113.4	S304	S304-T306 PolarHBondContact O-N 2.74Å; S304-T306 PolarHBondContact OG-N 3.37Å; S304-T306 VanDerWaalsContact OG-N 3.11Å; S304-T306 PolarHBondContact OG-OG1 3.25Å
307	G	36.7	Very low	35.4	Very low	51 Å²	51	96.8 Å²	96.8	53%	0.526	59%	0.585	S	S	.	*	S	Bend	trans	88	-2.3	178.4	0	0	0	0	0	115.5	S304 T309	S304-G307 PolarHBondContact O-N 2.99Å; S304-G307 PolarHBondContact OG-N 3.14Å; G307-T309 PolarHBondContact O-N 3.28Å
308	E	38.2	Very low	35.4	Very low	118 Å²	118	100.7 Å²	100.7	55%	0.551	59%	0.593	S	S	*	*			trans	-72.1	119.1	177.4	-62.9	-179.8	146.6	0	0	109.8	T303 S304	T303-E308 CarbonylContact C-O 3.6Å; T303-E308 WeakPolarHBondContact CA-O 3.37Å; S304-E308 PolarHBondContact N-O 2.8Å; S304-E308 PolarHBondContact OG-N 2.85Å; S304-E308 PolarHBondContact OG-O 3.03Å
309	T	37.3	Very low	35.2	Very low	77 Å²	77	102.9 Å²	102.9	47%	0.472	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.8	121.1	-176.1	-58	0	0	0	0	111.2	T301 I302 T303 G307	T301-T309 HydrophobicContact CG2-CG2 4.25Å; I302-T309 WeakPolarHBondContact O-CA 3.29Å; T303-T309 WeakPolarHBondContact CG2-OG1 3.48Å; T303-T309 PolarHBondContact OG1-OG1 3.46Å; G307-T309 PolarHBondContact O-N 3.28Å
310	W	35.7	Very low	34.8	Very low	153 Å²	153	110.5 Å²	110.5	58%	0.58	62%	0.619	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.7	120.7	-178.4	-60.4	87.9	0	0	0	110.2	T301 I302	T301-W310 CarbonylContact C-O 3.6Å; T301-W310 WeakPolarHBondContact CA-O 3.4Å; I302-W310 PolarHBondContact N-O 3.26Å; I302-W310 PolarHBondContact O-N 2.73Å
311	T	36	Very low	34.2	Very low	88 Å²	88	112.5 Å²	112.5	54%	0.54	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.7	126.4	170.2	-49.5	0	0	0	0	109.1	T299 T301 P313	T299-T311 HydrophobicContact CG2-CG2 3.82Å; T301-T311 HydrophobicContact CG2-CG2 4.18Å; T311-P313 VanDerWaalsContact O-CD 3.31Å; T311-P313 WeakPolarHBondContact O-CD 3.29Å
312	I	34.5	Very low	33.8	Very low	89 Å²	89	116.1 Å²	116.1	46%	0.456	66%	0.655	S	S	.	*			trans	-90.7	112.4	175.7	-57.5	176.4	0	0	0	109.1	G300 I302 V314	G300-I312 PolarHBondContact O-N 2.68Å; I302-I312 HydrophobicContact CD1-CD1 3.95Å; I312-V314 PolarHBondContact O-N 2.96Å
313	P	30.3	Very low	33.4	Very low	93 Å²	93	116.8 Å²	116.8	60%	0.604	67%	0.666	S	S	*	*			trans	-74.8	117.3	173.5	30.2	-32.8	0	0	0	110.3	T311 Y315	T311-P313 VanDerWaalsContact O-CD 3.31Å; T311-P313 WeakPolarHBondContact O-CD 3.29Å; P313-Y315 HydrophobicContact CB-CD2 4.49Å; P313-Y315 HydrophobicContact CB-CE2 4.06Å
314	V	32.4	Very low	33.2	Very low	77 Å²	77	121.1 Å²	121.1	47%	0.467	68%	0.68	S	S	.	*			trans	-92.4	107.9	174.5	-178.2	0	0	0	0	109	I312	I312-V314 PolarHBondContact O-N 2.96Å
315	Y	30.7	Very low	32.9	Very low	211 Å²	211	128 Å²	128	83%	0.827	71%	0.709	S	S	*	*			trans	-93.4	100.7	169.5	-73.3	-78.1	0	0	0	109.9	P313 A317	P313-Y315 HydrophobicContact CB-CD2 4.49Å; P313-Y315 HydrophobicContact CB-CE2 4.06Å; Y315-A317 PolarHBondContact O-N 2.82Å
316	S	32.1	Very low	32.7	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	71%	0.706	S	S	*	*			trans	-72.2	106.9	170.9	55.7	0	0	0	0	110.3	Q318	S316-Q318 PolarHBondContact O-N 3.22Å; S316-Q318 VanDerWaalsContact O-N 3.14Å
317	A	27.3	Very low	31.8	Very low	105 Å²	105	130.1 Å²	130.1	87%	0.868	71%	0.711	S	S	*	*			trans	-73	101.2	170.8	0	0	0	0	0	110	Y315	Y315-A317 PolarHBondContact O-N 2.82Å
318	Q	30.8	Very low	31.4	Very low	173 Å²	173	134.5 Å²	134.5	81%	0.808	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-84.9	141	166.4	-72.6	-174.3	-49.5	0	0	110.3	S316	S316-Q318 PolarHBondContact O-N 3.22Å; S316-Q318 VanDerWaalsContact O-N 3.14Å
319	P	29.9	Very low	30.8	Very low	127 Å²	127	135.2 Å²	135.2	83%	0.825	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-66.3	143.1	173	28.9	-34.2	0	0	0	110.7
320	R	29.2	Very low	30.3	Very low	258 Å²	258	140.1 Å²	140.1	97%	0.974	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-73.3	130.8	178.8	-83.6	-178.7	165.9	177.8	-4.1	111.6
321	G	27	Very low	29.8	Very low	73 Å²	73	140.5 Å²	140.5	75%	0.753	76%	0.762	S	S	*	*			trans	-151.1	88.9	167.6	0	0	0	0	0	111.3
322	D	27.4	Very low	29.4	Very low	167 Å²	167	140.8 Å²	140.8	89%	0.893	77%	0.773	S	S	*	*			trans	48.9	157.6	171.3	-74.4	-39.4	0	0	0	121.8
323	P	37.8	Very low	29	Very low	114 Å²	114	144.1 Å²	144.1	74%	0.74	79%	0.79	S	S	*	*			trans	-119.4	105.4	-167.4	35.8	-18.5	0	0	0	114
324	Q	30	Very low	28.8	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	80%	0.799	S	S	*	*			trans	-153.6	148.3	157.2	-119.7	178.3	30.7	0	0	113.8
325	Q	30.8	Very low	28.7	Very low	177 Å²	177	150.9 Å²	150.9	83%	0.827	82%	0.819	S	S	*	*			trans	60	93.3	169.3	-57.7	-173.3	6.6	0	0	117.5
326	Q	28.8	Very low	28.6	Very low	190 Å²	190	150 Å²	150	89%	0.888	82%	0.823	S	S	*	*			trans	-82.4	138.3	153.1	-69.2	177.2	-22.9	0	0	109.6
327	S	24.6	Very low	28.4	Very low	116 Å²	116	150.1 Å²	150.1	81%	0.811	83%	0.829	S	S	*	*			trans	-132.8	136.7	158.2	61.6	0	0	0	0	109.2
328	I	28.9	Very low	28.4	Very low	143 Å²	143	156.1 Å²	156.1	73%	0.733	83%	0.831	S	S	*	*			trans	-115.2	119.4	-173.7	-62.7	173.7	0	0	0	108.3
329	T	26.3	Very low	28.1	Very low	132 Å²	132	155.6 Å²	155.6	81%	0.81	83%	0.834	S	S	*	*			trans	-95.3	116.5	174.1	38.3	0	0	0	0	110.6
330	H	25.5	Very low	28.1	Very low	181 Å²	181	153.7 Å²	153.7	84%	0.838	83%	0.829	S	S	*	*			trans	-76.4	140.3	168.2	-82.2	-102.6	0	0	0	110.6
331	I	26.6	Very low	27.9	Very low	160 Å²	160	147.4 Å²	147.4	82%	0.821	82%	0.819	S	S	*	*			trans	-120.9	130.5	161.9	-61.7	179.2	0	0	0	107.3
332	A	25.6	Very low	27.9	Very low	94 Å²	94	152.3 Å²	152.3	78%	0.777	82%	0.822	S	S	*	*			trans	-104.7	156.3	178.5	0	0	0	0	0	111
333	I	27.2	Very low	28.1	Very low	160 Å²	160	150.6 Å²	150.6	82%	0.821	82%	0.817	S	S	*	*			trans	-120.9	131.3	174.3	-59.5	178.4	0	0	0	107.8
334	P	26.9	Very low	27.4	Very low	122 Å²	122	151 Å²	151	79%	0.792	82%	0.822	S	S	*	*			trans	-76.9	163.8	-178	29.5	-32	0	0	0	113.1
335	Q	29.9	Very low	27.1	Very low	190 Å²	190	146.5 Å²	146.5	89%	0.888	82%	0.824	S	S	*	*			trans	-134	99.8	-167.8	179.1	-173.2	42.9	0	0	110.8
336	E	29	Very low	26.9	Very low	192 Å²	192	143.4 Å²	143.4	90%	0.897	82%	0.822	S	S	*	*			trans	-142.3	165.1	179.5	-69.9	-168	-165.6	0	0	113.7
337	A	26.1	Very low	27.7	Very low	99 Å²	99	139.5 Å²	139.5	82%	0.818	81%	0.813	S	S	*	*			trans	69.1	67.6	168.9	0	0	0	0	0	119.1
338	Y	28	Very low	27.9	Very low	231 Å²	231	140.1 Å²	140.1	91%	0.906	81%	0.812	S	S	*	*			trans	-77.3	143.9	147.8	-111.3	-96.4	0	0	0	110.5
339	N	25.7	Very low	27.8	Very low	163 Å²	163	137.9 Å²	137.9	87%	0.872	82%	0.816	S	S	*	*			trans	-157.7	152	156.5	-98.8	-51.9	0	0	0	111.7
340	A	28.6	Very low	28.1	Very low	86 Å²	86	140.2 Å²	140.2	71%	0.711	82%	0.822	S	S	*	*			trans	-103.1	-173.5	179.5	0	0	0	0	0	110.2
341	V	26.3	Very low	28.2	Very low	127 Å²	127	136.6 Å²	136.6	77%	0.77	82%	0.824	S	S	*	*			cis	-158.1	166.1	25.7	-161.2	0	0	0	0	110
342	H	26.7	Very low	28.3	Very low	175 Å²	175	133.7 Å²	133.7	81%	0.81	82%	0.824	S	S	*	*			trans	132	147.5	134.8	-107.9	-78.8	0	0	0	118.8
343	V	31.3	Very low	28.4	Very low	131 Å²	131	136.3 Å²	136.3	79%	0.794	83%	0.83	S	S	*	*			trans	-139.2	144.4	-168.5	172.5	0	0	0	0	110.1
344	S	23.2	Very low	28.5	Very low	122 Å²	122	137.9 Å²	137.9	85%	0.853	83%	0.83	S	S	*	*			trans	-168.4	146.7	158.4	44.3	0	0	0	0	113.4
345	G	24.2	Very low	28.6	Very low	85 Å²	85	138.8 Å²	138.8	88%	0.876	83%	0.828	S	S	*	*			trans	108.7	104.9	152.4	0	0	0	0	0	119.5
346	S	25.6	Very low	28.6	Very low	112 Å²	112	138.3 Å²	138.3	78%	0.783	83%	0.826	S	S	*	*			trans	-142.8	-175.6	154.8	69.9	0	0	0	0	106.9
347	P	44.8	Very low	29	Very low	108 Å²	108	135.7 Å²	135.7	70%	0.701	82%	0.818	S	S	*	*			cis	-141.8	-161.8	3.9	31.8	-6.2	0	0	0	115.2
348	T	29	Very low	29.5	Very low	129 Å²	129	138.7 Å²	138.7	79%	0.791	82%	0.82	S	S	*	*			trans	94.1	114.1	146.6	-21.6	0	0	0	0	119.8
349	A	27.9	Very low	30.1	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	81%	0.811	S	S	*	*				177.4	149.6	107.7	0	0	0	0	0	112.5
350	L	31.3	Very low	30.5	Very low	181 Å²	181	134.4 Å²	134.4	95%	0.948	80%	0.8	S	S	*	*			trans	-129.5	148.2	171	-82.7	169.6	0	0	0	109.5
351	A	27.8	Very low	30.7	Very low	105 Å²	105	137.7 Å²	137.7	87%	0.868	80%	0.799	S	S	*	*			trans	-146	149.5	166.1	0	0	0	0	0	109.6
352	A	28.5	Very low	31	Very low	99 Å²	99	139.1 Å²	139.1	82%	0.818	80%	0.799	S	S	*	*			trans	-138.4	151.3	-177	0	0	0	0	0	111
353	V	27.7	Very low	31.2	Very low	149 Å²	149	137 Å²	137	90%	0.903	80%	0.798	S	S	*	*			trans	-136.2	147.2	169.5	-176.1	0	0	0	0	108.8
354	K	29.5	Very low	31.1	Very low	193 Å²	193	133.7 Å²	133.7	84%	0.839	79%	0.79	S	S	*	*			trans	-141.5	153.5	-180	177.3	-170	177.1	-168.5	0	106.5
355	L	30.7	Very low	31.4	Very low	140 Å²	140	134.1 Å²	134.1	73%	0.733	79%	0.788	S	S	*	*			trans	152.6	147.5	166.5	-85.5	157.2	0	0	0	107.1
356	E	28	Very low	31.6	Very low	181 Å²	181	136.5 Å²	136.5	85%	0.846	79%	0.785	S	S	*	*			cis	-151	-172.9	-11.6	-159.7	149.8	-141.3	0	0	109.6
357	D	38.7	Very low	31.8	Very low	137 Å²	137	137 Å²	137	73%	0.733	79%	0.789	S	S	*	*			trans	-115.4	146.1	-173.1	-166.2	-78.1	0	0	0	110.6
358	D	35.9	Very low	31.1	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	80%	0.796	S	S	*	*			trans	-155.3	154.6	162.4	-144.7	-36.1	0	0	0	112.6
359	K	40.5	Very low	31.1	Very low	166 Å²	166	139.1 Å²	139.1	72%	0.722	80%	0.799	S	S	*	*			trans	-171.9	131.4	-159.1	162.3	-158.5	169.4	-167.9	0	110.6
360	E	34.4	Very low	31.2	Very low	137 Å²	137	143.7 Å²	143.7	64%	0.64	80%	0.801	S	S	*	*			trans	-177.4	148.8	135.3	-107.4	-169.3	164.9	0	0	117.3
361	K	33.3	Very low	31	Very low	155 Å²	155	142.4 Å²	142.4	67%	0.674	80%	0.795	S	S	*	*			trans	60.4	148	140.3	-76	176	-171.7	145.6	0	122
362	M	31.3	Very low	31	Very low	157 Å²	157	142.6 Å²	142.6	77%	0.773	79%	0.79	S	S	*	*			cis	-175.5	154.1	-18.2	-141.3	-178.8	156.1	0	0	110.5
363	V	31.4	Very low	30.8	Very low	132 Å²	132	145.6 Å²	145.6	80%	0.8	79%	0.787	S	S	*	*			trans	60	135.2	160.6	-167.9	0	0	0	0	118.4
364	G	29.4	Very low	30.7	Very low	61 Å²	61	146.1 Å²	146.1	63%	0.629	78%	0.779	S	S	*	*			cis	165.5	-170.6	-5.5	0	0	0	0	0	114.9
365	T	29.1	Very low	30.5	Very low	130 Å²	130	146 Å²	146	80%	0.798	78%	0.782	S	S	*	*			trans	67.4	93.9	171.4	37.6	0	0	0	0	120.9
366	T	29	Very low	30.5	Very low	135 Å²	135	145 Å²	145	83%	0.828	78%	0.781	S	S	*	*				56.5	111	127.1	57.4	0	0	0	0	122.1
367	S	29.8	Very low	30.4	Very low	123 Å²	123	143.2 Å²	143.2	86%	0.86	78%	0.783	S	S	*	*				-158	160.1	113.1	65	0	0	0	0	111.3
368	V	29.2	Very low	29.9	Very low	141 Å²	141	144.3 Å²	144.3	86%	0.855	78%	0.783	S	S	*	*			trans	-107.6	133.4	-179.2	173.6	0	0	0	0	109.8
369	V	30.8	Very low	29.4	Very low	140 Å²	140	142.2 Å²	142.2	85%	0.848	78%	0.776	S	S	*	*			trans	-177	163.6	138.6	142.9	0	0	0	0	108.9
370	K	29.7	Very low	28.7	Very low	193 Å²	193	142.5 Å²	142.5	84%	0.839	79%	0.785	S	S	*	*			trans	-83.7	154.6	-165.7	-62.3	172.7	-179.8	174.8	0	113.9
371	N	27.4	Very low	28.3	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	79%	0.787	S	S	*	*			trans	-43.7	156	160.6	-42.1	-1.6	0	0	0	111.1
372	S	27.3	Very low	28.1	Very low	109 Å²	109	140.1 Å²	140.1	76%	0.762	80%	0.796	S	S	*	*			cis	-165.8	146.9	32.7	50.7	0	0	0	0	112.7
373	H	23.1	Very low	27.9	Very low	161 Å²	161	137.9 Å²	137.9	75%	0.745	80%	0.795	S	S	*	*			trans	-150.6	163.6	151.4	-129	-108.4	0	0	0	111.6
374	E	26	Very low	27.7	Very low	160 Å²	160	139.5 Å²	139.5	75%	0.748	80%	0.798	S	S	*	*			trans	-10	142.8	171	-66.6	154.5	156.9	0	0	120.4
375	E	25.7	Very low	27.6	Very low	192 Å²	192	146.2 Å²	146.2	90%	0.897	81%	0.811	S	S	*	*				-158.3	175.6	98.6	-126.3	-164.1	128.5	0	0	114.8
376	V	30.5	Very low	27.6	Very low	118 Å²	118	146.3 Å²	146.3	72%	0.715	81%	0.813	S	S	*	*			trans	-83.6	141.1	-172.8	174.6	0	0	0	0	112
377	V	25.8	Very low	27.4	Very low	144 Å²	144	144.2 Å²	144.2	87%	0.873	81%	0.81	S	S	*	*			trans	-135.7	128.7	157.8	-178.4	0	0	0	0	110.9
378	Q	27.5	Very low	27.4	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	81%	0.809	S	S	*	*			trans	-87.2	169	176.3	-171.8	84.3	0.7	0	0	110.6
379	T	25.4	Very low	27.3	Very low	118 Å²	118	150.1 Å²	150.1	72%	0.724	81%	0.812	S	S	*	*			trans	96.8	148.3	143.1	-9	0	0	0	0	120.8
380	L	25.7	Very low	27	Very low	172 Å²	172	151.3 Å²	151.3	90%	0.901	81%	0.81	S	S	*	*			trans	86.5	140.2	157	-65.1	176.5	0	0	0	120.3
381	A	27.4	Very low	27	Very low	83 Å²	83	149.4 Å²	149.4	69%	0.686	81%	0.809	S	S	*	*			trans	-107.7	-177.1	172.5	0	0	0	0	0	110.2
382	N	29.2	Very low	26.9	Very low	160 Å²	160	145.7 Å²	145.7	86%	0.856	81%	0.807	S	S	*	*			trans	77.5	84.7	172.3	-56.1	-18.4	0	0	0	117.5
383	S	26.7	Very low	26.7	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	81%	0.812	S	S	*	*			trans	-149.1	98.7	146.7	56.8	0	0	0	0	108.3
384	L	26.4	Very low	26.9	Very low	166 Å²	166	147.9 Å²	147.9	87%	0.869	81%	0.814	S	S	*	*				70.5	103.4	93.4	-73.3	168.6	0	0	0	113.5
385	F	27	Very low	26.9	Very low	202 Å²	202	148.4 Å²	148.4	89%	0.886	82%	0.817	S	S	*	*			trans	-74.5	139.6	171	-71.5	-96	0	0	0	111.6
386	P	29.1	Very low	26.9	Very low	132 Å²	132	146.4 Å²	146.4	86%	0.857	81%	0.811	S	S	*	*			trans	-80.8	110.4	156.8	-3	21.5	0	0	0	109.3
387	A	26.7	Very low	26.7	Very low	91 Å²	91	146.7 Å²	146.7	75%	0.752	82%	0.815	S	S	*	*			trans	-100.6	107.6	171.1	0	0	0	0	0	110.1
388	Q	27.9	Very low	26.7	Very low	180 Å²	180	145.8 Å²	145.8	84%	0.841	81%	0.809	S	S	*	*			trans	-169.3	104	161.5	-111.8	165.2	34.9	0	0	111.2
389	F	28.1	Very low	26.7	Very low	209 Å²	209	142.9 Å²	142.9	92%	0.917	81%	0.812	S	S	*	*				-175.6	122.4	122.4	-104.4	-70.1	0	0	0	108.7
390	M	25.5	Very low	26.7	Very low	165 Å²	165	143.4 Å²	143.4	81%	0.813	82%	0.815	S	S	*	*			trans	-116.5	159.4	176.7	-82.3	-175.4	68.3	0	0	110.7
391	N	27.7	Very low	26.7	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	82%	0.816	S	S	*	*			trans	66.8	103.9	166.5	-64.2	9.6	0	0	0	117.1
392	G	25.5	Very low	26.5	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	82%	0.819	S	S	*	*			trans	-160.7	77.2	167.1	0	0	0	0	0	110.9
393	N	24.8	Very low	26.3	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	82%	0.816	S	S	*	*			trans	-71.3	131.9	173.4	-71.6	-10.8	0	0	0	110.1
394	I	27.4	Very low	26.2	Very low	155 Å²	155	143 Å²	143	80%	0.795	82%	0.818	S	S	*	*			trans	-165.5	129.5	143.5	-101.6	148	0	0	0	110.8
395	H	24.2	Very low	26.1	Very low	172 Å²	172	138.2 Å²	138.2	80%	0.796	81%	0.809	S	S	*	*			trans	7.1	126.2	163.3	-60.2	-91.4	0	0	0	121.6
396	I	26.5	Very low	26	Very low	150 Å²	150	135.2 Å²	135.2	77%	0.769	81%	0.807	S	S	*	*			trans	-97.3	124.2	147.2	-61.3	167.2	0	0	0	107.7	V398	I396-V398 HydrophobicContact CG2-CG2 4.31Å
397	P	27.4	Very low	25.8	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	81%	0.812	S	S	*	*			trans	-82.2	115.9	168.7	31.3	-30.2	0	0	0	110.2
398	V	25	Very low	25.9	Very low	125 Å²	125	145.3 Å²	145.3	76%	0.758	82%	0.819	S	S	*	*			trans	-99.1	121.5	166.1	177.1	0	0	0	0	108.4	I396 V400	I396-V398 HydrophobicContact CG2-CG2 4.31Å; V398-V400 HydrophobicContact CG1-CG2 4.32Å
399	A	26.8	Very low	25.8	Very low	98 Å²	98	143.6 Å²	143.6	81%	0.81	82%	0.815	S	S	*	*			trans	-133.2	119.1	167.8	0	0	0	0	0	108.3
400	V	25.2	Very low	25.7	Very low	130 Å²	130	139.5 Å²	139.5	79%	0.788	81%	0.807	S	S	*	*			trans	-139.1	104.5	176.1	-180	0	0	0	0	108.6	V398	V398-V400 HydrophobicContact CG1-CG2 4.32Å
401	Q	26.1	Very low	25.7	Very low	196 Å²	196	136.6 Å²	136.6	92%	0.916	81%	0.81	S	S	*	*			trans	-154	151.4	147.8	-126.3	169.1	-2.9	0	0	112.6
402	A	24.6	Very low	25.6	Very low	90 Å²	90	138 Å²	138	74%	0.744	81%	0.811	S	S	*	*			trans	-67.4	173	180	0	0	0	0	0	112.2
403	V	23.6	Very low	25.7	Very low	133 Å²	133	140.2 Å²	140.2	81%	0.806	81%	0.81	S	S	*	*			cis	-159.5	162.3	17.9	79.5	0	0	0	0	112.4
404	A	24	Very low	25.6	Very low	97 Å²	97	137.8 Å²	137.8	80%	0.802	80%	0.8	S	S	*	*			trans	64.7	145	158.1	0	0	0	0	0	121.5
405	G	25.5	Very low	25.6	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	80%	0.796	S	S	*	*			trans	116.1	82.1	138.9	0	0	0	0	0	119.2
406	T	25.3	Very low	25.7	Very low	139 Å²	139	136.1 Å²	136.1	85%	0.853	79%	0.792	S	S	*	*			trans	35.7	123.9	142	53.9	0	0	0	0	121.3
407	Y	25.1	Very low	25.6	Very low	243 Å²	243	140.1 Å²	140.1	95%	0.953	80%	0.798	S	S	*	*			trans	-88.4	117.1	151.7	-81.5	-79.4	0	0	0	111.3
408	Q	28.8	Very low	25.5	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	79%	0.794	S	S	*	*			trans	-119.6	167.3	146.9	-90.8	-163.8	-11.7	0	0	109.3
409	N	26	Very low	26.1	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	78%	0.784	S	S	*	*			trans	-90.9	143.4	-158.2	-154	4.6	0	0	0	113.8
410	T	25.4	Very low	26.1	Very low	123 Å²	123	141.6 Å²	141.6	76%	0.755	78%	0.781	S	S	*	*			trans	42	111	159.7	46.2	0	0	0	0	120.4
411	A	26.1	Very low	26.2	Very low	104 Å²	104	144.1 Å²	144.1	86%	0.86	78%	0.784	S	S	*	*				-164.4	158	129.4	0	0	0	0	0	113
412	Q	25.6	Very low	26.2	Very low	181 Å²	181	143.2 Å²	143.2	85%	0.846	78%	0.78	S	S	*	*			trans	-82.3	171.2	172.2	-57.8	158.3	-32.4	0	0	109.4
413	T	26	Very low	27.2	Very low	125 Å²	125	144 Å²	144	77%	0.767	78%	0.777	S	S	*	*			cis	-161.1	167.5	22.9	-28.4	0	0	0	0	111.9
414	V	24.2	Very low	27.2	Very low	109 Å²	109	145.3 Å²	145.3	66%	0.661	78%	0.775	S	S	*	*			trans	-53	143.9	172.9	-143.9	0	0	0	0	112.4
415	H	27.1	Very low	27.3	Very low	153 Å²	153	148.5 Å²	148.5	71%	0.708	77%	0.773	S	S	*	*				177.1	133.6	85.2	-92.4	-70.3	0	0	0	116.9
416	I	26.6	Very low	27.4	Very low	139 Å²	139	154.2 Å²	154.2	71%	0.713	78%	0.782	S	S	*	*				71.9	130.4	126.7	-70.6	178	0	0	0	124
417	W	23.3	Very low	27.3	Very low	235 Å²	235	153.8 Å²	153.8	89%	0.89	78%	0.779	S	S	*	*			trans	81.4	140.4	154.1	-133.1	-101.5	0	0	0	122.7
418	D	24.8	Very low	28.2	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	77%	0.768	S	S	*	*			trans	-139.6	137.4	174.4	172.7	56.9	0	0	0	105.9
419	P	38.8	Very low	28.2	Very low	86 Å²	86	146 Å²	146	56%	0.558	76%	0.761	S	S	*	*				-153.5	148.4	94.2	37	-16.3	0	0	0	118.1
420	Q	25.9	Very low	28.2	Very low	158 Å²	158	146.2 Å²	146.2	74%	0.738	76%	0.758	S	S	*	*			trans	50.8	126.5	138.7	-56.9	174.3	-0.2	0	0	121.6
421	Q	28.6	Very low	28.4	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	76%	0.761	S	S	*	*				165	155.5	108.7	-85.6	-172.6	55.4	0	0	113.1
422	Q	25.1	Very low	28.4	Very low	178 Å²	178	150.1 Å²	150.1	83%	0.832	76%	0.759	S	S	*	*			trans	-106.4	-177.8	169.1	-69.5	-175.4	-15.4	0	0	109.4
423	P	45.1	Very low	29.4	Very low	105 Å²	105	147 Å²	147	68%	0.682	75%	0.754	S	S	*	*			cis	-132.6	-163.6	-13.3	19.9	7.1	0	0	0	113.6
424	Q	24.6	Very low	30.3	Very low	162 Å²	162	146.3 Å²	146.3	76%	0.757	75%	0.752	S	S	*	*			trans	112.5	111.8	144.5	-64.7	-169.9	-35.6	0	0	121.1
425	Q	26.2	Very low	31.3	Very low	163 Å²	163	146.2 Å²	146.2	76%	0.762	75%	0.754	S	S	*	*				35.4	128.4	127.2	-58.6	177.8	-8.3	0	0	121.6
426	Q	27.1	Very low	31.3	Very low	185 Å²	185	147 Å²	147	86%	0.864	76%	0.757	S	S	*	*				-173.4	163.5	107.4	-99	167.2	34	0	0	113.7
427	T	24	Very low	31.4	Very low	130 Å²	130	148.7 Å²	148.7	80%	0.798	76%	0.762	S	S	*	*			trans	-142.8	-178.5	177.9	59.3	0	0	0	0	107.9
428	P	43.8	Very low	31.6	Very low	109 Å²	109	145.4 Å²	145.4	71%	0.708	76%	0.757	S	S	*	*			cis	-134.9	-148.9	-2.7	31.6	-5.5	0	0	0	113.2
429	Q	28	Very low	31.8	Very low	162 Å²	162	148.7 Å²	148.7	76%	0.757	77%	0.768	S	S	*	*			trans	83.1	150	161.9	-63.4	-162.8	-73.6	0	0	119.8
430	E	26.8	Very low	31.2	Very low	149 Å²	149	152.6 Å²	152.6	70%	0.696	78%	0.779	S	S	*	*			cis	-170.5	173.2	-27.6	-161.5	172.2	116	0	0	109.7
431	Q	28.4	Very low	31.2	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.822	79%	0.787	S	S	*	*			trans	106.8	146.8	158	-57.4	179	13.5	0	0	120.6
432	T	26.6	Very low	31.2	Very low	132 Å²	132	152.7 Å²	152.7	81%	0.81	78%	0.783	S	S	*	*			trans	-161	179.1	-179.2	56.1	0	0	0	0	107.5
433	P	45.6	Very low	31.2	Very low	117 Å²	117	153.6 Å²	153.6	76%	0.76	79%	0.788	S	S	*	*			cis	-125.3	-115.6	-7.5	25	0.8	0	0	0	115.2
434	P	45.6	Very low	30.3	Very low	109 Å²	109	154.6 Å²	154.6	71%	0.708	79%	0.791	S	S	*	*				-123.9	-143	-107	40.4	-20.5	0	0	0	114.3
435	P	44.6	Very low	30.2	Very low	108 Å²	108	153.3 Å²	153.3	70%	0.701	80%	0.795	S	S	*	*				-123.9	175.8	-57.6	28.4	-9.3	0	0	0	114.3
436	Q	27.1	Very low	30.1	Very low	168 Å²	168	150.5 Å²	150.5	79%	0.785	79%	0.792	S	S	*	*			trans	156.4	156.1	145	-88.8	177.6	43.5	0	0	110.1
437	Q	29.1	Very low	30.1	Very low	175 Å²	175	147.1 Å²	147.1	82%	0.818	79%	0.789	S	S	*	*			cis	-145.2	-160.3	-4.4	-137.8	174.1	47.9	0	0	111.1
438	Q	27.7	Very low	30.2	Very low	167 Å²	167	145.8 Å²	145.8	78%	0.78	79%	0.791	S	S	*	*			trans	-135	138.4	-156.1	175.2	-170.2	28.7	0	0	113.7
439	Q	28.6	Very low	29.4	Very low	201 Å²	201	149.6 Å²	149.6	94%	0.939	80%	0.799	S	S	*	*			trans	-160.9	161.2	148.7	-119.6	168.9	57.7	0	0	113.5
440	Q	26.6	Very low	29.4	Very low	168 Å²	168	148.6 Å²	148.6	79%	0.785	80%	0.804	S	S	*	*			trans	-160.3	131.6	-162.9	172.2	-174.8	80.1	0	0	110.7
441	Q	26.9	Very low	29.4	Very low	195 Å²	195	147.8 Å²	147.8	91%	0.911	81%	0.809	S	S	*	*			trans	-158.2	151.1	160.5	-138.9	168.8	36.2	0	0	112
442	L	26.8	Very low	29.3	Very low	148 Å²	148	148.6 Å²	148.6	78%	0.775	81%	0.813	S	S	*	*			trans	-121.5	143.1	175.8	-71.6	71	0	0	0	108.6
443	Q	25.9	Very low	29.5	Very low	197 Å²	197	149 Å²	149	92%	0.921	82%	0.815	S	S	*	*				-164.5	142.8	129.4	-113.1	170.6	2.6	0	0	116.1
444	V	25.9	Very low	28.6	Very low	125 Å²	125	147.4 Å²	147.4	76%	0.758	81%	0.811	S	S	*	*			trans	-52.3	150.8	171.9	176.8	0	0	0	0	114.1
445	T	23.4	Very low	27.8	Very low	136 Å²	136	151.6 Å²	151.6	83%	0.834	82%	0.822	S	S	*	*				177.7	166.5	120.2	-65.1	0	0	0	0	111.5
446	C	23.2	Very low	27.1	Very low	103 Å²	103	152 Å²	152	70%	0.696	82%	0.822	S	S	*	*			trans	-96	165.2	-155.7	-52.3	0	0	0	0	116.7
447	S	27.5	Very low	27.1	Very low	115 Å²	115	151.1 Å²	151.1	80%	0.804	82%	0.818	S	S	*	*			trans	58.7	118.6	140.4	62.3	0	0	0	0	121.4
448	A	26.7	Very low	27.2	Very low	101 Å²	101	148.4 Å²	148.4	84%	0.835	82%	0.815	S	S	*	*			trans	-150.3	141.4	141.6	0	0	0	0	0	110.2
449	Q	26.5	Very low	27.3	Very low	190 Å²	190	148.7 Å²	148.7	89%	0.888	82%	0.817	S	S	*	*			trans	-97.5	142.1	165.3	-69.3	171.7	-42	0	0	108.9
450	T	27.9	Very low	27.3	Very low	141 Å²	141	144.6 Å²	144.6	87%	0.865	81%	0.81	S	S	*	*			trans	-135.4	132.4	163.9	40.6	0	0	0	0	109.9
451	V	26.5	Very low	27.5	Very low	132 Å²	132	145.5 Å²	145.5	80%	0.8	82%	0.815	S	S	*	*			trans	-117	128.4	-177.6	174.1	0	0	0	0	108.5
452	Q	27.1	Very low	27.9	Very low	193 Å²	193	142.2 Å²	142.2	90%	0.902	81%	0.81	S	S	*	*			trans	-137	100.4	164.9	-70.8	-163.1	-2.7	0	0	111.6
453	V	29.5	Very low	28.2	Very low	140 Å²	140	143.9 Å²	143.9	85%	0.848	81%	0.814	S	S	*	*			trans	30.9	130.4	143.7	-166.5	0	0	0	0	120.1
454	A	27.2	Very low	28.5	Very low	83 Å²	83	139.9 Å²	139.9	69%	0.686	81%	0.805	S	S	*	*			trans	-70.5	163.8	-178.6	0	0	0	0	0	117.3	V456	A454-V456 HydrophobicContact CB-CG2 4.24Å
455	E	28.3	Very low	28.8	Very low	197 Å²	197	138.2 Å²	138.2	92%	0.921	80%	0.799	S	S	*	*			trans	-127.9	162.4	142.6	-163.7	165.7	-177.1	0	0	108.9
456	V	30.5	Very low	29.4	Very low	117 Å²	117	138.1 Å²	138.1	71%	0.709	80%	0.8	S	S	*	*			trans	-149.7	144.4	-153.5	175.9	0	0	0	0	108.5	A454	A454-V456 HydrophobicContact CB-CG2 4.24Å
457	E	27.8	Very low	30.3	Very low	149 Å²	149	139.9 Å²	139.9	70%	0.696	80%	0.798	S	S	*	*			cis	-136.7	-168.5	13.5	-125.4	-132.6	114.6	0	0	108.8	Q459	E457-Q459 PolarHBondContact OE1-N 3.32Å
458	P	31.1	Very low	31.4	Very low	118 Å²	118	141.2 Å²	141.2	77%	0.766	80%	0.796	S	S	*	*			cis	-128.1	151.9	7.6	39.8	-22.5	0	0	0	118.9
459	Q	30.6	Very low	33	Very low	174 Å²	174	144.8 Å²	144.8	81%	0.813	80%	0.8	S	S	*	*			trans	-104.3	128.3	167.1	-112.9	-171.9	-18.3	0	0	110.5	E457	E457-Q459 PolarHBondContact OE1-N 3.32Å
460	S	28.5	Very low	35.2	Very low	115 Å²	115	137.2 Å²	137.2	80%	0.804	77%	0.765	S	S	*	*			trans	177.2	92.4	136.4	40.2	0	0	0	0	113.7
461	Q	29.5	Very low	37.4	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	74%	0.736	S	S	*	*			trans	-121.5	128.1	130	-78.7	-170.5	-24	0	0	106.5	Q463	Q461-Q463 PolarHBondContact O-N 2.86Å
462	P	35.5	Very low	40.1	Very low	125 Å²	125	131 Å²	131	81%	0.812	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-68.9	121.4	172.6	26.7	-28.9	0	0	0	108.2
463	Q	32.4	Very low	43.1	Very low	184 Å²	184	124.4 Å²	124.4	86%	0.86	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-62.5	133.7	159.2	-66.9	-168.3	-83.2	0	0	107.3	Q461 S465	Q461-Q463 PolarHBondContact O-N 2.86Å; Q463-S465 PolarHBondContact O-N 2.91Å
464	P	33.1	Very low	46.1	Very low	113 Å²	113	117.9 Å²	117.9	73%	0.734	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-58.7	141.7	167.9	26.5	-33	0	0	0	108.7
465	S	31.5	Very low	49.3	Very low	89 Å²	89	118.2 Å²	118.2	62%	0.622	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-55.2	156.5	169.7	43.2	0	0	0	0	110.8	Q463 E467	Q463-S465 PolarHBondContact O-N 2.91Å; S465-E467 PolarHBondContact O-N 3.39Å
466	P	37.2	Very low	52.5	Low	134 Å²	134	109.3 Å²	109.3	87%	0.87	61%	0.605	S	S	*	*			trans	-68	82.1	169.1	30.5	-35	0	0	0	109.7
467	E	42.3	Very low	55.6	Low	140 Å²	140	109.7 Å²	109.7	65%	0.654	60%	0.599	S	S	*	*			trans	-54.7	147.5	157.5	-68.8	-175.9	105.9	0	0	108.7	S465 L469	S465-E467 PolarHBondContact O-N 3.39Å; E467-L469 PolarHBondContact O-N 2.74Å
468	L	50.1	Low	58.7	Low	143 Å²	143	106 Å²	106	75%	0.749	58%	0.582	S	S	*	*			trans	-54.9	115.3	176.5	-72.8	149.4	0	0	0	108.4	L470	L468-L470 HydrophobicContact CB-CD2 4.36Å; L468-L470 PolarHBondContact O-N 2.65Å
469	L	59.7	Low	61.8	Low	176 Å²	176	100.4 Å²	100.4	92%	0.921	55%	0.545	S	S	*	.			trans	-71.4	70.8	177.8	-71.3	174.3	0	0	0	109.9	E467	E467-L469 PolarHBondContact O-N 2.74Å
470	L	73.7	Confident	64.9	Low	32 Å²	32	93 Å²	93	17%	0.168	51%	0.511	C	S	.	.			trans	-58.6	144.9	172.1	-61.9	-172.4	0	0	0	109.3	L468 P601	L468-L470 HydrophobicContact CB-CD2 4.36Å; L468-L470 PolarHBondContact O-N 2.65Å; L470-P601 HydrophobicContact CD1-CB 4.16Å; L470-P601 HydrophobicContact CD1-CG 3.88Å; L470-P601 WeakPolarHBondContact CD1-O 3.42Å
471	P	74.1	Confident	68.1	Low	38 Å²	38	92 Å²	92	25%	0.247	49%	0.494	C	S	.	.			trans	-53.7	143.9	171.3	-24.7	34.5	0	0	0	111.5	Y551 M608 R762	P471-Y551 HydrophobicContact CB-CE2 4.39Å; P471-M608 HydrophobicContact CB-CE 3.92Å; P471-M608 WeakPolarHBondContact O-CE 3.35Å; P471-R762 PolarHBondContact O-NH2 2.75Å
472	N	81.7	Confident	71.3	Confident	104 Å²	104	84.4 Å²	84.4	56%	0.556	46%	0.46	S	S	*	.	S	Bend	trans	-111.2	4.6	171.4	-69.5	-23.4	0	0	0	112.1	R762	N472-R762 PolarHBondContact OD1-NH1 3.29Å
473	S	90.2	Very high	74.2	Confident	54 Å²	54	78.5 Å²	78.5	38%	0.378	42%	0.422	S	S	.	.	S	Bend	trans	-147.4	148.8	-176.3	176.7	0	0	0	0	108.5	E611	S473-E611 WeakPolarHBondContact CA-OE1 3.3Å; S473-E611 WeakPolarHBondContact CB-OE1 3.28Å; S473-E611 VanDerWaalsContact OG-CD 3.28Å; S473-E611 PolarHBondContact OG-OE1 2.71Å; S473-E611 PolarHBondContact OG-OE2 3.23Å
474	L	94	Very high	77.3	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.016	39%	0.394	C	S	.	.			trans	-80.8	137.1	-178.8	-67.5	172.4	0	0	0	111.4	P476 Y551 L554 K558 M608 E611 C612	L474-P476 WeakPolarHBondContact O-CD 3.19Å; L474-Y551 HydrophobicContact CD2-CD2 3.81Å; L474-Y551 HydrophobicContact CD2-CE2 3.78Å; L474-L554 HydrophobicContact CD1-CB 3.96Å; L474-L554 HydrophobicContact CD2-CB 3.74Å; L474-K558 HydrophobicContact CB-CD 3.53Å; L474-K558 HydrophobicContact CD1-CB 4.25Å; L474-K558 HydrophobicContact CD1-CD 4.09Å; L474-K558 HydrophobicContact CG-CD 4.46Å; L474-K558 PolarHBondContact O-NZ 3.36Å; L474-M608 HydrophobicContact CD1-CB 4.07Å; L474-M608 VanDerWaalsContact CD1-O 3.23Å; L474-M608 WeakPolarHBondContact CD1-O 3.24Å; L474-M608 HydrophobicContact CD2-CB 3.76Å; L474-M608 HydrophobicContact CD2-CG 3.73Å; L474-M608 HydrophobicContact CD2-SD 3.79Å; L474-M608 HydrophobicContact CG-CB 3.61Å; L474-M608 HydrophobicContact CG-CG 3.69Å; L474-M608 HydrophobicContact CG-SD 4.41Å; L474-E611 PolarHBondContact N-OE2 3.24Å; L474-C612 HydrophobicContact CD1-CB 3.5Å; L474-C612 VanDerWaalsContact CD1-CB 3.5Å
475	K	94.3	Very high	80.2	Confident	91 Å²	91	71 Å²	71	40%	0.396	38%	0.378	S	S	.	.			trans	-105.7	101.6	171	-63.7	161.8	-178.8	178.3	0	109.7	E477 E478 C555	K475-E477 PolarHBondContact O-N 3.14Å; K475-E477 VanDerWaalsContact O-N 3.14Å; K475-E478 HydrophobicContact CB-CB 4.31Å; K475-E478 HydrophobicContact CB-CG 3.93Å; K475-E478 HydrophobicContact CD-CG 3.97Å; K475-E478 WeakPolarHBondContact CD-OE1 3Å; K475-E478 WeakPolarHBondContact CD-OE2 3.33Å; K475-E478 WeakPolarHBondContact CE-OE1 3.44Å; K475-E478 IonicContact NZ-OE1 2.6Å; K475-E478 PolarHBondContact NZ-OE1 3.03Å; K475-E478 PolarHBondContact O-N 2.98Å; K475-C555 WeakPolarHBondContact O-CB 3.46Å; K475-C555 PolarHBondContact O-SG 2.86Å
476	P	94.1	Very high	83.3	Confident	10 Å²	10	67.6 Å²	67.6	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-26.7	-176.7	27.5	-36.5	0	0	0	112.7	L474 G479 L480 K558 Y559 E562	L474-P476 WeakPolarHBondContact O-CD 3.19Å; P476-G479 PolarHBondContact O-N 3.4Å; P476-L480 PolarHBondContact O-N 3.19Å; P476-K558 HydrophobicContact CB-CB 4.41Å; P476-K558 HydrophobicContact CB-CG 4.27Å; P476-Y559 HydrophobicContact CB-CD2 4.15Å; P476-Y559 HydrophobicContact CB-CG 4.46Å; P476-E562 WeakPolarHBondContact CG-OE2 3.14Å
477	E	95.4	Very high	86.1	Confident	125 Å²	125	61.2 Å²	61.2	58%	0.584	31%	0.311	S	S	*	.	H	α-helix	trans	-64.1	-37.2	175.8	-55.5	77.7	-170.7	0	0	112.7	K475 L480 E481	K475-E477 PolarHBondContact O-N 3.14Å; K475-E477 VanDerWaalsContact O-N 3.14Å; E477-L480 PolarHBondContact O-N 3.24Å; E477-E481 VanDerWaalsContact O-CB 3.3Å; E477-E481 WeakPolarHBondContact O-CB 3.45Å; E477-E481 PolarHBondContact O-N 2.86Å
478	E	94.3	Very high	88.6	Confident	71 Å²	71	58.9 Å²	58.9	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-40.3	177.4	-69.8	-179.4	171.6	0	0	110.7	K475 E481 V482 Y551	K475-E478 HydrophobicContact CB-CB 4.31Å; K475-E478 HydrophobicContact CB-CG 3.93Å; K475-E478 HydrophobicContact CD-CG 3.97Å; K475-E478 WeakPolarHBondContact CD-OE1 3Å; K475-E478 WeakPolarHBondContact CD-OE2 3.33Å; K475-E478 WeakPolarHBondContact CE-OE1 3.44Å; K475-E478 IonicContact NZ-OE1 2.6Å; K475-E478 PolarHBondContact NZ-OE1 3.03Å; K475-E478 PolarHBondContact O-N 2.98Å; E478-E481 PolarHBondContact O-N 2.92Å; E478-V482 WeakPolarHBondContact O-CG2 3.38Å; E478-V482 PolarHBondContact O-N 3.25Å; E478-V482 VanDerWaalsContact O-N 3.1Å; E478-Y551 WeakPolarHBondContact OE2-CE1 3.31Å; E478-Y551 PolarHBondContact OE2-OH 3.03Å
479	G	95.3	Very high	90.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-44.2	174.9	0	0	0	0	0	112.8	P476 W483	P476-G479 PolarHBondContact O-N 3.4Å; G479-W483 PolarHBondContact O-N 3Å; G479-W483 VanDerWaalsContact O-N 3.08Å
480	L	96.3	Very high	92.4	Very high	18 Å²	18	49 Å²	49	9%	0.094	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-41.7	175.6	177.7	66.1	0	0	0	112.3	P476 E477 W483 K484 L517 Y559	P476-L480 PolarHBondContact O-N 3.19Å; E477-L480 PolarHBondContact O-N 3.24Å; L480-W483 PolarHBondContact O-N 3.49Å; L480-K484 HydrophobicContact CD1-CD 4.48Å; L480-K484 HydrophobicContact CG-CD 4.2Å; L480-K484 WeakPolarHBondContact O-CG 3.48Å; L480-K484 PolarHBondContact O-N 3.32Å; L480-L517 HydrophobicContact CD1-CB 4.47Å; L480-L517 HydrophobicContact CD1-CD1 3.83Å; L480-L517 HydrophobicContact CD1-CG 4.17Å; L480-Y559 HydrophobicContact CB-CD2 4.48Å; L480-Y559 HydrophobicContact CB-CG 4.49Å; L480-Y559 HydrophobicContact CD1-CD1 4.22Å; L480-Y559 HydrophobicContact CD1-CE1 3.75Å; L480-Y559 HydrophobicContact CD2-CD2 4.37Å; L480-Y559 HydrophobicContact CD2-CE1 4.28Å; L480-Y559 HydrophobicContact CD2-CE2 3.74Å; L480-Y559 HydrophobicContact CG-CE1 4.47Å
481	E	95.9	Very high	93.3	Very high	95 Å²	95	47.6 Å²	47.6	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-71.3	-40.1	-176.9	-169.3	57.2	-155.6	0	0	111.8	E477 E478 W483 K484 N485	E477-E481 VanDerWaalsContact O-CB 3.3Å; E477-E481 WeakPolarHBondContact O-CB 3.45Å; E477-E481 PolarHBondContact O-N 2.86Å; E478-E481 PolarHBondContact O-N 2.92Å; E481-W483 VanDerWaalsContact C-N 3.35Å; E481-K484 PolarHBondContact O-N 2.74Å; E481-N485 PolarHBondContact O-N 3.02Å; E481-N485 PolarHBondContact O-ND2 3.13Å; E481-N485 PolarHBondContact OE1-ND2 2.74Å
482	V	96.6	Very high	94.2	Very high	28 Å²	28	48.5 Å²	48.5	17%	0.17	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-37.7	173.2	-176.9	0	0	0	0	111.1	E478 W486 M532 Y544 I552	E478-V482 WeakPolarHBondContact O-CG2 3.38Å; E478-V482 PolarHBondContact O-N 3.25Å; E478-V482 VanDerWaalsContact O-N 3.1Å; V482-W486 WeakPolarHBondContact O-CB 3.19Å; V482-W486 PolarHBondContact O-N 2.68Å; V482-M532 HydrophobicContact CB-CE 4.21Å; V482-M532 HydrophobicContact CG1-CE 3.67Å; V482-Y544 HydrophobicContact CG1-CE2 3.88Å; V482-Y544 WeakPolarHBondContact CG1-OH 3.4Å; V482-Y544 WeakPolarHBondContact CG2-OH 3.25Å; V482-I552 HydrophobicContact CB-CG2 4.19Å; V482-I552 HydrophobicContact CG1-CD1 4.31Å; V482-I552 HydrophobicContact CG1-CG2 4.23Å; V482-I552 HydrophobicContact CG2-CD1 4.42Å
483	W	97.1	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-50.2	171.7	171.8	-92.8	0	0	0	111.9	G479 L480 E481 W486 A487 Q514 L517 L525 L529 M532 I556	G479-W483 PolarHBondContact O-N 3Å; G479-W483 VanDerWaalsContact O-N 3.08Å; L480-W483 PolarHBondContact O-N 3.49Å; E481-W483 VanDerWaalsContact C-N 3.35Å; W483-W486 HydrophobicContact CE3-CE3 4.28Å; W483-W486 HydrophobicContact CE3-CZ3 4.48Å; W483-W486 HydrophobicContact CH2-CZ3 4.09Å; W483-W486 HydrophobicContact CZ3-CE3 4.25Å; W483-W486 HydrophobicContact CZ3-CZ3 4.01Å; W483-W486 PolarHBondContact O-N 2.9Å; W483-A487 VanDerWaalsContact O-CB 3.27Å; W483-A487 WeakPolarHBondContact O-CB 3.48Å; W483-A487 PolarHBondContact O-N 2.71Å; W483-Q514 PolarHBondContact NE1-O 3.31Å; W483-L517 HydrophobicContact CB-CD1 4.25Å; W483-L517 HydrophobicContact CB-CD2 4.34Å; W483-L517 HydrophobicContact CB-CG 4.35Å; W483-L517 HydrophobicContact CD2-CD2 3.46Å; W483-L517 VanDerWaalsContact CD2-CD2 3.46Å; W483-L517 HydrophobicContact CD2-CG 4.21Å; W483-L517 HydrophobicContact CE3-CD2 3.97Å; W483-L517 HydrophobicContact CG-CD1 4.24Å; W483-L517 HydrophobicContact CG-CD2 3.59Å; W483-L517 HydrophobicContact CG-CG 3.8Å; W483-L517 HydrophobicContact CZ2-CD2 4.22Å; W483-L525 HydrophobicContact CE3-CD1 4.41Å; W483-L525 HydrophobicContact CH2-CD1 3.58Å; W483-L525 HydrophobicContact CZ2-CD1 4Å; W483-L525 HydrophobicContact CZ3-CD1 3.82Å; W483-L529 HydrophobicContact CE3-CD2 4.27Å; W483-L529 HydrophobicContact CZ3-CD2 4.04Å; W483-L529 HydrophobicContact CZ3-CG 4.16Å; W483-M532 HydrophobicContact CB-CE 4.45Å; W483-M532 HydrophobicContact CE3-SD 3.76Å; W483-M532 HydrophobicContact CZ3-SD 4.37Å; W483-I556 HydrophobicContact CB-CD1 4.34Å
484	K	96	Very high	94.6	Very high	64 Å²	64	47.8 Å²	47.8	28%	0.278	24%	0.242	S	C	.	.	H	α-helix	trans	-58.2	-51.1	-179.6	-77.8	168.7	178.7	169.6	0	112.2	L480 E481 W486 A487 Q488 E515	L480-K484 HydrophobicContact CD1-CD 4.48Å; L480-K484 HydrophobicContact CG-CD 4.2Å; L480-K484 WeakPolarHBondContact O-CG 3.48Å; L480-K484 PolarHBondContact O-N 3.32Å; E481-K484 PolarHBondContact O-N 2.74Å; K484-W486 VanDerWaalsContact C-N 3.33Å; K484-W486 PolarHBondContact O-N 3.39Å; K484-A487 PolarHBondContact O-N 3.09Å; K484-Q488 WeakPolarHBondContact O-CB 3.22Å; K484-Q488 VanDerWaalsContact O-CG 3.31Å; K484-Q488 WeakPolarHBondContact O-CG 3.31Å; K484-Q488 PolarHBondContact O-N 3.37Å; K484-E515 VanDerWaalsContact CG-O 3.28Å; K484-E515 WeakPolarHBondContact CG-O 3.49Å
485	N	94.9	Very high	94.3	Very high	75 Å²	75	52.2 Å²	52.2	40%	0.401	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-39.6	-178.6	-75.7	-79.9	0	0	0	111.6	E481 T489	E481-N485 PolarHBondContact O-N 3.02Å; E481-N485 PolarHBondContact O-ND2 3.13Å; E481-N485 PolarHBondContact OE1-ND2 2.74Å; N485-T489 WeakPolarHBondContact O-CB 3.23Å; N485-T489 PolarHBondContact O-N 2.98Å; N485-T489 VanDerWaalsContact O-N 3.1Å; N485-T489 PolarHBondContact O-OG1 3.06Å
486	W	96.3	Very high	94	Very high	19 Å²	19	55 Å²	55	7%	0.072	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-48.6	172.5	175.2	78.2	0	0	0	112.1	V482 W483 K484 T489 K490 F513 G528 L531 M532	V482-W486 WeakPolarHBondContact O-CB 3.19Å; V482-W486 PolarHBondContact O-N 2.68Å; W483-W486 HydrophobicContact CE3-CE3 4.28Å; W483-W486 HydrophobicContact CE3-CZ3 4.48Å; W483-W486 HydrophobicContact CH2-CZ3 4.09Å; W483-W486 HydrophobicContact CZ3-CE3 4.25Å; W483-W486 HydrophobicContact CZ3-CZ3 4.01Å; W483-W486 PolarHBondContact O-N 2.9Å; K484-W486 VanDerWaalsContact C-N 3.33Å; K484-W486 PolarHBondContact O-N 3.39Å; W486-T489 PolarHBondContact O-N 3.33Å; W486-K490 HydrophobicContact CH2-CB 4.4Å; W486-K490 HydrophobicContact CH2-CG 4.28Å; W486-K490 HydrophobicContact CZ2-CB 4.04Å; W486-K490 HydrophobicContact CZ2-CG 3.86Å; W486-K490 WeakPolarHBondContact O-CB 3.48Å; W486-K490 PolarHBondContact O-N 3.22Å; W486-F513 HydrophobicContact CH2-CD1 4.33Å; W486-F513 HydrophobicContact CH2-CD2 4.07Å; W486-F513 HydrophobicContact CH2-CE1 4.25Å; W486-F513 AromaticContact CH2-CE2 3.99Å; W486-F513 HydrophobicContact CH2-CE2 3.99Å; W486-F513 HydrophobicContact CH2-CG 4.24Å; W486-F513 HydrophobicContact CH2-CZ 4.09Å; W486-F513 HydrophobicContact CZ3-CD1 4.4Å; W486-F513 HydrophobicContact CZ3-CD2 4.42Å; W486-F513 HydrophobicContact CZ3-CG 4.24Å; W486-G528 WeakPolarHBondContact CH2-O 3.32Å; W486-L531 HydrophobicContact CH2-CB 4.04Å; W486-L531 HydrophobicContact CH2-CD1 4.43Å; W486-L531 HydrophobicContact CZ2-CB 3.53Å; W486-L531 HydrophobicContact CZ2-CD1 4.3Å; W486-M532 HydrophobicContact CD2-CB 3.94Å; W486-M532 HydrophobicContact CD2-CG 4.11Å; W486-M532 HydrophobicContact CE3-CB 4.18Å; W486-M532 HydrophobicContact CE3-CG 4.43Å; W486-M532 HydrophobicContact CG-CB 4.39Å; W486-M532 HydrophobicContact CG-CG 4.1Å
487	A	96	Very high	93.5	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-43.4	-178.3	0	0	0	0	0	112.2	W483 K484 K490 N491 F513 E515	W483-A487 VanDerWaalsContact O-CB 3.27Å; W483-A487 WeakPolarHBondContact O-CB 3.48Å; W483-A487 PolarHBondContact O-N 2.71Å; K484-A487 PolarHBondContact O-N 3.09Å; A487-K490 PolarHBondContact O-N 3.02Å; A487-N491 VanDerWaalsContact O-CB 3.29Å; A487-N491 WeakPolarHBondContact O-CB 3.36Å; A487-N491 PolarHBondContact O-N 2.88Å; A487-N491 PolarHBondContact O-ND2 2.9Å; A487-N491 VanDerWaalsContact O-ND2 3.13Å; A487-F513 HydrophobicContact CB-CB 4.18Å; A487-E515 HydrophobicContact CB-CG 4.39Å
488	Q	94.9	Very high	92.8	Very high	90 Å²	90	53.9 Å²	53.9	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-48.1	174.5	-74.7	176.1	0.6	0	0	111.7	K484 K490 N491 A492 E515	K484-Q488 WeakPolarHBondContact O-CB 3.22Å; K484-Q488 VanDerWaalsContact O-CG 3.31Å; K484-Q488 WeakPolarHBondContact O-CG 3.31Å; K484-Q488 PolarHBondContact O-N 3.37Å; Q488-K490 VanDerWaalsContact C-N 3.32Å; Q488-K490 PolarHBondContact O-N 2.85Å; Q488-N491 PolarHBondContact O-N 3.21Å; Q488-A492 PolarHBondContact O-N 3.22Å; Q488-E515 VanDerWaalsContact CG-CD 3.42Å; Q488-E515 HydrophobicContact CG-CG 3.92Å; Q488-E515 VanDerWaalsContact CG-OE2 3.27Å; Q488-E515 WeakPolarHBondContact CG-OE2 3.48Å; Q488-E515 PolarHBondContact NE2-OE2 2.87Å
489	T	94.1	Very high	91.8	Very high	87 Å²	87	58.7 Å²	58.7	53%	0.534	30%	0.3	S	S	.	.	H	α-helix	trans	-59.2	-45.4	176.2	-57.6	0	0	0	0	110.6	N485 W486 A492 E493	N485-T489 WeakPolarHBondContact O-CB 3.23Å; N485-T489 PolarHBondContact O-N 2.98Å; N485-T489 VanDerWaalsContact O-N 3.1Å; N485-T489 PolarHBondContact O-OG1 3.06Å; W486-T489 PolarHBondContact O-N 3.33Å; T489-A492 PolarHBondContact O-N 3.47Å; T489-E493 PolarHBondContact O-N 2.85Å
490	K	94.4	Very high	90.6	Very high	25 Å²	25	64.9 Å²	64.9	11%	0.109	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-37	-178.5	-163.2	54.8	164.6	-162.2	0	113.2	W486 A487 Q488 A492 E493 L494 F513 E535	W486-K490 HydrophobicContact CH2-CB 4.4Å; W486-K490 HydrophobicContact CH2-CG 4.28Å; W486-K490 HydrophobicContact CZ2-CB 4.04Å; W486-K490 HydrophobicContact CZ2-CG 3.86Å; W486-K490 WeakPolarHBondContact O-CB 3.48Å; W486-K490 PolarHBondContact O-N 3.22Å; A487-K490 PolarHBondContact O-N 3.02Å; Q488-K490 VanDerWaalsContact C-N 3.32Å; Q488-K490 PolarHBondContact O-N 2.85Å; K490-A492 VanDerWaalsContact C-N 3.35Å; K490-E493 HydrophobicContact CD-CB 4.44Å; K490-E493 WeakPolarHBondContact CD-OE2 3.42Å; K490-E493 WeakPolarHBondContact CE-OE2 3.42Å; K490-E493 IonicContact NZ-OE2 3.18Å; K490-E493 PolarHBondContact NZ-OE2 3.39Å; K490-E493 PolarHBondContact O-N 3.41Å; K490-L494 HydrophobicContact CG-CD1 4.35Å; K490-L494 VanDerWaalsContact O-CG 3.3Å; K490-L494 WeakPolarHBondContact O-CG 3.47Å; K490-L494 PolarHBondContact O-N 3.07Å; K490-F513 HydrophobicContact CB-CD2 4.42Å; K490-F513 HydrophobicContact CG-CD2 4.16Å; K490-F513 HydrophobicContact CG-CE2 3.88Å; K490-E535 WeakPolarHBondContact CE-OE2 3.44Å; K490-E535 IonicContact NZ-OE1 3.64Å; K490-E535 PolarHBondContact NZ-OE1 2.8Å; K490-E535 IonicContact NZ-OE2 3.88Å; K490-E535 PolarHBondContact NZ-OE2 3.27Å
491	N	94.1	Very high	89.2	Confident	3 Å²	3	71.8 Å²	71.8	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-61.9	-43.2	173	-71.6	-25.9	0	0	0	110.8	A487 Q488 L494 E495 R512 F513	A487-N491 VanDerWaalsContact O-CB 3.29Å; A487-N491 WeakPolarHBondContact O-CB 3.36Å; A487-N491 PolarHBondContact O-N 2.88Å; A487-N491 PolarHBondContact O-ND2 2.9Å; A487-N491 VanDerWaalsContact O-ND2 3.13Å; Q488-N491 PolarHBondContact O-N 3.21Å; N491-L494 PolarHBondContact O-N 3.44Å; N491-E495 WeakPolarHBondContact O-CB 3.48Å; N491-E495 WeakPolarHBondContact O-CG 3.34Å; N491-E495 PolarHBondContact O-N 3.49Å; N491-R512 HydrophobicContact CB-CG 4.23Å; N491-R512 WeakPolarHBondContact ND2-CG 3.44Å; N491-R512 WeakPolarHBondContact OD1-CA 3.26Å; N491-R512 VanDerWaalsContact OD1-CG 3.29Å; N491-R512 WeakPolarHBondContact OD1-CG 3.48Å; N491-F513 PolarHBondContact ND2-O 2.88Å; N491-F513 PolarHBondContact OD1-N 2.7Å
492	A	93.1	Very high	87.8	Confident	56 Å²	56	75.4 Å²	75.4	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-65.8	-36.1	175.8	0	0	0	0	0	113.2	Q488 T489 K490 K496	Q488-A492 PolarHBondContact O-N 3.22Å; T489-A492 PolarHBondContact O-N 3.47Å; K490-A492 VanDerWaalsContact C-N 3.35Å; A492-K496 VanDerWaalsContact O-CB 3.28Å; A492-K496 WeakPolarHBondContact O-CB 3.31Å; A492-K496 PolarHBondContact O-N 3.23Å
493	E	90.9	Very high	86.1	Confident	100 Å²	100	78.2 Å²	78.2	47%	0.467	41%	0.406	S	S	.	.	H	α-helix	trans	-61.7	-45.9	170.4	-71.7	-172	164.1	0	0	112.1	T489 K490 K496 D497	T489-E493 PolarHBondContact O-N 2.85Å; K490-E493 HydrophobicContact CD-CB 4.44Å; K490-E493 WeakPolarHBondContact CD-OE2 3.42Å; K490-E493 WeakPolarHBondContact CE-OE2 3.42Å; K490-E493 IonicContact NZ-OE2 3.18Å; K490-E493 PolarHBondContact NZ-OE2 3.39Å; K490-E493 PolarHBondContact O-N 3.41Å; E493-K496 WeakPolarHBondContact O-CB 3.42Å; E493-K496 PolarHBondContact O-N 3.13Å; E493-D497 PolarHBondContact O-N 2.96Å
494	L	89.3	Confident	84.1	Confident	43 Å²	43	82.9 Å²	82.9	23%	0.225	44%	0.436	C	S	.	.	H	α-helix	trans	-68.6	-39.6	-178.1	-70.9	170.6	0	0	0	112.2	K490 N491 K496 D497 A498 L511 F513	K490-L494 HydrophobicContact CG-CD1 4.35Å; K490-L494 VanDerWaalsContact O-CG 3.3Å; K490-L494 WeakPolarHBondContact O-CG 3.47Å; K490-L494 PolarHBondContact O-N 3.07Å; N491-L494 PolarHBondContact O-N 3.44Å; L494-K496 VanDerWaalsContact C-N 3.31Å; L494-K496 PolarHBondContact O-N 3.36Å; L494-D497 PolarHBondContact O-N 3.4Å; L494-A498 VanDerWaalsContact O-CB 3.23Å; L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 2.85Å; L494-L511 WeakPolarHBondContact CD1-O 3.44Å; L494-F513 HydrophobicContact CD1-CD2 4.4Å; L494-F513 HydrophobicContact CD1-CE2 4Å
495	E	87.8	Confident	82.4	Confident	97 Å²	97	88.8 Å²	88.8	45%	0.453	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-40.9	170.9	-74.5	173.7	-156.8	0	0	111.3	N491 A498 Q499 L510 R512	N491-E495 WeakPolarHBondContact O-CB 3.48Å; N491-E495 WeakPolarHBondContact O-CG 3.34Å; N491-E495 PolarHBondContact O-N 3.49Å; E495-A498 PolarHBondContact O-N 2.88Å; E495-Q499 WeakPolarHBondContact O-CB 3.4Å; E495-Q499 PolarHBondContact O-N 2.94Å; E495-L510 HydrophobicContact CG-CD2 4.1Å; E495-R512 IonicContact OE1-CZ 3.3Å; E495-R512 IonicContact OE1-NH1 2.65Å; E495-R512 PolarHBondContact OE1-NH1 2.85Å
496	K	87.9	Confident	80.5	Confident	150 Å²	150	87.8 Å²	87.8	65%	0.652	48%	0.476	S	S	*	.	H	α-helix	trans	-68	-42.5	177.9	-173.2	178.9	178.5	-176.6	0	112.8	A492 E493 L494 Q499 N500	A492-K496 VanDerWaalsContact O-CB 3.28Å; A492-K496 WeakPolarHBondContact O-CB 3.31Å; A492-K496 PolarHBondContact O-N 3.23Å; E493-K496 WeakPolarHBondContact O-CB 3.42Å; E493-K496 PolarHBondContact O-N 3.13Å; L494-K496 VanDerWaalsContact C-N 3.31Å; L494-K496 PolarHBondContact O-N 3.36Å; K496-Q499 PolarHBondContact O-N 2.7Å; K496-N500 PolarHBondContact O-N 2.94Å; K496-N500 PolarHBondContact O-ND2 2.84Å
497	D	83.3	Confident	78.6	Confident	73 Å²	73	98.8 Å²	98.8	39%	0.39	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-40.7	173.9	-175.4	58.9	0	0	0	111.1	E493 L494 Q499 N500 R501	E493-D497 PolarHBondContact O-N 2.96Å; L494-D497 PolarHBondContact O-N 3.4Å; D497-Q499 VanDerWaalsContact C-N 3.34Å; D497-Q499 PolarHBondContact O-N 3.37Å; D497-N500 CarbonylContact O-C 3.55Å; D497-N500 PolarHBondContact O-N 3.15Å; D497-N500 VanDerWaalsContact O-N 3.09Å; D497-R501 WeakPolarHBondContact O-CG 3.46Å; D497-R501 PolarHBondContact O-N 3.42Å; D497-R501 IonicContact OD1-CZ 3.39Å; D497-R501 IonicContact OD1-NE 3.85Å; D497-R501 PolarHBondContact OD1-NE 3.2Å; D497-R501 IonicContact OD1-NH2 3.85Å; D497-R501 PolarHBondContact OD1-NH2 2.8Å; D497-R501 IonicContact OD2-CZ 2.78Å; D497-R501 IonicContact OD2-NE 3.16Å; D497-R501 PolarHBondContact OD2-NE 3.46Å; D497-R501 IonicContact OD2-NH2 2.78Å; D497-R501 PolarHBondContact OD2-NH2 3.4Å
498	A	79.8	Confident	76.8	Confident	38 Å²	38	109.8 Å²	109.8	31%	0.314	56%	0.559	S	S	.	*	H	α-helix	trans	-59.4	-42.8	175.2	0	0	0	0	0	112.3	L494 E495 N500 R501 L510	L494-A498 VanDerWaalsContact O-CB 3.23Å; L494-A498 WeakPolarHBondContact O-CB 3.47Å; L494-A498 PolarHBondContact O-N 2.85Å; E495-A498 PolarHBondContact O-N 2.88Å; A498-N500 PolarHBondContact O-N 3.24Å; A498-R501 PolarHBondContact O-N 2.97Å; A498-R501 VanDerWaalsContact O-N 3.14Å; A498-R501 VanDerWaalsContact O-O 3.1Å; A498-L510 HydrophobicContact CB-CD1 3.85Å; A498-L510 HydrophobicContact CB-CD2 3.72Å; A498-L510 HydrophobicContact CB-CG 4.43Å
499	Q	74.1	Confident	75.2	Confident	171 Å²	171	113.9 Å²	113.9	80%	0.799	58%	0.579	S	S	*	*	H	α-helix	trans	-68.1	-21	177.2	-163.7	66.2	10.7	0	0	113.2	E495 K496 D497	E495-Q499 WeakPolarHBondContact O-CB 3.4Å; E495-Q499 PolarHBondContact O-N 2.94Å; K496-Q499 PolarHBondContact O-N 2.7Å; D497-Q499 VanDerWaalsContact C-N 3.34Å; D497-Q499 PolarHBondContact O-N 3.37Å
500	N	70.6	Confident	74	Confident	131 Å²	131	113.6 Å²	113.6	70%	0.701	57%	0.573	S	S	*	*	H	α-helix	trans	-90.6	-5	174.2	-77.6	-81	0	0	0	113.5	K496 D497 A498	K496-N500 PolarHBondContact O-N 2.94Å; K496-N500 PolarHBondContact O-ND2 2.84Å; D497-N500 CarbonylContact O-C 3.55Å; D497-N500 PolarHBondContact O-N 3.15Å; D497-N500 VanDerWaalsContact O-N 3.09Å; A498-N500 PolarHBondContact O-N 3.24Å
501	R	67.3	Low	73.3	Confident	162 Å²	162	116.2 Å²	116.2	61%	0.611	59%	0.588	S	S	*	*	S	Bend	trans	-105.1	141.4	174.7	-67.3	-177.8	-164.2	-122.5	3.2	110.9	D497 A498 A503	D497-R501 WeakPolarHBondContact O-CG 3.46Å; D497-R501 PolarHBondContact O-N 3.42Å; D497-R501 IonicContact OD1-CZ 3.39Å; D497-R501 IonicContact OD1-NE 3.85Å; D497-R501 PolarHBondContact OD1-NE 3.2Å; D497-R501 IonicContact OD1-NH2 3.85Å; D497-R501 PolarHBondContact OD1-NH2 2.8Å; D497-R501 IonicContact OD2-CZ 2.78Å; D497-R501 IonicContact OD2-NE 3.16Å; D497-R501 PolarHBondContact OD2-NE 3.46Å; D497-R501 IonicContact OD2-NH2 2.78Å; D497-R501 PolarHBondContact OD2-NH2 3.4Å; A498-R501 PolarHBondContact O-N 2.97Å; A498-R501 VanDerWaalsContact O-N 3.14Å; A498-R501 VanDerWaalsContact O-O 3.1Å; R501-A503 PolarHBondContact O-N 3.07Å
502	L	65.4	Low	73	Confident	172 Å²	172	121.4 Å²	121.4	90%	0.901	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.3	166.2	-72.1	169.2	0	0	0	109.1
503	A	60.6	Low	73	Confident	87 Å²	87	118.8 Å²	118.8	72%	0.719	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-52.1	124.9	-174.6	0	0	0	0	0	111.2	R501 I505	R501-A503 PolarHBondContact O-N 3.07Å; A503-I505 PolarHBondContact O-N 2.67Å
504	P	56.4	Low	73.1	Confident	98 Å²	98	117.9 Å²	117.9	64%	0.636	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-56.2	138.8	179.5	-27.1	35.1	0	0	0	112	G506	P504-G506 PolarHBondContact O-N 3.32Å
505	I	58.7	Low	73.3	Confident	188 Å²	188	118.6 Å²	118.6	96%	0.964	58%	0.583	S	S	*	*	S	Bend	trans	-75.1	77.7	175.7	-54.6	178.5	0	0	0	108.7	A503	A503-I505 PolarHBondContact O-N 2.67Å
506	G	56.8	Low	73.5	Confident	54 Å²	54	116.6 Å²	116.6	56%	0.557	58%	0.576	S	S	*	*	S	Bend	trans	156.2	144.7	-179	0	0	0	0	0	111.9	P504 R508	P504-G506 PolarHBondContact O-N 3.32Å; G506-R508 PolarHBondContact O-N 3.13Å
507	R	55.6	Low	73.8	Confident	250 Å²	250	109.4 Å²	109.4	94%	0.943	55%	0.545	S	S	*	.			trans	-72.5	63.6	-179.8	-63.8	-173.8	-177.7	-173.6	1.1	112.8
508	R	57.5	Low	74.3	Confident	231 Å²	231	108.7 Å²	108.7	87%	0.872	54%	0.54	S	S	*	.			trans	-83.4	110.6	161.4	-79.9	-172.7	171.2	174.1	-2	108.2	G506 L510	G506-R508 PolarHBondContact O-N 3.13Å; R508-L510 PolarHBondContact O-N 2.82Å
509	Q	62.7	Low	74.9	Confident	176 Å²	176	110.8 Å²	110.8	82%	0.822	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-53.5	135.6	166.1	-166.5	69.3	24.9	0	0	108.2	L511	Q509-L511 PolarHBondContact O-N 3.26Å
510	L	67.4	Low	75.8	Confident	80 Å²	80	102.8 Å²	102.8	42%	0.419	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-62.7	137.1	172.4	-175.8	61.4	0	0	0	108.8	E495 A498 R508 R512	E495-L510 HydrophobicContact CG-CD2 4.1Å; A498-L510 HydrophobicContact CB-CD1 3.85Å; A498-L510 HydrophobicContact CB-CD2 3.72Å; A498-L510 HydrophobicContact CB-CG 4.43Å; R508-L510 PolarHBondContact O-N 2.82Å; L510-R512 PolarHBondContact O-N 3.06Å
511	L	79.9	Confident	76.9	Confident	81 Å²	81	99.2 Å²	99.2	42%	0.424	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-64.5	124.4	173.8	-178.1	67.6	0	0	0	108.7	L494 Q509 F513 Y527	L494-L511 WeakPolarHBondContact CD1-O 3.44Å; Q509-L511 PolarHBondContact O-N 3.26Å; L511-F513 HydrophobicContact CD2-CE2 4.31Å; L511-F513 HydrophobicContact CD2-CZ 3.96Å; L511-Y527 HydrophobicContact CD2-CD1 4.1Å; L511-Y527 HydrophobicContact CD2-CE1 3.69Å
512	R	88	Confident	78.2	Confident	111 Å²	111	93.3 Å²	93.3	42%	0.419	49%	0.486	S	S	.	.			trans	-128.9	131.9	171.2	-169.9	-167.9	-174.6	82.9	7.8	107.4	N491 E495 L510 E515	N491-R512 HydrophobicContact CB-CG 4.23Å; N491-R512 WeakPolarHBondContact ND2-CG 3.44Å; N491-R512 WeakPolarHBondContact OD1-CA 3.26Å; N491-R512 VanDerWaalsContact OD1-CG 3.29Å; N491-R512 WeakPolarHBondContact OD1-CG 3.48Å; E495-R512 IonicContact OE1-CZ 3.3Å; E495-R512 IonicContact OE1-NH1 2.65Å; E495-R512 PolarHBondContact OE1-NH1 2.85Å; L510-R512 PolarHBondContact O-N 3.06Å; R512-E515 IonicContact CZ-OE1 3.41Å; R512-E515 IonicContact NE-OE1 2.74Å; R512-E515 IonicContact NH2-OE1 3.7Å; R512-E515 PolarHBondContact NH2-OE1 3.23Å
513	F	92.8	Very high	79.5	Confident	1 Å²	1	88.9 Å²	88.9	0%	0.004	47%	0.474	C	S	.	.			trans	-81.3	135.2	173	-64.5	-79.1	0	0	0	110.5	W486 A487 K490 N491 L494 L511 E524 Y527 L531	W486-F513 HydrophobicContact CH2-CD1 4.33Å; W486-F513 HydrophobicContact CH2-CD2 4.07Å; W486-F513 HydrophobicContact CH2-CE1 4.25Å; W486-F513 AromaticContact CH2-CE2 3.99Å; W486-F513 HydrophobicContact CH2-CE2 3.99Å; W486-F513 HydrophobicContact CH2-CG 4.24Å; W486-F513 HydrophobicContact CH2-CZ 4.09Å; W486-F513 HydrophobicContact CZ3-CD1 4.4Å; W486-F513 HydrophobicContact CZ3-CD2 4.42Å; W486-F513 HydrophobicContact CZ3-CG 4.24Å; A487-F513 HydrophobicContact CB-CB 4.18Å; K490-F513 HydrophobicContact CB-CD2 4.42Å; K490-F513 HydrophobicContact CG-CD2 4.16Å; K490-F513 HydrophobicContact CG-CE2 3.88Å; N491-F513 PolarHBondContact ND2-O 2.88Å; N491-F513 PolarHBondContact OD1-N 2.7Å; L494-F513 HydrophobicContact CD1-CD2 4.4Å; L494-F513 HydrophobicContact CD1-CE2 4Å; L511-F513 HydrophobicContact CD2-CE2 4.31Å; L511-F513 HydrophobicContact CD2-CZ 3.96Å; F513-E524 WeakPolarHBondContact CA-OE1 3.31Å; F513-E524 HydrophobicContact CD1-CG 4.26Å; F513-Y527 AromaticContact CE1-CD1 3.79Å; F513-Y527 HydrophobicContact CE1-CD1 3.79Å; F513-Y527 HydrophobicContact CE1-CE1 4.39Å; F513-Y527 AromaticContact CZ-CD1 3.73Å; F513-Y527 HydrophobicContact CZ-CD1 3.73Å; F513-Y527 AromaticContact CZ-CE1 3.86Å; F513-Y527 HydrophobicContact CZ-CE1 3.86Å; F513-L531 HydrophobicContact CE2-CD1 4.24Å; F513-L531 HydrophobicContact CZ-CD1 3.73Å
514	Q	93.3	Very high	81.1	Confident	81 Å²	81	86.6 Å²	86.6	38%	0.379	45%	0.449	S	S	.	.			trans	-65.5	132.9	170.5	-58.2	-44	-51.2	0	0	111.1	W483 D516 E524	W483-Q514 PolarHBondContact NE1-O 3.31Å; Q514-D516 VanDerWaalsContact C-N 3.32Å; Q514-E524 WeakPolarHBondContact CG-OE1 3.37Å; Q514-E524 PolarHBondContact N-OE1 3.16Å
515	E	93.1	Very high	83	Confident	58 Å²	58	82 Å²	82	27%	0.271	42%	0.418	S	S	.	.	S	Bend	trans	-80.4	-19.4	176.5	-62.9	165.6	-139.9	0	0	111.3	K484 A487 Q488 R512	K484-E515 VanDerWaalsContact CG-O 3.28Å; K484-E515 WeakPolarHBondContact CG-O 3.49Å; A487-E515 HydrophobicContact CB-CG 4.39Å; Q488-E515 VanDerWaalsContact CG-CD 3.42Å; Q488-E515 HydrophobicContact CG-CG 3.92Å; Q488-E515 VanDerWaalsContact CG-OE2 3.27Å; Q488-E515 WeakPolarHBondContact CG-OE2 3.48Å; Q488-E515 PolarHBondContact NE2-OE2 2.87Å; R512-E515 IonicContact CZ-OE1 3.41Å; R512-E515 IonicContact NE-OE1 2.74Å; R512-E515 IonicContact NH2-OE1 3.7Å; R512-E515 PolarHBondContact NH2-OE1 3.23Å
516	D	92.6	Very high	84.8	Confident	55 Å²	55	74 Å²	74	29%	0.294	38%	0.378	S	S	.	.	S	Bend	trans	-93.3	114.4	166.6	169	34.5	0	0	0	111.2	Q514 I518 S519 S520	Q514-D516 VanDerWaalsContact C-N 3.32Å; D516-I518 PolarHBondContact O-N 2.89Å; D516-I518 WeakPolarHBondContact OD1-CB 3.42Å; D516-I518 PolarHBondContact OD1-N 3Å; D516-S519 PolarHBondContact O-N 2.94Å; D516-S519 WeakPolarHBondContact OD2-CB 3.3Å; D516-S519 PolarHBondContact OD2-N 3.43Å; D516-S519 PolarHBondContact OD2-OG 2.83Å; D516-S520 PolarHBondContact O-N 3.44Å; D516-S520 PolarHBondContact O-OG 3.1Å; D516-S520 VanDerWaalsContact O-OG 3.06Å
517	L	93.5	Very high	86.7	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.9	175.5	-77.4	170.7	0	0	0	114.2	L480 W483 L525 I556 Y559 L560 R565	L480-L517 HydrophobicContact CD1-CB 4.47Å; L480-L517 HydrophobicContact CD1-CD1 3.83Å; L480-L517 HydrophobicContact CD1-CG 4.17Å; W483-L517 HydrophobicContact CB-CD1 4.25Å; W483-L517 HydrophobicContact CB-CD2 4.34Å; W483-L517 HydrophobicContact CB-CG 4.35Å; W483-L517 HydrophobicContact CD2-CD2 3.46Å; W483-L517 VanDerWaalsContact CD2-CD2 3.46Å; W483-L517 HydrophobicContact CD2-CG 4.21Å; W483-L517 HydrophobicContact CE3-CD2 3.97Å; W483-L517 HydrophobicContact CG-CD1 4.24Å; W483-L517 HydrophobicContact CG-CD2 3.59Å; W483-L517 HydrophobicContact CG-CG 3.8Å; W483-L517 HydrophobicContact CZ2-CD2 4.22Å; L517-L525 HydrophobicContact CD2-CD1 3.52Å; L517-I556 HydrophobicContact CD1-CG1 4.15Å; L517-I556 HydrophobicContact CD1-CG2 4.1Å; L517-I556 HydrophobicContact CD2-CG2 4.29Å; L517-Y559 HydrophobicContact CB-CD1 4.06Å; L517-Y559 HydrophobicContact CB-CE1 4.02Å; L517-Y559 HydrophobicContact CD1-CD1 3.78Å; L517-Y559 HydrophobicContact CD1-CE1 4.32Å; L517-L560 HydrophobicContact CB-CD2 3.8Å; L517-L560 HydrophobicContact CD1-CD2 4.5Å; L517-R565 PolarHBondContact O-NH1 3.1Å
518	I	94.8	Very high	88.6	Confident	57 Å²	57	64.7 Å²	64.7	29%	0.292	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-40.1	-177.5	-50.4	-51.1	0	0	0	110.4	D516 Y559 L560 N563	D516-I518 PolarHBondContact O-N 2.89Å; D516-I518 WeakPolarHBondContact OD1-CB 3.42Å; D516-I518 PolarHBondContact OD1-N 3Å; I518-Y559 HydrophobicContact CD1-CD1 4.03Å; I518-Y559 HydrophobicContact CD1-CE1 3.65Å; I518-Y559 HydrophobicContact CG1-CE1 3.81Å; I518-L560 HydrophobicContact CD1-CD2 4.14Å; I518-N563 HydrophobicContact CD1-CB 3.59Å; I518-N563 HydrophobicContact CG1-CB 3.97Å
519	S	92.1	Very high	90.5	Very high	82 Å²	82	53.7 Å²	53.7	57%	0.573	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.9	174.8	-61.4	0	0	0	0	114.6	D516 A521	D516-S519 PolarHBondContact O-N 2.94Å; D516-S519 WeakPolarHBondContact OD2-CB 3.3Å; D516-S519 PolarHBondContact OD2-N 3.43Å; D516-S519 PolarHBondContact OD2-OG 2.83Å; S519-A521 PolarHBondContact O-N 2.72Å
520	S	92.8	Very high	92.2	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.021	25%	0.248	C	C	.	.	S	Bend	trans	-56.8	126.5	179.1	-62	0	0	0	0	113.3	D516 R565	D516-S520 PolarHBondContact O-N 3.44Å; D516-S520 PolarHBondContact O-OG 3.1Å; D516-S520 VanDerWaalsContact O-OG 3.06Å; S520-R565 PolarHBondContact O-NH1 2.74Å; S520-R565 PolarHBondContact O-NH2 3.33Å
521	A	93.3	Very high	93.5	Very high	56 Å²	56	43.3 Å²	43.3	46%	0.463	24%	0.236	S	C	.	.			trans	-63.7	144.8	171.5	0	0	0	0	0	111.3	S519 A523 E524 L525	S519-A521 PolarHBondContact O-N 2.72Å; A521-A523 VanDerWaalsContact C-N 3.31Å; A521-A523 PolarHBondContact O-N 3.33Å; A521-E524 HydrophobicContact CB-CB 4.14Å; A521-E524 WeakPolarHBondContact O-CA 3.27Å; A521-E524 WeakPolarHBondContact O-CB 3.27Å; A521-E524 PolarHBondContact O-N 3.3Å; A521-L525 PolarHBondContact O-N 2.69Å
522	V	94.5	Very high	94.3	Very high	38 Å²	38	39.5 Å²	39.5	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-49.7	-47.6	-176.3	-175.3	0	0	0	0	112.8	E524 L525 N526 Y574 Y575	V522-E524 VanDerWaalsContact C-N 3.34Å; V522-E524 PolarHBondContact O-N 2.92Å; V522-L525 PolarHBondContact O-N 2.83Å; V522-N526 WeakPolarHBondContact O-CB 3.49Å; V522-N526 PolarHBondContact O-N 3.49Å; V522-Y574 HydrophobicContact CG1-CD2 4.27Å; V522-Y574 HydrophobicContact CG1-CG 3.9Å; V522-Y575 HydrophobicContact CG1-CE2 3.86Å
523	A	93.9	Very high	94.7	Very high	79 Å²	79	34.5 Å²	34.5	65%	0.653	20%	0.198	S	C	*	.	H	α-helix	trans	-69.4	-29.8	179.3	0	0	0	0	0	113.6	A521 Y527	A521-A523 VanDerWaalsContact C-N 3.31Å; A521-A523 PolarHBondContact O-N 3.33Å; A523-Y527 WeakPolarHBondContact O-CB 3.46Å; A523-Y527 PolarHBondContact O-N 3.22Å
524	E	93.6	Very high	94.6	Very high	40 Å²	40	41.6 Å²	41.6	19%	0.187	23%	0.225	C	C	.	.	H	α-helix	trans	-74.3	-43.8	176.3	-170.6	-168.8	145.3	0	0	110.6	F513 Q514 A521 V522 Y527 G528	F513-E524 WeakPolarHBondContact CA-OE1 3.31Å; F513-E524 HydrophobicContact CD1-CG 4.26Å; Q514-E524 WeakPolarHBondContact CG-OE1 3.37Å; Q514-E524 PolarHBondContact N-OE1 3.16Å; A521-E524 HydrophobicContact CB-CB 4.14Å; A521-E524 WeakPolarHBondContact O-CA 3.27Å; A521-E524 WeakPolarHBondContact O-CB 3.27Å; A521-E524 PolarHBondContact O-N 3.3Å; V522-E524 VanDerWaalsContact C-N 3.34Å; V522-E524 PolarHBondContact O-N 2.92Å; E524-Y527 PolarHBondContact O-N 3.45Å; E524-G528 PolarHBondContact O-N 2.99Å
525	L	96.1	Very high	94.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-49.3	176.1	-177.1	52.1	0	0	0	111.2	W483 L517 A521 V522 Y527 G528 L529 L560 Y575	W483-L525 HydrophobicContact CE3-CD1 4.41Å; W483-L525 HydrophobicContact CH2-CD1 3.58Å; W483-L525 HydrophobicContact CZ2-CD1 4Å; W483-L525 HydrophobicContact CZ3-CD1 3.82Å; L517-L525 HydrophobicContact CD2-CD1 3.52Å; A521-L525 PolarHBondContact O-N 2.69Å; V522-L525 PolarHBondContact O-N 2.83Å; L525-Y527 VanDerWaalsContact C-N 3.33Å; L525-Y527 PolarHBondContact O-N 3.18Å; L525-G528 PolarHBondContact O-N 2.86Å; L525-L529 HydrophobicContact CD1-CD1 4.04Å; L525-L529 HydrophobicContact CD1-CD2 4.48Å; L525-L529 HydrophobicContact CD1-CG 3.99Å; L525-L529 HydrophobicContact CG-CD1 3.99Å; L525-L529 HydrophobicContact CG-CG 4.41Å; L525-L529 WeakPolarHBondContact O-CB 3.4Å; L525-L529 VanDerWaalsContact O-CG 3.26Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 2.87Å; L525-L560 HydrophobicContact CD2-CD1 4.01Å; L525-L560 HydrophobicContact CD2-CD2 4.49Å; L525-Y575 HydrophobicContact CB-CE1 4.38Å; L525-Y575 HydrophobicContact CD2-CE1 4.49Å; L525-Y575 HydrophobicContact CG-CE1 4.13Å
526	N	96.6	Very high	94.7	Very high	22 Å²	22	38.3 Å²	38.3	12%	0.118	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-46.4	174.1	176.6	28.2	0	0	0	111.7	V522 G528 L529 C530 Y574 Y575 F578	V522-N526 WeakPolarHBondContact O-CB 3.49Å; V522-N526 PolarHBondContact O-N 3.49Å; N526-G528 PolarHBondContact O-N 2.8Å; N526-L529 PolarHBondContact O-N 3.12Å; N526-C530 PolarHBondContact O-N 2.6Å; N526-C530 PolarHBondContact O-SG 3.21Å; N526-Y574 VanDerWaalsContact CG-O 3.29Å; N526-Y574 PolarHBondContact ND2-O 3.15Å; N526-Y575 HydrophobicContact CB-CD1 3.61Å; N526-Y575 HydrophobicContact CB-CE1 3.77Å; N526-Y575 HydrophobicContact CB-CG 4.45Å; N526-F578 VanDerWaalsContact OD1-CB 3.31Å; N526-F578 WeakPolarHBondContact OD1-CB 3.36Å; N526-F578 PolarHBondContact OD1-N 2.87Å
527	Y	95.9	Very high	94.7	Very high	107 Å²	107	41 Å²	41	42%	0.42	22%	0.216	S	C	.	.	H	α-helix	trans	-65.4	-39.1	179.2	-175.3	-116.8	0	0	0	112.7	L511 F513 A523 E524 L525 C530 L531	L511-Y527 HydrophobicContact CD2-CD1 4.1Å; L511-Y527 HydrophobicContact CD2-CE1 3.69Å; F513-Y527 AromaticContact CE1-CD1 3.79Å; F513-Y527 HydrophobicContact CE1-CD1 3.79Å; F513-Y527 HydrophobicContact CE1-CE1 4.39Å; F513-Y527 AromaticContact CZ-CD1 3.73Å; F513-Y527 HydrophobicContact CZ-CD1 3.73Å; F513-Y527 AromaticContact CZ-CE1 3.86Å; F513-Y527 HydrophobicContact CZ-CE1 3.86Å; A523-Y527 WeakPolarHBondContact O-CB 3.46Å; A523-Y527 PolarHBondContact O-N 3.22Å; E524-Y527 PolarHBondContact O-N 3.45Å; L525-Y527 VanDerWaalsContact C-N 3.33Å; L525-Y527 PolarHBondContact O-N 3.18Å; Y527-C530 WeakPolarHBondContact O-CB 3.4Å; Y527-C530 PolarHBondContact O-N 3.34Å; Y527-L531 HydrophobicContact CD1-CD1 4.41Å; Y527-L531 HydrophobicContact CE1-CD1 3.84Å; Y527-L531 PolarHBondContact O-N 3.15Å
528	G	96.7	Very high	94.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-47.3	174.1	0	0	0	0	0	112.2	W486 E524 L525 N526 C530 L531 M532	W486-G528 WeakPolarHBondContact CH2-O 3.32Å; E524-G528 PolarHBondContact O-N 2.99Å; L525-G528 PolarHBondContact O-N 2.86Å; N526-G528 PolarHBondContact O-N 2.8Å; G528-C530 VanDerWaalsContact C-N 3.31Å; G528-C530 PolarHBondContact O-N 2.8Å; G528-L531 PolarHBondContact O-N 2.81Å; G528-L531 VanDerWaalsContact O-N 3.07Å; G528-M532 VanDerWaalsContact O-CB 3.3Å; G528-M532 WeakPolarHBondContact O-CB 3.2Å; G528-M532 PolarHBondContact O-N 2.84Å
529	L	97.7	Very high	94.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-39.7	175.9	-68.3	170.5	0	0	0	111.9	W483 L525 N526 L531 M532 T533 F553 I556 I569 Y575 F578	W483-L529 HydrophobicContact CE3-CD2 4.27Å; W483-L529 HydrophobicContact CZ3-CD2 4.04Å; W483-L529 HydrophobicContact CZ3-CG 4.16Å; L525-L529 HydrophobicContact CD1-CD1 4.04Å; L525-L529 HydrophobicContact CD1-CD2 4.48Å; L525-L529 HydrophobicContact CD1-CG 3.99Å; L525-L529 HydrophobicContact CG-CD1 3.99Å; L525-L529 HydrophobicContact CG-CG 4.41Å; L525-L529 WeakPolarHBondContact O-CB 3.4Å; L525-L529 VanDerWaalsContact O-CG 3.26Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 2.87Å; N526-L529 PolarHBondContact O-N 3.12Å; L529-L531 VanDerWaalsContact C-N 3.32Å; L529-L531 PolarHBondContact O-N 3.43Å; L529-M532 HydrophobicContact CD2-SD 4.31Å; L529-M532 PolarHBondContact O-N 3.37Å; L529-T533 WeakPolarHBondContact O-CB 3.17Å; L529-T533 PolarHBondContact O-N 2.89Å; L529-T533 PolarHBondContact O-OG1 2.99Å; L529-F553 HydrophobicContact CD2-CD1 3.8Å; L529-F553 HydrophobicContact CD2-CE1 3.67Å; L529-I556 HydrophobicContact CD2-CD1 4.2Å; L529-I569 HydrophobicContact CD1-CB 4.33Å; L529-I569 HydrophobicContact CD1-CD1 4.22Å; L529-I569 HydrophobicContact CD1-CG2 4.19Å; L529-Y575 HydrophobicContact CD1-CD1 4.19Å; L529-Y575 HydrophobicContact CD1-CE1 4.1Å; L529-F578 HydrophobicContact CB-CB 4.26Å; L529-F578 HydrophobicContact CB-CD2 3.6Å; L529-F578 HydrophobicContact CB-CE2 4.07Å; L529-F578 HydrophobicContact CB-CG 3.88Å; L529-F578 HydrophobicContact CD1-CD1 4.39Å; L529-F578 HydrophobicContact CD1-CG 4.44Å
530	C	97.2	Very high	93.9	Very high	7 Å²	7	49.2 Å²	49.2	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-58.1	-40.6	173.3	-70.1	0	0	0	0	113	N526 Y527 G528 F578	N526-C530 PolarHBondContact O-N 2.6Å; N526-C530 PolarHBondContact O-SG 3.21Å; Y527-C530 WeakPolarHBondContact O-CB 3.4Å; Y527-C530 PolarHBondContact O-N 3.34Å; G528-C530 VanDerWaalsContact C-N 3.31Å; G528-C530 PolarHBondContact O-N 2.8Å; C530-F578 VanDerWaalsContact SG-CA 3.6Å; C530-F578 PolarHBondContact SG-N 3.11Å; C530-F578 VanDerWaalsContact SG-N 3.44Å
531	L	96.2	Very high	93.8	Very high	32 Å²	32	51.2 Å²	51.2	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-76.4	-47	178	-66.2	178.2	0	0	0	111.3	W486 F513 Y527 G528 L529 T533 R534 E535	W486-L531 HydrophobicContact CH2-CB 4.04Å; W486-L531 HydrophobicContact CH2-CD1 4.43Å; W486-L531 HydrophobicContact CZ2-CB 3.53Å; W486-L531 HydrophobicContact CZ2-CD1 4.3Å; F513-L531 HydrophobicContact CE2-CD1 4.24Å; F513-L531 HydrophobicContact CZ-CD1 3.73Å; Y527-L531 HydrophobicContact CD1-CD1 4.41Å; Y527-L531 HydrophobicContact CE1-CD1 3.84Å; Y527-L531 PolarHBondContact O-N 3.15Å; G528-L531 PolarHBondContact O-N 2.81Å; G528-L531 VanDerWaalsContact O-N 3.07Å; L529-L531 VanDerWaalsContact C-N 3.32Å; L529-L531 PolarHBondContact O-N 3.43Å; L531-T533 PolarHBondContact O-N 2.59Å; L531-R534 PolarHBondContact O-N 3Å; L531-E535 WeakPolarHBondContact O-CB 3.43Å; L531-E535 WeakPolarHBondContact O-CG 3.32Å; L531-E535 PolarHBondContact O-N 2.95Å
532	M	96.5	Very high	93.7	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-51.9	-39.9	176.5	-171.8	-174.8	-173.5	0	0	111.9	V482 W483 W486 G528 L529 R534 E535 A536 I552 F553 I556	V482-M532 HydrophobicContact CB-CE 4.21Å; V482-M532 HydrophobicContact CG1-CE 3.67Å; W483-M532 HydrophobicContact CB-CE 4.45Å; W483-M532 HydrophobicContact CE3-SD 3.76Å; W483-M532 HydrophobicContact CZ3-SD 4.37Å; W486-M532 HydrophobicContact CD2-CB 3.94Å; W486-M532 HydrophobicContact CD2-CG 4.11Å; W486-M532 HydrophobicContact CE3-CB 4.18Å; W486-M532 HydrophobicContact CE3-CG 4.43Å; W486-M532 HydrophobicContact CG-CB 4.39Å; W486-M532 HydrophobicContact CG-CG 4.1Å; G528-M532 VanDerWaalsContact O-CB 3.3Å; G528-M532 WeakPolarHBondContact O-CB 3.2Å; G528-M532 PolarHBondContact O-N 2.84Å; L529-M532 HydrophobicContact CD2-SD 4.31Å; L529-M532 PolarHBondContact O-N 3.37Å; M532-R534 PolarHBondContact O-N 3.37Å; M532-E535 PolarHBondContact O-N 3.33Å; M532-A536 HydrophobicContact CG-CB 3.88Å; M532-A536 WeakPolarHBondContact O-CB 3.17Å; M532-A536 PolarHBondContact O-N 3.38Å; M532-I552 HydrophobicContact CE-CG2 3.88Å; M532-F553 HydrophobicContact CG-CE1 4.31Å; M532-F553 HydrophobicContact SD-CE1 3.8Å; M532-I556 HydrophobicContact CE-CD1 4.09Å; M532-I556 HydrophobicContact SD-CD1 4.14Å
533	T	95.9	Very high	93.6	Very high	6 Å²	6	56.2 Å²	56.2	4%	0.037	31%	0.31	C	S	.	.	H	α-helix	trans	-55.8	-20.5	175.7	-57.8	0	0	0	0	113.8	L529 L531 L549 F553 W581 V585	L529-T533 WeakPolarHBondContact O-CB 3.17Å; L529-T533 PolarHBondContact O-N 2.89Å; L529-T533 PolarHBondContact O-OG1 2.99Å; L531-T533 PolarHBondContact O-N 2.59Å; T533-L549 HydrophobicContact CG2-CD2 4.27Å; T533-L549 WeakPolarHBondContact O-CD2 3.29Å; T533-F553 HydrophobicContact CG2-CE2 4.49Å; T533-F553 VanDerWaalsContact OG1-CZ 3.26Å; T533-F553 WeakPolarHBondContact OG1-CZ 3.42Å; T533-W581 HydrophobicContact CG2-CB 3.98Å; T533-V585 HydrophobicContact CG2-CG2 3.91Å
534	R	91.4	Very high	93.6	Very high	150 Å²	150	55 Å²	55	57%	0.566	29%	0.289	S	S	*	.	H	α-helix	trans	-116.2	-28.1	179.8	-57.6	178.7	64.8	-155.3	-6.5	113.4	L531 M532 R537 W581	L531-R534 PolarHBondContact O-N 3Å; M532-R534 PolarHBondContact O-N 3.37Å; R534-R537 PolarHBondContact O-NH1 3.36Å; R534-R537 PolarHBondContact O-NH2 3.27Å; R534-W581 HydrophobicContact CG-CE3 4.27Å
535	E	94.3	Very high	93.6	Very high	64 Å²	64	56.3 Å²	56.3	30%	0.299	30%	0.298	S	S	.	.	H	α-helix	trans	-107.5	-15.6	-168.1	-63.2	-176.3	163.2	0	0	114	K490 L531 M532 R537	K490-E535 WeakPolarHBondContact CE-OE2 3.44Å; K490-E535 IonicContact NZ-OE1 3.64Å; K490-E535 PolarHBondContact NZ-OE1 2.8Å; K490-E535 IonicContact NZ-OE2 3.88Å; K490-E535 PolarHBondContact NZ-OE2 3.27Å; L531-E535 WeakPolarHBondContact O-CB 3.43Å; L531-E535 WeakPolarHBondContact O-CG 3.32Å; L531-E535 PolarHBondContact O-N 2.95Å; M532-E535 PolarHBondContact O-N 3.33Å; E535-R537 VanDerWaalsContact C-NH1 3.33Å; E535-R537 PolarHBondContact O-NH1 3.42Å
536	A	93.6	Very high	93.5	Very high	5 Å²	5	58.1 Å²	58.1	4%	0.041	31%	0.31	C	S	.	.			trans	-63	137.1	177	0	0	0	0	0	111.5	M532 Y544 L549	M532-A536 HydrophobicContact CG-CB 3.88Å; M532-A536 WeakPolarHBondContact O-CB 3.17Å; M532-A536 PolarHBondContact O-N 3.38Å; A536-Y544 HydrophobicContact CB-CD2 3.81Å; A536-Y544 HydrophobicContact CB-CE2 3.89Å; A536-L549 HydrophobicContact CB-CD1 4.44Å
537	R	92.4	Very high	93.4	Very high	113 Å²	113	57.7 Å²	57.7	43%	0.426	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-131.4	152	179.5	-59.7	-59.7	175.1	-101.4	0.7	110	R534 E535 G541 E542 Y544	R534-R537 PolarHBondContact O-NH1 3.36Å; R534-R537 PolarHBondContact O-NH2 3.27Å; E535-R537 VanDerWaalsContact C-NH1 3.33Å; E535-R537 PolarHBondContact O-NH1 3.42Å; R537-G541 WeakPolarHBondContact CD-O 3.33Å; R537-G541 WeakPolarHBondContact CG-O 3.5Å; R537-E542 CarbonylContact C-O 3.56Å; R537-E542 VanDerWaalsContact CA-O 3.23Å; R537-E542 WeakPolarHBondContact CA-O 3.46Å; R537-E542 WeakPolarHBondContact CB-O 3.24Å; R537-E542 VanDerWaalsContact CD-C 3.49Å; R537-E542 WeakPolarHBondContact CD-O 3.49Å; R537-Y544 WeakPolarHBondContact O-CE2 3.44Å; R537-Y544 PolarHBondContact O-OH 2.89Å
538	N	90.3	Very high	93.3	Very high	48 Å²	48	53.9 Å²	53.9	26%	0.257	30%	0.295	S	S	.	.			trans	-71.5	177.6	171.8	75.9	2.8	0	0	0	111.2	E540 G541 E542 Y544	N538-E540 PolarHBondContact O-N 3.01Å; N538-E540 VanDerWaalsContact O-N 3.1Å; N538-E540 WeakPolarHBondContact OD1-CA 3.12Å; N538-E540 WeakPolarHBondContact OD1-CB 3.14Å; N538-E540 PolarHBondContact OD1-N 2.9Å; N538-G541 PolarHBondContact O-N 3.26Å; N538-G541 PolarHBondContact OD1-N 2.69Å; N538-E542 PolarHBondContact N-O 2.98Å; N538-E542 PolarHBondContact OD1-N 2.82Å; N538-E542 PolarHBondContact OD1-O 3.02Å; N538-Y544 HydrophobicContact CB-CD1 4.41Å; N538-Y544 HydrophobicContact CB-CE1 3.98Å
539	G	85.9	Confident	93.3	Very high	94 Å²	94	54.3 Å²	54.3	97%	0.969	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-8.2	178.5	0	0	0	0	0	115.6
540	E	87.8	Confident	93.2	Very high	168 Å²	168	54.5 Å²	54.5	79%	0.785	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-10	175.6	-55.9	179.7	152.8	0	0	112	N538	N538-E540 PolarHBondContact O-N 3.01Å; N538-E540 VanDerWaalsContact O-N 3.1Å; N538-E540 WeakPolarHBondContact OD1-CA 3.12Å; N538-E540 WeakPolarHBondContact OD1-CB 3.14Å; N538-E540 PolarHBondContact OD1-N 2.9Å
541	G	89.6	Confident	93.2	Very high	46 Å²	46	54.8 Å²	54.8	47%	0.474	30%	0.298	S	S	.	.	S	Bend	trans	95.6	-1.7	-178.1	0	0	0	0	0	115	R537 N538	R537-G541 WeakPolarHBondContact CD-O 3.33Å; R537-G541 WeakPolarHBondContact CG-O 3.5Å; N538-G541 PolarHBondContact O-N 3.26Å; N538-G541 PolarHBondContact OD1-N 2.69Å
542	E	92.6	Very high	93.3	Very high	121 Å²	121	53.7 Å²	53.7	57%	0.565	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-84.2	152.4	-179.7	-69.4	-59	145.5	0	0	112.2	R537 N538	R537-E542 CarbonylContact C-O 3.56Å; R537-E542 VanDerWaalsContact CA-O 3.23Å; R537-E542 WeakPolarHBondContact CA-O 3.46Å; R537-E542 WeakPolarHBondContact CB-O 3.24Å; R537-E542 VanDerWaalsContact CD-C 3.49Å; R537-E542 WeakPolarHBondContact CD-O 3.49Å; N538-E542 PolarHBondContact N-O 2.98Å; N538-E542 PolarHBondContact OD1-N 2.82Å; N538-E542 PolarHBondContact OD1-O 3.02Å
543	P	92.5	Very high	93.3	Very high	77 Å²	77	53.6 Å²	53.6	50%	0.5	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-65.6	145	176.2	29.5	-34.2	0	0	0	111.5
544	Y	93.8	Very high	93.4	Very high	53 Å²	53	53.3 Å²	53.3	21%	0.208	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-64.9	139.6	172.8	-72.1	-74.6	0	0	0	111.4	V482 A536 R537 N538 V548 I552	V482-Y544 HydrophobicContact CG1-CE2 3.88Å; V482-Y544 WeakPolarHBondContact CG1-OH 3.4Å; V482-Y544 WeakPolarHBondContact CG2-OH 3.25Å; A536-Y544 HydrophobicContact CB-CD2 3.81Å; A536-Y544 HydrophobicContact CB-CE2 3.89Å; R537-Y544 WeakPolarHBondContact O-CE2 3.44Å; R537-Y544 PolarHBondContact O-OH 2.89Å; N538-Y544 HydrophobicContact CB-CD1 4.41Å; N538-Y544 HydrophobicContact CB-CE1 3.98Å; Y544-V548 HydrophobicContact CD1-CB 4.5Å; Y544-V548 HydrophobicContact CD1-CG1 3.7Å; Y544-V548 HydrophobicContact CE1-CG1 4.31Å; Y544-I552 HydrophobicContact CD1-CD1 3.76Å; Y544-I552 HydrophobicContact CD2-CD1 4.11Å; Y544-I552 HydrophobicContact CE1-CD1 3.64Å; Y544-I552 HydrophobicContact CE2-CD1 4Å; Y544-I552 HydrophobicContact CG-CD1 3.98Å
545	D	92.8	Very high	93.8	Very high	68 Å²	68	46.2 Å²	46.2	36%	0.364	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-56.3	142.9	165	-88	-44	0	0	0	109.6	D547 V548 L549 R592	D545-D547 VanDerWaalsContact C-N 3.3Å; D545-D547 PolarHBondContact O-N 2.94Å; D545-V548 HydrophobicContact CB-CB 4.36Å; D545-V548 HydrophobicContact CB-CG2 3.91Å; D545-V548 WeakPolarHBondContact O-CB 3.16Å; D545-V548 PolarHBondContact O-N 3.35Å; D545-V548 VanDerWaalsContact O-N 3.09Å; D545-L549 PolarHBondContact O-N 3.44Å; D545-R592 VanDerWaalsContact CG-NH1 3.29Å; D545-R592 IonicContact OD1-CZ 3.4Å; D545-R592 IonicContact OD1-NH1 3.98Å; D545-R592 IonicContact OD1-NH2 3.61Å; D545-R592 IonicContact OD2-CZ 3.67Å; D545-R592 VanDerWaalsContact OD2-CZ 3.22Å; D545-R592 IonicContact OD2-NH1 3.06Å; D545-R592 PolarHBondContact OD2-NH1 3.47Å; D545-R592 IonicContact OD2-NH2 3.23Å; D545-R592 PolarHBondContact OD2-NH2 2.9Å
546	P	94.3	Very high	93.9	Very high	39 Å²	39	43.1 Å²	43.1	25%	0.253	25%	0.249	S	C	.	.	H	α-helix	trans	-57.4	-35.3	-172.4	-30	37.4	0	0	0	115.3	L549 Y550 V585 L586 V589	P546-L549 PolarHBondContact O-N 3.12Å; P546-Y550 PolarHBondContact O-N 3.16Å; P546-V585 HydrophobicContact CB-CG1 4Å; P546-V585 HydrophobicContact CG-CG1 4.29Å; P546-L586 HydrophobicContact CB-CD2 3.85Å; P546-L586 VanDerWaalsContact O-CD2 3.26Å; P546-L586 WeakPolarHBondContact O-CD2 3.3Å; P546-V589 HydrophobicContact CB-CG2 3.48Å; P546-V589 VanDerWaalsContact CB-CG2 3.48Å; P546-V589 HydrophobicContact CG-CG2 3.92Å
547	D	93.9	Very high	94.1	Very high	13 Å²	13	43.3 Å²	43.3	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-75.7	-34.6	177.9	70.4	-46.9	0	0	0	112.4	D545 L549 Y550 Y551 S602 H603 V760	D545-D547 VanDerWaalsContact C-N 3.3Å; D545-D547 PolarHBondContact O-N 2.94Å; D547-L549 VanDerWaalsContact C-N 3.32Å; D547-Y550 PolarHBondContact O-N 3.17Å; D547-Y551 PolarHBondContact O-N 2.97Å; D547-S602 PolarHBondContact OD2-OG 3.1Å; D547-H603 IonicContact OD1-ND1 2.68Å; D547-H603 IonicContact OD2-CE1 2.68Å; D547-H603 IonicContact OD2-CG 2.7Å; D547-H603 PolarHBondContact OD2-N 3.18Å; D547-H603 IonicContact OD2-ND1 3.13Å; D547-H603 PolarHBondContact OD2-ND1 3.45Å; D547-V760 HydrophobicContact CB-CG1 3.61Å
548	V	94.5	Very high	94.3	Very high	27 Å²	27	38.9 Å²	38.9	16%	0.164	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-40.9	169.4	-177.2	0	0	0	0	110.6	Y544 D545 Y551 I552 H603	Y544-V548 HydrophobicContact CD1-CB 4.5Å; Y544-V548 HydrophobicContact CD1-CG1 3.7Å; Y544-V548 HydrophobicContact CE1-CG1 4.31Å; D545-V548 HydrophobicContact CB-CB 4.36Å; D545-V548 HydrophobicContact CB-CG2 3.91Å; D545-V548 WeakPolarHBondContact O-CB 3.16Å; D545-V548 PolarHBondContact O-N 3.35Å; D545-V548 VanDerWaalsContact O-N 3.09Å; V548-Y551 WeakPolarHBondContact O-CB 3.44Å; V548-Y551 PolarHBondContact O-N 3.29Å; V548-I552 HydrophobicContact CG1-CD1 4.14Å; V548-I552 WeakPolarHBondContact O-CG1 3.33Å; V548-I552 PolarHBondContact O-N 3.44Å; V548-H603 HydrophobicContact CG2-CB 4.5Å; V548-H603 VanDerWaalsContact CG2-CE1 3.45Å; V548-H603 WeakPolarHBondContact CG2-CE1 3.42Å; V548-H603 WeakPolarHBondContact CG2-ND1 3.44Å
549	L	95.7	Very high	94.7	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-39.9	176.1	-174.3	67.2	0	0	0	111.6	T533 A536 D545 P546 D547 I552 F553 V585	T533-L549 HydrophobicContact CG2-CD2 4.27Å; T533-L549 WeakPolarHBondContact O-CD2 3.29Å; A536-L549 HydrophobicContact CB-CD1 4.44Å; D545-L549 PolarHBondContact O-N 3.44Å; P546-L549 PolarHBondContact O-N 3.12Å; D547-L549 VanDerWaalsContact C-N 3.32Å; L549-I552 PolarHBondContact O-N 3.34Å; L549-F553 HydrophobicContact CD1-CE2 3.84Å; L549-F553 HydrophobicContact CD1-CZ 3.93Å; L549-F553 HydrophobicContact CD2-CE2 4.16Å; L549-F553 HydrophobicContact CG-CD2 4.26Å; L549-F553 HydrophobicContact CG-CE2 3.6Å; L549-F553 HydrophobicContact CG-CZ 4.2Å; L549-F553 WeakPolarHBondContact O-CD2 3.28Å; L549-F553 PolarHBondContact O-N 2.95Å; L549-V585 HydrophobicContact CD2-CG1 4.06Å
550	Y	97.1	Very high	95.2	Very high	4 Å²	4	34 Å²	34	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-41.6	173.1	-175.9	-152	0	0	0	112.1	P546 D547 I552 F553 L554 F570 L582 L586 V604 R757 V760	P546-Y550 PolarHBondContact O-N 3.16Å; D547-Y550 PolarHBondContact O-N 3.17Å; Y550-I552 VanDerWaalsContact C-N 3.33Å; Y550-I552 PolarHBondContact O-N 3.27Å; Y550-F553 PolarHBondContact O-N 2.87Å; Y550-F553 VanDerWaalsContact O-N 3.17Å; Y550-L554 HydrophobicContact CD1-CD1 4.48Å; Y550-L554 HydrophobicContact CD2-CD1 4.19Å; Y550-L554 HydrophobicContact CD2-CD2 4.48Å; Y550-L554 HydrophobicContact CD2-CG 4Å; Y550-L554 HydrophobicContact CE1-CD1 4.26Å; Y550-L554 HydrophobicContact CE2-CD1 3.95Å; Y550-L554 HydrophobicContact CE2-CD2 3.71Å; Y550-L554 HydrophobicContact CE2-CG 3.7Å; Y550-L554 HydrophobicContact CG-CD1 4.43Å; Y550-L554 WeakPolarHBondContact O-CG 3.42Å; Y550-L554 PolarHBondContact O-N 3.08Å; Y550-F570 HydrophobicContact CD2-CE1 4.02Å; Y550-F570 HydrophobicContact CD2-CZ 4.25Å; Y550-F570 HydrophobicContact CE2-CD1 4.36Å; Y550-F570 AromaticContact CE2-CE1 3.64Å; Y550-F570 HydrophobicContact CE2-CE1 3.64Å; Y550-F570 AromaticContact CE2-CZ 3.86Å; Y550-F570 HydrophobicContact CE2-CZ 3.86Å; Y550-L582 HydrophobicContact CD2-CD2 4.22Å; Y550-L586 HydrophobicContact CD1-CD1 4.18Å; Y550-L586 HydrophobicContact CG-CD1 4.09Å; Y550-V604 HydrophobicContact CD1-CG1 4.32Å; Y550-V604 HydrophobicContact CD1-CG2 3.9Å; Y550-V604 HydrophobicContact CE1-CG1 4.15Å; Y550-V604 HydrophobicContact CG-CG2 4.31Å; Y550-R757 HydrophobicContact CE1-CB 4.11Å; Y550-R757 WeakPolarHBondContact CE1-O 3.5Å; Y550-V760 HydrophobicContact CD1-CB 4.32Å; Y550-V760 HydrophobicContact CD1-CG1 4.07Å
551	Y	96.8	Very high	95.5	Very high	14 Å²	14	29.8 Å²	29.8	6%	0.055	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-45.4	171.5	167.9	-93.3	0	0	0	112.1	P471 L474 E478 D547 V548 F553 L554 C555 M608	P471-Y551 HydrophobicContact CB-CE2 4.39Å; L474-Y551 HydrophobicContact CD2-CD2 3.81Å; L474-Y551 HydrophobicContact CD2-CE2 3.78Å; E478-Y551 WeakPolarHBondContact OE2-CE1 3.31Å; E478-Y551 PolarHBondContact OE2-OH 3.03Å; D547-Y551 PolarHBondContact O-N 2.97Å; V548-Y551 WeakPolarHBondContact O-CB 3.44Å; V548-Y551 PolarHBondContact O-N 3.29Å; Y551-F553 VanDerWaalsContact C-N 3.33Å; Y551-F553 PolarHBondContact O-N 3.36Å; Y551-L554 PolarHBondContact O-N 3.05Å; Y551-L554 VanDerWaalsContact O-N 3.14Å; Y551-C555 VanDerWaalsContact CZ-SG 3.57Å; Y551-C555 PolarHBondContact O-N 2.79Å; Y551-M608 HydrophobicContact CD2-CE 4Å; Y551-M608 HydrophobicContact CD2-SD 3.74Å; Y551-M608 HydrophobicContact CE2-CE 3.77Å; Y551-M608 HydrophobicContact CE2-SD 3.99Å
552	I	97.3	Very high	95.8	Very high	8 Å²	8	32.4 Å²	32.4	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-43.5	176.7	-70.6	159.5	0	0	0	111.2	V482 M532 Y544 V548 L549 Y550 C555 I556	V482-I552 HydrophobicContact CB-CG2 4.19Å; V482-I552 HydrophobicContact CG1-CD1 4.31Å; V482-I552 HydrophobicContact CG1-CG2 4.23Å; V482-I552 HydrophobicContact CG2-CD1 4.42Å; M532-I552 HydrophobicContact CE-CG2 3.88Å; Y544-I552 HydrophobicContact CD1-CD1 3.76Å; Y544-I552 HydrophobicContact CD2-CD1 4.11Å; Y544-I552 HydrophobicContact CE1-CD1 3.64Å; Y544-I552 HydrophobicContact CE2-CD1 4Å; Y544-I552 HydrophobicContact CG-CD1 3.98Å; V548-I552 HydrophobicContact CG1-CD1 4.14Å; V548-I552 WeakPolarHBondContact O-CG1 3.33Å; V548-I552 PolarHBondContact O-N 3.44Å; L549-I552 PolarHBondContact O-N 3.34Å; Y550-I552 VanDerWaalsContact C-N 3.33Å; Y550-I552 PolarHBondContact O-N 3.27Å; I552-C555 PolarHBondContact O-N 3.23Å; I552-I556 HydrophobicContact CG2-CD1 4.26Å; I552-I556 WeakPolarHBondContact O-CG1 3.29Å; I552-I556 PolarHBondContact O-N 3.42Å
553	F	98.1	Very high	96	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.8	-32.4	176.4	-64.1	-49.3	0	0	0	113.4	L529 M532 T533 L549 Y550 Y551 I556 Q557 I569 F570 F578 L582	L529-F553 HydrophobicContact CD2-CD1 3.8Å; L529-F553 HydrophobicContact CD2-CE1 3.67Å; M532-F553 HydrophobicContact CG-CE1 4.31Å; M532-F553 HydrophobicContact SD-CE1 3.8Å; T533-F553 HydrophobicContact CG2-CE2 4.49Å; T533-F553 VanDerWaalsContact OG1-CZ 3.26Å; T533-F553 WeakPolarHBondContact OG1-CZ 3.42Å; L549-F553 HydrophobicContact CD1-CE2 3.84Å; L549-F553 HydrophobicContact CD1-CZ 3.93Å; L549-F553 HydrophobicContact CD2-CE2 4.16Å; L549-F553 HydrophobicContact CG-CD2 4.26Å; L549-F553 HydrophobicContact CG-CE2 3.6Å; L549-F553 HydrophobicContact CG-CZ 4.2Å; L549-F553 WeakPolarHBondContact O-CD2 3.28Å; L549-F553 PolarHBondContact O-N 2.95Å; Y550-F553 PolarHBondContact O-N 2.87Å; Y550-F553 VanDerWaalsContact O-N 3.17Å; Y551-F553 VanDerWaalsContact C-N 3.33Å; Y551-F553 PolarHBondContact O-N 3.36Å; F553-I556 HydrophobicContact CD1-CD1 4.15Å; F553-I556 PolarHBondContact O-N 3.41Å; F553-Q557 PolarHBondContact O-N 2.98Å; F553-I569 HydrophobicContact CB-CD1 4.45Å; F553-F570 HydrophobicContact CB-CE1 4.11Å; F553-F570 HydrophobicContact CB-CZ 3.72Å; F553-F578 HydrophobicContact CB-CZ 4.11Å; F553-F578 AromaticContact CD1-CE2 3.95Å; F553-F578 HydrophobicContact CD1-CE2 3.95Å; F553-F578 AromaticContact CD1-CZ 3.92Å; F553-F578 HydrophobicContact CD1-CZ 3.92Å; F553-F578 AromaticContact CD2-CE2 3.81Å; F553-F578 HydrophobicContact CD2-CE2 3.81Å; F553-F578 AromaticContact CD2-CZ 3.81Å; F553-F578 HydrophobicContact CD2-CZ 3.81Å; F553-F578 AromaticContact CE1-CE2 3.84Å; F553-F578 HydrophobicContact CE1-CE2 3.84Å; F553-F578 HydrophobicContact CE1-CZ 4.3Å; F553-F578 AromaticContact CE2-CE2 3.67Å; F553-F578 HydrophobicContact CE2-CE2 3.67Å; F553-F578 HydrophobicContact CE2-CZ 4.17Å; F553-F578 AromaticContact CG-CE2 3.96Å; F553-F578 HydrophobicContact CG-CE2 3.96Å; F553-F578 AromaticContact CG-CZ 3.68Å; F553-F578 HydrophobicContact CG-CZ 3.68Å; F553-F578 AromaticContact CZ-CE2 3.71Å; F553-F578 HydrophobicContact CZ-CE2 3.71Å; F553-F578 HydrophobicContact CZ-CZ 4.42Å; F553-L582 HydrophobicContact CD2-CD1 3.86Å; F553-L582 HydrophobicContact CD2-CD2 4.41Å; F553-L582 HydrophobicContact CE2-CD1 4Å
554	L	98	Very high	96	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.1	-40	172.3	-67.2	168.6	0	0	0	111.4	L474 Y550 Y551 Q557 K558 F570 V604 L609 Q614	L474-L554 HydrophobicContact CD1-CB 3.96Å; L474-L554 HydrophobicContact CD2-CB 3.74Å; Y550-L554 HydrophobicContact CD1-CD1 4.48Å; Y550-L554 HydrophobicContact CD2-CD1 4.19Å; Y550-L554 HydrophobicContact CD2-CD2 4.48Å; Y550-L554 HydrophobicContact CD2-CG 4Å; Y550-L554 HydrophobicContact CE1-CD1 4.26Å; Y550-L554 HydrophobicContact CE2-CD1 3.95Å; Y550-L554 HydrophobicContact CE2-CD2 3.71Å; Y550-L554 HydrophobicContact CE2-CG 3.7Å; Y550-L554 HydrophobicContact CG-CD1 4.43Å; Y550-L554 WeakPolarHBondContact O-CG 3.42Å; Y550-L554 PolarHBondContact O-N 3.08Å; Y551-L554 PolarHBondContact O-N 3.05Å; Y551-L554 VanDerWaalsContact O-N 3.14Å; L554-Q557 PolarHBondContact O-N 3.04Å; L554-K558 PolarHBondContact O-N 3.37Å; L554-F570 HydrophobicContact CD2-CE2 3.87Å; L554-F570 HydrophobicContact CD2-CZ 3.94Å; L554-F570 HydrophobicContact CG-CZ 4.3Å; L554-V604 HydrophobicContact CD1-CB 4.46Å; L554-V604 HydrophobicContact CD1-CG1 3.58Å; L554-V604 HydrophobicContact CD1-CG2 4.02Å; L554-L609 HydrophobicContact CD1-CD1 4.07Å; L554-L609 HydrophobicContact CD2-CG 4.43Å; L554-Q614 HydrophobicContact CD2-CG 3.96Å
555	C	97.9	Very high	96.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-40.3	171.9	-71.5	0	0	0	0	112.1	K475 Y551 I552 K558 Y559	K475-C555 WeakPolarHBondContact O-CB 3.46Å; K475-C555 PolarHBondContact O-SG 2.86Å; Y551-C555 VanDerWaalsContact CZ-SG 3.57Å; Y551-C555 PolarHBondContact O-N 2.79Å; I552-C555 PolarHBondContact O-N 3.23Å; C555-K558 PolarHBondContact O-N 3.46Å; C555-Y559 PolarHBondContact O-N 3.33Å
556	I	98	Very high	96	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-49.4	172.6	-72.7	170.2	0	0	0	110.6	W483 L517 L529 M532 I552 F553 K558 Y559 L560 I569	W483-I556 HydrophobicContact CB-CD1 4.34Å; L517-I556 HydrophobicContact CD1-CG1 4.15Å; L517-I556 HydrophobicContact CD1-CG2 4.1Å; L517-I556 HydrophobicContact CD2-CG2 4.29Å; L529-I556 HydrophobicContact CD2-CD1 4.2Å; M532-I556 HydrophobicContact CE-CD1 4.09Å; M532-I556 HydrophobicContact SD-CD1 4.14Å; I552-I556 HydrophobicContact CG2-CD1 4.26Å; I552-I556 WeakPolarHBondContact O-CG1 3.29Å; I552-I556 PolarHBondContact O-N 3.42Å; F553-I556 HydrophobicContact CD1-CD1 4.15Å; F553-I556 PolarHBondContact O-N 3.41Å; I556-K558 VanDerWaalsContact C-N 3.31Å; I556-K558 PolarHBondContact O-N 3.04Å; I556-Y559 WeakPolarHBondContact O-CB 3.28Å; I556-Y559 PolarHBondContact O-N 3.1Å; I556-Y559 VanDerWaalsContact O-N 3.11Å; I556-L560 HydrophobicContact CG2-CG 4.43Å; I556-L560 WeakPolarHBondContact O-CG 3.14Å; I556-L560 PolarHBondContact O-N 3.47Å; I556-I569 HydrophobicContact CG2-CD1 4.22Å
557	Q	97.7	Very high	96	Very high	9 Å²	9	31 Å²	31	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-38.3	178.3	-179.7	59	65.7	0	0	112.8	F553 L554 F561 D567 I569 F570	F553-Q557 PolarHBondContact O-N 2.98Å; L554-Q557 PolarHBondContact O-N 3.04Å; Q557-F561 PolarHBondContact O-N 2.93Å; Q557-F561 VanDerWaalsContact O-N 3.12Å; Q557-D567 PolarHBondContact NE2-O 2.78Å; Q557-D567 PolarHBondContact OE1-O 2.98Å; Q557-I569 HydrophobicContact CB-CD1 4.33Å; Q557-I569 HydrophobicContact CB-CG1 4.37Å; Q557-F570 HydrophobicContact CB-CD2 4.33Å; Q557-F570 HydrophobicContact CB-CE2 3.75Å; Q557-F570 HydrophobicContact CG-CD2 4.25Å; Q557-F570 HydrophobicContact CG-CE2 4.14Å
558	K	96.9	Very high	96	Very high	19 Å²	19	31.3 Å²	31.3	8%	0.083	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-48.8	172.3	-173.9	169.8	176.1	-179.9	0	110.9	L474 P476 L554 C555 I556 L560 F561 E562 E611 C612	L474-K558 HydrophobicContact CB-CD 3.53Å; L474-K558 HydrophobicContact CD1-CB 4.25Å; L474-K558 HydrophobicContact CD1-CD 4.09Å; L474-K558 HydrophobicContact CG-CD 4.46Å; L474-K558 PolarHBondContact O-NZ 3.36Å; P476-K558 HydrophobicContact CB-CB 4.41Å; P476-K558 HydrophobicContact CB-CG 4.27Å; L554-K558 PolarHBondContact O-N 3.37Å; C555-K558 PolarHBondContact O-N 3.46Å; I556-K558 VanDerWaalsContact C-N 3.31Å; I556-K558 PolarHBondContact O-N 3.04Å; K558-L560 PolarHBondContact O-N 2.73Å; K558-F561 PolarHBondContact O-N 3.18Å; K558-E562 WeakPolarHBondContact CE-OE1 3.36Å; K558-E562 HydrophobicContact CG-CG 4.22Å; K558-E562 WeakPolarHBondContact CG-OE1 3.26Å; K558-E562 WeakPolarHBondContact O-CB 3.35Å; K558-E562 WeakPolarHBondContact O-CG 3.37Å; K558-E562 PolarHBondContact O-N 3.06Å; K558-E611 IonicContact NZ-OE2 2.68Å; K558-E611 PolarHBondContact NZ-OE2 3.43Å; K558-C612 HydrophobicContact CB-CB 3.93Å
559	Y	97.3	Very high	96.1	Very high	40 Å²	40	30 Å²	30	16%	0.157	17%	0.165	C	C	.	.	H	α-helix	trans	-58.3	-44.2	177.7	-176	-102.2	0	0	0	112.6	P476 L480 L517 I518 C555 I556 N563	P476-Y559 HydrophobicContact CB-CD2 4.15Å; P476-Y559 HydrophobicContact CB-CG 4.46Å; L480-Y559 HydrophobicContact CB-CD2 4.48Å; L480-Y559 HydrophobicContact CB-CG 4.49Å; L480-Y559 HydrophobicContact CD1-CD1 4.22Å; L480-Y559 HydrophobicContact CD1-CE1 3.75Å; L480-Y559 HydrophobicContact CD2-CD2 4.37Å; L480-Y559 HydrophobicContact CD2-CE1 4.28Å; L480-Y559 HydrophobicContact CD2-CE2 3.74Å; L480-Y559 HydrophobicContact CG-CE1 4.47Å; L517-Y559 HydrophobicContact CB-CD1 4.06Å; L517-Y559 HydrophobicContact CB-CE1 4.02Å; L517-Y559 HydrophobicContact CD1-CD1 3.78Å; L517-Y559 HydrophobicContact CD1-CE1 4.32Å; I518-Y559 HydrophobicContact CD1-CD1 4.03Å; I518-Y559 HydrophobicContact CD1-CE1 3.65Å; I518-Y559 HydrophobicContact CG1-CE1 3.81Å; C555-Y559 PolarHBondContact O-N 3.33Å; I556-Y559 WeakPolarHBondContact O-CB 3.28Å; I556-Y559 PolarHBondContact O-N 3.1Å; I556-Y559 VanDerWaalsContact O-N 3.11Å; Y559-N563 VanDerWaalsContact CD2-ND2 3.34Å; Y559-N563 WeakPolarHBondContact CD2-ND2 3.47Å; Y559-N563 WeakPolarHBondContact CE2-ND2 3.23Å; Y559-N563 WeakPolarHBondContact O-CB 3.45Å; Y559-N563 PolarHBondContact O-N 2.96Å; Y559-N563 PolarHBondContact O-ND2 3.04Å
560	L	96.6	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-53	176.5	-60	-166.1	0	0	0	110.9	L517 I518 L525 I556 K558 N563 G564 R565 D567 I569	L517-L560 HydrophobicContact CB-CD2 3.8Å; L517-L560 HydrophobicContact CD1-CD2 4.5Å; I518-L560 HydrophobicContact CD1-CD2 4.14Å; L525-L560 HydrophobicContact CD2-CD1 4.01Å; L525-L560 HydrophobicContact CD2-CD2 4.49Å; I556-L560 HydrophobicContact CG2-CG 4.43Å; I556-L560 WeakPolarHBondContact O-CG 3.14Å; I556-L560 PolarHBondContact O-N 3.47Å; K558-L560 PolarHBondContact O-N 2.73Å; L560-N563 PolarHBondContact O-N 3.34Å; L560-G564 PolarHBondContact O-N 3.4Å; L560-R565 HydrophobicContact CB-CB 4.22Å; L560-R565 HydrophobicContact CB-CG 4.49Å; L560-R565 WeakPolarHBondContact O-CB 3.33Å; L560-R565 PolarHBondContact O-N 2.87Å; L560-D567 HydrophobicContact CD1-CB 4.38Å; L560-I569 HydrophobicContact CD1-CG2 3.82Å
561	F	94.6	Very high	96	Very high	79 Å²	79	31.2 Å²	31.2	35%	0.346	17%	0.174	S	C	.	.	H	α-helix	trans	-62.9	-45.7	-177.2	164	-110.2	0	0	0	112.5	Q557 K558 N563 G564 R565 K613	Q557-F561 PolarHBondContact O-N 2.93Å; Q557-F561 VanDerWaalsContact O-N 3.12Å; K558-F561 PolarHBondContact O-N 3.18Å; F561-N563 VanDerWaalsContact C-N 3.26Å; F561-N563 PolarHBondContact O-N 3.2Å; F561-G564 PolarHBondContact O-N 3.27Å; F561-R565 WeakPolarHBondContact CA-O 3.49Å; F561-K613 HydrophobicContact CD1-CD 4.08Å; F561-K613 HydrophobicContact CD2-CD 4.24Å; F561-K613 HydrophobicContact CE1-CD 4.07Å; F561-K613 HydrophobicContact CE2-CD 4.27Å; F561-K613 HydrophobicContact CG-CD 4.21Å; F561-K613 HydrophobicContact CZ-CD 4.21Å; F561-K613 VanDerWaalsContact CZ-CE 3.5Å
562	E	95.9	Very high	95.8	Very high	102 Å²	102	33.4 Å²	33.4	48%	0.477	19%	0.187	S	C	.	.	H	α-helix	trans	-65.8	-28.8	-177.6	-72.5	178	164.3	0	0	112.7	P476 K558 G564	P476-E562 WeakPolarHBondContact CG-OE2 3.14Å; K558-E562 WeakPolarHBondContact CE-OE1 3.36Å; K558-E562 HydrophobicContact CG-CG 4.22Å; K558-E562 WeakPolarHBondContact CG-OE1 3.26Å; K558-E562 WeakPolarHBondContact O-CB 3.35Å; K558-E562 WeakPolarHBondContact O-CG 3.37Å; K558-E562 PolarHBondContact O-N 3.06Å; E562-G564 VanDerWaalsContact C-N 3.27Å; E562-G564 PolarHBondContact O-N 2.95Å
563	N	96	Very high	95.5	Very high	83 Å²	83	39.2 Å²	39.2	44%	0.444	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	14.9	173.1	-68.3	-90.7	0	0	0	113.1	I518 Y559 L560 F561 R565	I518-N563 HydrophobicContact CD1-CB 3.59Å; I518-N563 HydrophobicContact CG1-CB 3.97Å; Y559-N563 VanDerWaalsContact CD2-ND2 3.34Å; Y559-N563 WeakPolarHBondContact CD2-ND2 3.47Å; Y559-N563 WeakPolarHBondContact CE2-ND2 3.23Å; Y559-N563 WeakPolarHBondContact O-CB 3.45Å; Y559-N563 PolarHBondContact O-N 2.96Å; Y559-N563 PolarHBondContact O-ND2 3.04Å; L560-N563 PolarHBondContact O-N 3.34Å; F561-N563 VanDerWaalsContact C-N 3.26Å; F561-N563 PolarHBondContact O-N 3.2Å; N563-R565 VanDerWaalsContact C-N 3.34Å; N563-R565 PolarHBondContact O-N 2.68Å
564	G	93.7	Very high	95.3	Very high	60 Å²	60	47.3 Å²	47.3	62%	0.619	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.1	7.4	171.6	0	0	0	0	0	115.6	L560 F561 E562	L560-G564 PolarHBondContact O-N 3.4Å; F561-G564 PolarHBondContact O-N 3.27Å; E562-G564 VanDerWaalsContact C-N 3.27Å; E562-G564 PolarHBondContact O-N 2.95Å
565	R	94.6	Very high	95.2	Very high	28 Å²	28	47.3 Å²	47.3	11%	0.106	25%	0.249	C	C	.	.			trans	-79.4	134.4	171.2	-176.6	173.2	180	156.8	4	109.6	L517 S520 L560 F561 N563 D567 Y575	L517-R565 PolarHBondContact O-NH1 3.1Å; S520-R565 PolarHBondContact O-NH1 2.74Å; S520-R565 PolarHBondContact O-NH2 3.33Å; L560-R565 HydrophobicContact CB-CB 4.22Å; L560-R565 HydrophobicContact CB-CG 4.49Å; L560-R565 WeakPolarHBondContact O-CB 3.33Å; L560-R565 PolarHBondContact O-N 2.87Å; F561-R565 WeakPolarHBondContact CA-O 3.49Å; N563-R565 VanDerWaalsContact C-N 3.34Å; N563-R565 PolarHBondContact O-N 2.68Å; R565-D567 HydrophobicContact CG-CB 4.43Å; R565-D567 WeakPolarHBondContact CG-OD1 3.33Å; R565-D567 IonicContact CZ-OD1 2.67Å; R565-D567 IonicContact CZ-OD2 3.22Å; R565-D567 IonicContact NE-OD1 3.53Å; R565-D567 PolarHBondContact NE-OD1 3.15Å; R565-D567 IonicContact NE-OD2 2.73Å; R565-D567 PolarHBondContact NE-OD2 3.24Å; R565-D567 IonicContact NH2-OD1 3.42Å; R565-D567 IonicContact NH2-OD2 2.94Å; R565-D567 PolarHBondContact NH2-OD2 3.48Å; R565-Y575 PolarHBondContact NH2-OH 3.34Å
566	V	90.9	Very high	95.1	Very high	137 Å²	137	50 Å²	50	83%	0.83	27%	0.265	S	S	*	.			trans	-95.5	-8.5	-168.1	-62.5	0	0	0	0	114.9	D568	V566-D568 PolarHBondContact O-N 3.13Å
567	D	93.6	Very high	94.9	Very high	20 Å²	20	57.2 Å²	57.2	11%	0.107	29%	0.292	C	S	.	.			trans	-55	132	178.1	-55.8	50	0	0	0	112.2	Q557 L560 R565 D572 Y575	Q557-D567 PolarHBondContact NE2-O 2.78Å; Q557-D567 PolarHBondContact OE1-O 2.98Å; L560-D567 HydrophobicContact CD1-CB 4.38Å; R565-D567 HydrophobicContact CG-CB 4.43Å; R565-D567 WeakPolarHBondContact CG-OD1 3.33Å; R565-D567 IonicContact CZ-OD1 2.67Å; R565-D567 IonicContact CZ-OD2 3.22Å; R565-D567 IonicContact NE-OD1 3.53Å; R565-D567 PolarHBondContact NE-OD1 3.15Å; R565-D567 IonicContact NE-OD2 2.73Å; R565-D567 PolarHBondContact NE-OD2 3.24Å; R565-D567 IonicContact NH2-OD1 3.42Å; R565-D567 IonicContact NH2-OD2 2.94Å; R565-D567 PolarHBondContact NH2-OD2 3.48Å; D567-D572 WeakPolarHBondContact CA-OD2 3.2Å; D567-Y575 HydrophobicContact CB-CE2 3.98Å; D567-Y575 PolarHBondContact OD2-OH 2.9Å
568	D	94.8	Very high	94.9	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.102	29%	0.29	C	S	.	.			trans	-104.7	97.7	163.3	-179.2	-4	0	0	0	109.5	V566 F570 S571 D572 Q614	V566-D568 PolarHBondContact O-N 3.13Å; D568-F570 PolarHBondContact O-N 3.41Å; D568-F570 PolarHBondContact OD1-N 2.64Å; D568-S571 PolarHBondContact O-N 3.15Å; D568-S571 VanDerWaalsContact O-N 3.12Å; D568-S571 PolarHBondContact OD1-N 2.87Å; D568-S571 WeakPolarHBondContact OD2-CB 3.15Å; D568-S571 PolarHBondContact OD2-OG 2.95Å; D568-D572 PolarHBondContact N-OD2 3.39Å; D568-D572 WeakPolarHBondContact O-CB 3.19Å; D568-D572 PolarHBondContact O-N 3.42Å; D568-Q614 PolarHBondContact OD1-NE2 3.48Å
569	I	97.1	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.7	-176.2	73.5	177.5	0	0	0	113.2	L529 F553 I556 Q557 L560 Y575 F578 T579	L529-I569 HydrophobicContact CD1-CB 4.33Å; L529-I569 HydrophobicContact CD1-CD1 4.22Å; L529-I569 HydrophobicContact CD1-CG2 4.19Å; F553-I569 HydrophobicContact CB-CD1 4.45Å; I556-I569 HydrophobicContact CG2-CD1 4.22Å; Q557-I569 HydrophobicContact CB-CD1 4.33Å; Q557-I569 HydrophobicContact CB-CG1 4.37Å; L560-I569 HydrophobicContact CD1-CG2 3.82Å; I569-Y575 HydrophobicContact CB-CD1 4.16Å; I569-Y575 HydrophobicContact CB-CE1 4.47Å; I569-Y575 HydrophobicContact CB-CG 4.23Å; I569-Y575 HydrophobicContact CG2-CD1 4.17Å; I569-Y575 HydrophobicContact CG2-CE1 3.98Å; I569-Y575 HydrophobicContact CG2-CE2 4.34Å; I569-Y575 HydrophobicContact CG2-CG 4.46Å; I569-Y575 WeakPolarHBondContact O-CB 3.11Å; I569-F578 HydrophobicContact CB-CD1 4.38Å; I569-F578 HydrophobicContact CB-CE1 4.12Å; I569-F578 HydrophobicContact CD1-CE1 3.94Å; I569-F578 HydrophobicContact CD1-CZ 4.26Å; I569-F578 HydrophobicContact CG1-CE1 3.87Å; I569-F578 VanDerWaalsContact O-CD1 3.25Å; I569-F578 WeakPolarHBondContact O-CD1 3.3Å; I569-F578 WeakPolarHBondContact O-CE1 3.35Å; I569-T579 WeakPolarHBondContact O-CG2 3.46Å
570	F	96.7	Very high	94.9	Very high	5 Å²	5	58 Å²	58	2%	0.022	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-13.8	-179.4	-60	-75.2	0	0	0	113.9	Y550 F553 L554 Q557 D568 F578 L582 Q614 R757	Y550-F570 HydrophobicContact CD2-CE1 4.02Å; Y550-F570 HydrophobicContact CD2-CZ 4.25Å; Y550-F570 HydrophobicContact CE2-CD1 4.36Å; Y550-F570 AromaticContact CE2-CE1 3.64Å; Y550-F570 HydrophobicContact CE2-CE1 3.64Å; Y550-F570 AromaticContact CE2-CZ 3.86Å; Y550-F570 HydrophobicContact CE2-CZ 3.86Å; F553-F570 HydrophobicContact CB-CE1 4.11Å; F553-F570 HydrophobicContact CB-CZ 3.72Å; L554-F570 HydrophobicContact CD2-CE2 3.87Å; L554-F570 HydrophobicContact CD2-CZ 3.94Å; L554-F570 HydrophobicContact CG-CZ 4.3Å; Q557-F570 HydrophobicContact CB-CD2 4.33Å; Q557-F570 HydrophobicContact CB-CE2 3.75Å; Q557-F570 HydrophobicContact CG-CD2 4.25Å; Q557-F570 HydrophobicContact CG-CE2 4.14Å; D568-F570 PolarHBondContact O-N 3.41Å; D568-F570 PolarHBondContact OD1-N 2.64Å; F570-F578 HydrophobicContact CD1-CE1 4.24Å; F570-F578 HydrophobicContact CE1-CE1 4.19Å; F570-F578 HydrophobicContact CE1-CZ 4.23Å; F570-L582 HydrophobicContact CD1-CD2 4.02Å; F570-L582 HydrophobicContact CE1-CD2 3.63Å; F570-Q614 VanDerWaalsContact CB-OE1 3.27Å; F570-Q614 HydrophobicContact CD2-CG 4.01Å; F570-Q614 HydrophobicContact CE2-CG 4.31Å; F570-R757 PolarHBondContact O-NH1 3.49Å; F570-R757 PolarHBondContact O-NH2 3.38Å
571	S	92.7	Very high	94.9	Very high	32 Å²	32	62.3 Å²	62.3	22%	0.224	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-27.2	-176.1	-53	0	0	0	0	115	D568	D568-S571 PolarHBondContact O-N 3.15Å; D568-S571 VanDerWaalsContact O-N 3.12Å; D568-S571 PolarHBondContact OD1-N 2.87Å; D568-S571 WeakPolarHBondContact OD2-CB 3.15Å; D568-S571 PolarHBondContact OD2-OG 2.95Å
572	D	93	Very high	95	Very high	61 Å²	61	58.5 Å²	58.5	33%	0.326	30%	0.298	S	S	.	.			trans	-73.1	139.6	-173.8	-82.3	-26.1	0	0	0	112.3	D567 D568 Y574 Y575	D567-D572 WeakPolarHBondContact CA-OD2 3.2Å; D568-D572 PolarHBondContact N-OD2 3.39Å; D568-D572 WeakPolarHBondContact O-CB 3.19Å; D568-D572 PolarHBondContact O-N 3.42Å; D572-Y574 PolarHBondContact O-N 3.29Å; D572-Y575 HydrophobicContact CB-CD2 3.99Å; D572-Y575 PolarHBondContact O-N 3.39Å
573	L	91.7	Very high	95	Very high	129 Å²	129	55.6 Å²	55.6	68%	0.675	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-58.8	-21.5	-177.9	-63.1	178.2	0	0	0	113.7	Y575 V576 P731	L573-Y575 VanDerWaalsContact C-N 3.3Å; L573-Y575 PolarHBondContact O-N 3.31Å; L573-V576 WeakPolarHBondContact O-CG2 3.21Å; L573-P731 HydrophobicContact CD1-CB 4.46Å
574	Y	93.9	Very high	95.1	Very high	171 Å²	171	56.2 Å²	56.2	67%	0.671	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-72	-20.7	175.3	-58.6	-69.3	0	0	0	113.9	V522 N526 D572	V522-Y574 HydrophobicContact CG1-CD2 4.27Å; V522-Y574 HydrophobicContact CG1-CG 3.9Å; N526-Y574 VanDerWaalsContact CG-O 3.29Å; N526-Y574 PolarHBondContact ND2-O 3.15Å; D572-Y574 PolarHBondContact O-N 3.29Å
575	Y	96.3	Very high	95.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-108.9	6.7	-174.3	-66.2	-84.4	0	0	0	114	V522 L525 N526 L529 R565 D567 I569 D572 L573 R577 F578 T579	V522-Y575 HydrophobicContact CG1-CE2 3.86Å; L525-Y575 HydrophobicContact CB-CE1 4.38Å; L525-Y575 HydrophobicContact CD2-CE1 4.49Å; L525-Y575 HydrophobicContact CG-CE1 4.13Å; N526-Y575 HydrophobicContact CB-CD1 3.61Å; N526-Y575 HydrophobicContact CB-CE1 3.77Å; N526-Y575 HydrophobicContact CB-CG 4.45Å; L529-Y575 HydrophobicContact CD1-CD1 4.19Å; L529-Y575 HydrophobicContact CD1-CE1 4.1Å; R565-Y575 PolarHBondContact NH2-OH 3.34Å; D567-Y575 HydrophobicContact CB-CE2 3.98Å; D567-Y575 PolarHBondContact OD2-OH 2.9Å; I569-Y575 HydrophobicContact CB-CD1 4.16Å; I569-Y575 HydrophobicContact CB-CE1 4.47Å; I569-Y575 HydrophobicContact CB-CG 4.23Å; I569-Y575 HydrophobicContact CG2-CD1 4.17Å; I569-Y575 HydrophobicContact CG2-CE1 3.98Å; I569-Y575 HydrophobicContact CG2-CE2 4.34Å; I569-Y575 HydrophobicContact CG2-CG 4.46Å; I569-Y575 WeakPolarHBondContact O-CB 3.11Å; D572-Y575 HydrophobicContact CB-CD2 3.99Å; D572-Y575 PolarHBondContact O-N 3.39Å; L573-Y575 VanDerWaalsContact C-N 3.3Å; L573-Y575 PolarHBondContact O-N 3.31Å; Y575-R577 PolarHBondContact O-N 2.92Å; Y575-R577 VanDerWaalsContact O-N 3.09Å; Y575-F578 WeakPolarHBondContact O-CA 3.38Å; Y575-F578 WeakPolarHBondContact O-CB 3.33Å; Y575-F578 PolarHBondContact O-N 3.32Å; Y575-T579 PolarHBondContact O-N 2.83Å
576	V	94.3	Very high	95.2	Very high	56 Å²	56	54.4 Å²	54.4	34%	0.339	26%	0.264	S	S	.	.	H	α-helix	trans	-46.4	-45.9	180	171.5	0	0	0	0	112.1	L573 F578 T579 E580	L573-V576 WeakPolarHBondContact O-CG2 3.21Å; V576-F578 PolarHBondContact O-N 3.12Å; V576-T579 WeakPolarHBondContact CA-OG1 3.41Å; V576-T579 CarbonylContact O-C 3.32Å; V576-T579 PolarHBondContact O-N 2.84Å; V576-T579 PolarHBondContact O-OG1 3.45Å; V576-E580 HydrophobicContact CG1-CG 4.44Å; V576-E580 WeakPolarHBondContact CG1-OE1 3.4Å; V576-E580 WeakPolarHBondContact O-CG 3.25Å; V576-E580 PolarHBondContact O-N 2.94Å
577	R	95.4	Very high	95.3	Very high	151 Å²	151	51.7 Å²	51.7	57%	0.57	24%	0.241	S	C	*	.	H	α-helix	trans	-63.6	-36.1	179.3	-160	179.3	-149.5	171.5	9	114.4	Y575 W581	Y575-R577 PolarHBondContact O-N 2.92Å; Y575-R577 VanDerWaalsContact O-N 3.09Å; R577-W581 PolarHBondContact O-N 3.42Å
578	F	97.5	Very high	95.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.5	-42.3	171.9	156	-110.4	0	0	0	110.2	N526 L529 C530 F553 I569 F570 Y575 V576 E580 W581 L582	N526-F578 VanDerWaalsContact OD1-CB 3.31Å; N526-F578 WeakPolarHBondContact OD1-CB 3.36Å; N526-F578 PolarHBondContact OD1-N 2.87Å; L529-F578 HydrophobicContact CB-CB 4.26Å; L529-F578 HydrophobicContact CB-CD2 3.6Å; L529-F578 HydrophobicContact CB-CE2 4.07Å; L529-F578 HydrophobicContact CB-CG 3.88Å; L529-F578 HydrophobicContact CD1-CD1 4.39Å; L529-F578 HydrophobicContact CD1-CG 4.44Å; C530-F578 VanDerWaalsContact SG-CA 3.6Å; C530-F578 PolarHBondContact SG-N 3.11Å; C530-F578 VanDerWaalsContact SG-N 3.44Å; F553-F578 HydrophobicContact CB-CZ 4.11Å; F553-F578 AromaticContact CD1-CE2 3.95Å; F553-F578 HydrophobicContact CD1-CE2 3.95Å; F553-F578 AromaticContact CD1-CZ 3.92Å; F553-F578 HydrophobicContact CD1-CZ 3.92Å; F553-F578 AromaticContact CD2-CE2 3.81Å; F553-F578 HydrophobicContact CD2-CE2 3.81Å; F553-F578 AromaticContact CD2-CZ 3.81Å; F553-F578 HydrophobicContact CD2-CZ 3.81Å; F553-F578 AromaticContact CE1-CE2 3.84Å; F553-F578 HydrophobicContact CE1-CE2 3.84Å; F553-F578 HydrophobicContact CE1-CZ 4.3Å; F553-F578 AromaticContact CE2-CE2 3.67Å; F553-F578 HydrophobicContact CE2-CE2 3.67Å; F553-F578 HydrophobicContact CE2-CZ 4.17Å; F553-F578 AromaticContact CG-CE2 3.96Å; F553-F578 HydrophobicContact CG-CE2 3.96Å; F553-F578 AromaticContact CG-CZ 3.68Å; F553-F578 HydrophobicContact CG-CZ 3.68Å; F553-F578 AromaticContact CZ-CE2 3.71Å; F553-F578 HydrophobicContact CZ-CE2 3.71Å; F553-F578 HydrophobicContact CZ-CZ 4.42Å; I569-F578 HydrophobicContact CB-CD1 4.38Å; I569-F578 HydrophobicContact CB-CE1 4.12Å; I569-F578 HydrophobicContact CD1-CE1 3.94Å; I569-F578 HydrophobicContact CD1-CZ 4.26Å; I569-F578 HydrophobicContact CG1-CE1 3.87Å; I569-F578 VanDerWaalsContact O-CD1 3.25Å; I569-F578 WeakPolarHBondContact O-CD1 3.3Å; I569-F578 WeakPolarHBondContact O-CE1 3.35Å; F570-F578 HydrophobicContact CD1-CE1 4.24Å; F570-F578 HydrophobicContact CE1-CE1 4.19Å; F570-F578 HydrophobicContact CE1-CZ 4.23Å; Y575-F578 WeakPolarHBondContact O-CA 3.38Å; Y575-F578 WeakPolarHBondContact O-CB 3.33Å; Y575-F578 PolarHBondContact O-N 3.32Å; V576-F578 PolarHBondContact O-N 3.12Å; F578-E580 VanDerWaalsContact C-N 3.32Å; F578-E580 PolarHBondContact O-N 3.4Å; F578-W581 PolarHBondContact O-N 3.35Å; F578-L582 HydrophobicContact CE2-CB 4.32Å; F578-L582 HydrophobicContact CE2-CD2 4.49Å; F578-L582 HydrophobicContact CZ-CD2 3.97Å; F578-L582 WeakPolarHBondContact O-CB 3.42Å; F578-L582 PolarHBondContact O-N 3.36Å
579	T	96.5	Very high	94.8	Very high	8 Å²	8	57.7 Å²	57.7	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-29.6	177.9	61.1	0	0	0	0	113.8	I569 Y575 V576 H583	I569-T579 WeakPolarHBondContact O-CG2 3.46Å; Y575-T579 PolarHBondContact O-N 2.83Å; V576-T579 WeakPolarHBondContact CA-OG1 3.41Å; V576-T579 CarbonylContact O-C 3.32Å; V576-T579 PolarHBondContact O-N 2.84Å; V576-T579 PolarHBondContact O-OG1 3.45Å; T579-H583 WeakPolarHBondContact O-CB 3.47Å; T579-H583 PolarHBondContact O-N 3.15Å
580	E	96.3	Very high	94	Very high	77 Å²	77	64.6 Å²	64.6	36%	0.36	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-53.5	167.7	-71.7	163.6	-174	0	0	110.8	V576 F578 L582 H583 E584	V576-E580 HydrophobicContact CG1-CG 4.44Å; V576-E580 WeakPolarHBondContact CG1-OE1 3.4Å; V576-E580 WeakPolarHBondContact O-CG 3.25Å; V576-E580 PolarHBondContact O-N 2.94Å; F578-E580 VanDerWaalsContact C-N 3.32Å; F578-E580 PolarHBondContact O-N 3.4Å; E580-L582 VanDerWaalsContact C-N 3.34Å; E580-L582 PolarHBondContact O-N 3.2Å; E580-H583 PolarHBondContact O-N 3.39Å; E580-E584 WeakPolarHBondContact O-CG 3.48Å; E580-E584 PolarHBondContact O-N 3.31Å
581	W	96.6	Very high	93.3	Very high	90 Å²	90	66.5 Å²	66.5	34%	0.341	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-39.4	178.5	-79.7	115.6	0	0	0	112.8	T533 R534 R577 F578 E584 V585	T533-W581 HydrophobicContact CG2-CB 3.98Å; R534-W581 HydrophobicContact CG-CE3 4.27Å; R577-W581 PolarHBondContact O-N 3.42Å; F578-W581 PolarHBondContact O-N 3.35Å; W581-E584 PolarHBondContact O-N 3.14Å; W581-V585 WeakPolarHBondContact O-CG2 3.37Å; W581-V585 PolarHBondContact O-N 2.92Å; W581-V585 VanDerWaalsContact O-N 3.15Å
582	L	97.1	Very high	92.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.5	-40.9	176.2	-178.1	61.9	0	0	0	111.4	Y550 F553 F570 F578 E580 V585 L586	Y550-L582 HydrophobicContact CD2-CD2 4.22Å; F553-L582 HydrophobicContact CD2-CD1 3.86Å; F553-L582 HydrophobicContact CD2-CD2 4.41Å; F553-L582 HydrophobicContact CE2-CD1 4Å; F570-L582 HydrophobicContact CD1-CD2 4.02Å; F570-L582 HydrophobicContact CE1-CD2 3.63Å; F578-L582 HydrophobicContact CE2-CB 4.32Å; F578-L582 HydrophobicContact CE2-CD2 4.49Å; F578-L582 HydrophobicContact CZ-CD2 3.97Å; F578-L582 WeakPolarHBondContact O-CB 3.42Å; F578-L582 PolarHBondContact O-N 3.36Å; E580-L582 VanDerWaalsContact C-N 3.34Å; E580-L582 PolarHBondContact O-N 3.2Å; L582-V585 PolarHBondContact O-N 3.19Å; L582-L586 HydrophobicContact CD1-CD1 3.78Å; L582-L586 HydrophobicContact CD1-CG 3.93Å; L582-L586 HydrophobicContact CD2-CD1 4.43Å; L582-L586 HydrophobicContact CG-CD1 3.82Å; L582-L586 HydrophobicContact CG-CG 4.28Å; L582-L586 WeakPolarHBondContact O-CB 3.31Å; L582-L586 VanDerWaalsContact O-CG 3.29Å; L582-L586 WeakPolarHBondContact O-CG 3.27Å; L582-L586 PolarHBondContact O-N 3.3Å
583	H	96.8	Very high	92.1	Very high	40 Å²	40	71.8 Å²	71.8	19%	0.185	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-44.6	173	173.9	72.4	0	0	0	111.6	T579 E580 V585 L586 K587 Q753 T756	T579-H583 WeakPolarHBondContact O-CB 3.47Å; T579-H583 PolarHBondContact O-N 3.15Å; E580-H583 PolarHBondContact O-N 3.39Å; H583-V585 PolarHBondContact O-N 3.49Å; H583-L586 PolarHBondContact O-N 3.47Å; H583-L586 VanDerWaalsContact O-N 3.17Å; H583-K587 VanDerWaalsContact O-CB 3.28Å; H583-K587 WeakPolarHBondContact O-CB 3.48Å; H583-K587 WeakPolarHBondContact O-CG 3.47Å; H583-K587 PolarHBondContact O-N 2.94Å; H583-Q753 HydrophobicContact CB-CB 4.48Å; H583-Q753 HydrophobicContact CB-CG 3.96Å; H583-T756 PolarHBondContact CE1-OG1 3.24Å; H583-T756 WeakPolarHBondContact ND1-CB 3.06Å; H583-T756 PolarHBondContact ND1-OG1 3.34Å; H583-T756 VanDerWaalsContact ND1-OG1 3.16Å
584	E	96.8	Very high	91.5	Very high	97 Å²	97	67.4 Å²	67.4	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-30.2	177.5	-75.5	-65.7	103.2	0	0	113.6	E580 W581 K587	E580-E584 WeakPolarHBondContact O-CG 3.48Å; E580-E584 PolarHBondContact O-N 3.31Å; W581-E584 PolarHBondContact O-N 3.14Å; E584-K587 WeakPolarHBondContact O-CE 3.25Å; E584-K587 WeakPolarHBondContact OE1-CE 3.35Å; E584-K587 IonicContact OE1-NZ 2.74Å; E584-K587 PolarHBondContact OE1-NZ 2.95Å; E584-K587 IonicContact OE2-NZ 2.8Å; E584-K587 PolarHBondContact OE2-NZ 3.37Å
585	V	95.5	Very high	90.8	Very high	46 Å²	46	65.9 Å²	65.9	28%	0.279	33%	0.33	S	S	.	.	H	α-helix	trans	-82.3	-33.3	174.8	172.3	0	0	0	0	112.6	T533 P546 L549 W581 L582 H583	T533-V585 HydrophobicContact CG2-CG2 3.91Å; P546-V585 HydrophobicContact CB-CG1 4Å; P546-V585 HydrophobicContact CG-CG1 4.29Å; L549-V585 HydrophobicContact CD2-CG1 4.06Å; W581-V585 WeakPolarHBondContact O-CG2 3.37Å; W581-V585 PolarHBondContact O-N 2.92Å; W581-V585 VanDerWaalsContact O-N 3.15Å; L582-V585 PolarHBondContact O-N 3.19Å; H583-V585 PolarHBondContact O-N 3.49Å
586	L	95.8	Very high	90.1	Very high	3 Å²	3	72.5 Å²	72.5	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-91.1	-22.7	-174.8	-68.1	-176.4	0	0	0	114.9	P546 Y550 L582 H583 D588 V589 T756 R757 V760	P546-L586 HydrophobicContact CB-CD2 3.85Å; P546-L586 VanDerWaalsContact O-CD2 3.26Å; P546-L586 WeakPolarHBondContact O-CD2 3.3Å; Y550-L586 HydrophobicContact CD1-CD1 4.18Å; Y550-L586 HydrophobicContact CG-CD1 4.09Å; L582-L586 HydrophobicContact CD1-CD1 3.78Å; L582-L586 HydrophobicContact CD1-CG 3.93Å; L582-L586 HydrophobicContact CD2-CD1 4.43Å; L582-L586 HydrophobicContact CG-CD1 3.82Å; L582-L586 HydrophobicContact CG-CG 4.28Å; L582-L586 WeakPolarHBondContact O-CB 3.31Å; L582-L586 VanDerWaalsContact O-CG 3.29Å; L582-L586 WeakPolarHBondContact O-CG 3.27Å; L582-L586 PolarHBondContact O-N 3.3Å; H583-L586 PolarHBondContact O-N 3.47Å; H583-L586 VanDerWaalsContact O-N 3.17Å; L586-D588 VanDerWaalsContact C-N 3.3Å; L586-D588 PolarHBondContact O-N 2.97Å; L586-V589 HydrophobicContact CD2-CG2 4.36Å; L586-V589 WeakPolarHBondContact O-CB 3.49Å; L586-V589 VanDerWaalsContact O-CG2 3.28Å; L586-V589 WeakPolarHBondContact O-CG2 3.33Å; L586-V589 PolarHBondContact O-N 3.03Å; L586-T756 HydrophobicContact CB-CG2 3.36Å; L586-R757 HydrophobicContact CD1-CG 4.09Å; L586-V760 HydrophobicContact CB-CG2 4.39Å; L586-V760 HydrophobicContact CD1-CG2 4.4Å; L586-V760 HydrophobicContact CD2-CG2 4.09Å
587	K	93.9	Very high	89.2	Confident	81 Å²	81	72.4 Å²	72.4	35%	0.352	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.3	-169	63.6	-179	177.5	-176.6	0	115.2	H583 E584 T756	H583-K587 VanDerWaalsContact O-CB 3.28Å; H583-K587 WeakPolarHBondContact O-CB 3.48Å; H583-K587 WeakPolarHBondContact O-CG 3.47Å; H583-K587 PolarHBondContact O-N 2.94Å; E584-K587 WeakPolarHBondContact O-CE 3.25Å; E584-K587 WeakPolarHBondContact OE1-CE 3.35Å; E584-K587 IonicContact OE1-NZ 2.74Å; E584-K587 PolarHBondContact OE1-NZ 2.95Å; E584-K587 IonicContact OE2-NZ 2.8Å; E584-K587 PolarHBondContact OE2-NZ 3.37Å; K587-T756 HydrophobicContact CB-CG2 4.32Å
588	D	89.4	Confident	88.3	Confident	125 Å²	125	73.1 Å²	73.1	67%	0.668	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	5.2	-176.5	-64.9	-54.7	0	0	0	112.4	L586 Q590	L586-D588 VanDerWaalsContact C-N 3.3Å; L586-D588 PolarHBondContact O-N 2.97Å; D588-Q590 PolarHBondContact O-N 3.43Å
589	V	88.6	Confident	87.4	Confident	40 Å²	40	76 Å²	76	24%	0.242	40%	0.396	C	S	.	.			trans	-67.7	121.7	179.4	176.4	0	0	0	0	110.5	P546 L586 V760	P546-V589 HydrophobicContact CB-CG2 3.48Å; P546-V589 VanDerWaalsContact CB-CG2 3.48Å; P546-V589 HydrophobicContact CG-CG2 3.92Å; L586-V589 HydrophobicContact CD2-CG2 4.36Å; L586-V589 WeakPolarHBondContact O-CB 3.49Å; L586-V589 VanDerWaalsContact O-CG2 3.28Å; L586-V589 WeakPolarHBondContact O-CG2 3.33Å; L586-V589 PolarHBondContact O-N 3.03Å; V589-V760 HydrophobicContact CG1-CG2 4.46Å
590	Q	79.9	Confident	86.8	Confident	145 Å²	145	79 Å²	79	68%	0.678	41%	0.411	S	S	*	.			trans	-104.3	148.7	171.1	-63.2	-63.1	-25.5	0	0	110.2	D588 R592	D588-Q590 PolarHBondContact O-N 3.43Å; Q590-R592 PolarHBondContact O-N 2.81Å; Q590-R592 VanDerWaalsContact O-N 3.16Å
591	P	80.9	Confident	86.4	Confident	45 Å²	45	77.6 Å²	77.6	29%	0.292	41%	0.409	S	S	.	.			trans	-55	121.4	168.8	-22.4	33.2	0	0	0	109.9	V593 V599 Q765	P591-V593 PolarHBondContact O-N 3.39Å; P591-V599 HydrophobicContact CB-CG1 3.82Å; P591-Q765 HydrophobicContact CG-CB 4.42Å; P591-Q765 HydrophobicContact CG-CG 4.15Å
592	R	80.8	Confident	86.2	Confident	116 Å²	116	73.5 Å²	73.5	44%	0.438	39%	0.394	S	S	.	.			trans	-71.1	125.8	-177	-64.1	162.6	80.8	164.6	15.7	108.4	D545 Q590 V599 L600	D545-R592 VanDerWaalsContact CG-NH1 3.29Å; D545-R592 IonicContact OD1-CZ 3.4Å; D545-R592 IonicContact OD1-NH1 3.98Å; D545-R592 IonicContact OD1-NH2 3.61Å; D545-R592 IonicContact OD2-CZ 3.67Å; D545-R592 VanDerWaalsContact OD2-CZ 3.22Å; D545-R592 IonicContact OD2-NH1 3.06Å; D545-R592 PolarHBondContact OD2-NH1 3.47Å; D545-R592 IonicContact OD2-NH2 3.23Å; D545-R592 PolarHBondContact OD2-NH2 2.9Å; Q590-R592 PolarHBondContact O-N 2.81Å; Q590-R592 VanDerWaalsContact O-N 3.16Å; R592-V599 CarbonylContact O-C 3.53Å; R592-V599 WeakPolarHBondContact O-CA 3.21Å; R592-L600 HydrophobicContact CB-CB 4.15Å; R592-L600 HydrophobicContact CB-CD1 4.09Å; R592-L600 PolarHBondContact O-N 3.38Å
593	V	80.1	Confident	85.9	Confident	88 Å²	88	75.7 Å²	75.7	53%	0.533	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-110.2	130.3	179.9	-169.8	0	0	0	0	109.7	P591 G597 V599	P591-V593 PolarHBondContact O-N 3.39Å; V593-G597 WeakPolarHBondContact CG1-O 3.39Å; V593-V599 HydrophobicContact CG2-CG2 4.45Å
594	T	79.9	Confident	85.9	Confident	36 Å²	36	73.8 Å²	73.8	22%	0.221	40%	0.395	C	S	.	.			trans	-65.8	159.2	173.8	60.6	0	0	0	0	111.4	L596 G597 Y598 L600	T594-L596 PolarHBondContact O-N 2.91Å; T594-G597 PolarHBondContact O-N 3.17Å; T594-G597 PolarHBondContact OG1-N 3.41Å; T594-Y598 PolarHBondContact N-O 3.05Å; T594-Y598 WeakPolarHBondContact OG1-CB 3.43Å; T594-Y598 PolarHBondContact OG1-N 3.31Å; T594-Y598 VanDerWaalsContact OG1-N 3.08Å; T594-Y598 PolarHBondContact OG1-O 3.18Å; T594-L600 HydrophobicContact CG2-CD1 4.35Å; T594-L600 HydrophobicContact CG2-CD2 3.51Å; T594-L600 HydrophobicContact CG2-CG 3.73Å
595	P	79.1	Confident	85.9	Confident	140 Å²	140	69.3 Å²	69.3	91%	0.909	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-11.9	172	-24.9	35.3	0	0	0	115.1
596	L	80.6	Confident	85.9	Confident	138 Å²	138	68.4 Å²	68.4	72%	0.723	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	0.4	175.9	-75.3	75.7	0	0	0	113	T594 Y598	T594-L596 PolarHBondContact O-N 2.91Å; L596-Y598 HydrophobicContact CB-CD2 3.76Å; L596-Y598 HydrophobicContact CB-CE2 3.77Å; L596-Y598 HydrophobicContact CD2-CE2 4.2Å
597	G	75.3	Confident	85.9	Confident	54 Å²	54	71.8 Å²	71.8	56%	0.557	38%	0.383	S	S	*	.	S	Bend	trans	91.3	-7.5	177.7	0	0	0	0	0	115.8	V593 T594	V593-G597 WeakPolarHBondContact CG1-O 3.39Å; T594-G597 PolarHBondContact O-N 3.17Å; T594-G597 PolarHBondContact OG1-N 3.41Å
598	Y	76.6	Confident	86.1	Confident	166 Å²	166	67.9 Å²	67.9	65%	0.651	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-71.5	134.9	173.6	-54.8	-75.5	0	0	0	111.1	T594 L596	T594-Y598 PolarHBondContact N-O 3.05Å; T594-Y598 WeakPolarHBondContact OG1-CB 3.43Å; T594-Y598 PolarHBondContact OG1-N 3.31Å; T594-Y598 VanDerWaalsContact OG1-N 3.08Å; T594-Y598 PolarHBondContact OG1-O 3.18Å; L596-Y598 HydrophobicContact CB-CD2 3.76Å; L596-Y598 HydrophobicContact CB-CE2 3.77Å; L596-Y598 HydrophobicContact CD2-CE2 4.2Å
599	V	80	Confident	86.5	Confident	62 Å²	62	62.1 Å²	62.1	38%	0.376	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-72.9	128.1	169.4	-177.7	0	0	0	0	108.5	P591 R592 V593 A769	P591-V599 HydrophobicContact CB-CG1 3.82Å; R592-V599 CarbonylContact O-C 3.53Å; R592-V599 WeakPolarHBondContact O-CA 3.21Å; V593-V599 HydrophobicContact CG2-CG2 4.45Å; V599-A769 HydrophobicContact CG2-CB 4.43Å
600	L	83.6	Confident	86.9	Confident	69 Å²	69	61.4 Å²	61.4	36%	0.361	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-74.6	129.2	170.4	-67.6	174	0	0	0	109	R592 T594	R592-L600 HydrophobicContact CB-CB 4.15Å; R592-L600 HydrophobicContact CB-CD1 4.09Å; R592-L600 PolarHBondContact O-N 3.38Å; T594-L600 HydrophobicContact CG2-CD1 4.35Å; T594-L600 HydrophobicContact CG2-CD2 3.51Å; T594-L600 HydrophobicContact CG2-CG 3.73Å
601	P	86.6	Confident	87.6	Confident	49 Å²	49	56.9 Å²	56.9	32%	0.318	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-65.9	141.3	-179.5	25	-32.8	0	0	0	111.8	L470 R762	L470-P601 HydrophobicContact CD1-CB 4.16Å; L470-P601 HydrophobicContact CD1-CG 3.88Å; L470-P601 WeakPolarHBondContact CD1-O 3.42Å; P601-R762 HydrophobicContact CB-CG 3.89Å
602	S	92.1	Very high	88.3	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.021	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-65.6	149.9	171.1	176.2	0	0	0	0	111.9	D547 V604 V760 R762	D547-S602 PolarHBondContact OD2-OG 3.1Å; S602-V604 PolarHBondContact O-N 2.79Å; S602-V604 PolarHBondContact OG-N 2.91Å; S602-V760 WeakPolarHBondContact CB-O 3.19Å; S602-V760 PolarHBondContact OG-O 3.17Å; S602-R762 PolarHBondContact O-NE 3.37Å; S602-R762 PolarHBondContact O-NH2 2.95Å
603	H	92.6	Very high	89	Confident	46 Å²	46	53 Å²	53	21%	0.213	29%	0.289	C	S	.	.	S	Bend	trans	-66.5	-19.2	171.9	-64.9	80.9	0	0	0	113	D547 V548 M608	D547-H603 IonicContact OD1-ND1 2.68Å; D547-H603 IonicContact OD2-CE1 2.68Å; D547-H603 IonicContact OD2-CG 2.7Å; D547-H603 PolarHBondContact OD2-N 3.18Å; D547-H603 IonicContact OD2-ND1 3.13Å; D547-H603 PolarHBondContact OD2-ND1 3.45Å; V548-H603 HydrophobicContact CG2-CB 4.5Å; V548-H603 VanDerWaalsContact CG2-CE1 3.45Å; V548-H603 WeakPolarHBondContact CG2-CE1 3.42Å; V548-H603 WeakPolarHBondContact CG2-ND1 3.44Å; H603-M608 WeakPolarHBondContact O-CE 3.13Å; H603-M608 VanDerWaalsContact O-SD 3.4Å
604	V	95.6	Very high	89.8	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.			trans	-99.7	122.1	-178.8	180	0	0	0	0	111	Y550 L554 S602 L609 I761 R762	Y550-V604 HydrophobicContact CD1-CG1 4.32Å; Y550-V604 HydrophobicContact CD1-CG2 3.9Å; Y550-V604 HydrophobicContact CE1-CG1 4.15Å; Y550-V604 HydrophobicContact CG-CG2 4.31Å; L554-V604 HydrophobicContact CD1-CB 4.46Å; L554-V604 HydrophobicContact CD1-CG1 3.58Å; L554-V604 HydrophobicContact CD1-CG2 4.02Å; S602-V604 PolarHBondContact O-N 2.79Å; S602-V604 PolarHBondContact OG-N 2.91Å; V604-L609 HydrophobicContact CG1-CD1 3.52Å; V604-I761 HydrophobicContact CG1-CG1 4.14Å; V604-R762 WeakPolarHBondContact O-CB 3.45Å; V604-R762 PolarHBondContact O-N 3.42Å
605	T	96.5	Very high	90.6	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.018	26%	0.255	C	S	.	.			trans	-106.5	164.1	175	68.6	0	0	0	0	112.7	E607 M608 L609 E763	T605-E607 VanDerWaalsContact C-N 3.31Å; T605-E607 PolarHBondContact O-N 2.8Å; T605-M608 HydrophobicContact CG2-CE 4.34Å; T605-M608 WeakPolarHBondContact O-CB 3.43Å; T605-M608 PolarHBondContact O-N 3.46Å; T605-M608 VanDerWaalsContact OG1-CG 3.3Å; T605-M608 WeakPolarHBondContact OG1-CG 3.46Å; T605-M608 PolarHBondContact OG1-N 3.09Å; T605-L609 WeakPolarHBondContact O-CD1 3.34Å; T605-E763 WeakPolarHBondContact CA-OE2 3.14Å; T605-E763 WeakPolarHBondContact CB-OE1 3.41Å
606	E	96.5	Very high	91.5	Very high	28 Å²	28	41.2 Å²	41.2	13%	0.131	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-42	172.5	178.2	179.9	158.3	0	0	111.3	M608 L609 W610 L615 F629 K633 E763	E606-M608 VanDerWaalsContact C-N 3.29Å; E606-M608 PolarHBondContact O-N 2.93Å; E606-L609 PolarHBondContact O-N 3.3Å; E606-L609 VanDerWaalsContact O-N 3.11Å; E606-W610 VanDerWaalsContact CG-NE1 3.32Å; E606-W610 PolarHBondContact O-N 2.93Å; E606-W610 PolarHBondContact OE1-NE1 3.05Å; E606-L615 HydrophobicContact CG-CD1 3.99Å; E606-F629 HydrophobicContact CB-CZ 3.91Å; E606-F629 VanDerWaalsContact CD-CE1 3.41Å; E606-F629 VanDerWaalsContact CD-CZ 3.43Å; E606-F629 HydrophobicContact CG-CE1 3.83Å; E606-F629 HydrophobicContact CG-CE2 4.41Å; E606-F629 HydrophobicContact CG-CZ 3.51Å; E606-F629 WeakPolarHBondContact OE2-CE1 3.47Å; E606-F629 VanDerWaalsContact OE2-CZ 3.25Å; E606-F629 WeakPolarHBondContact OE2-CZ 3.29Å; E606-K633 IonicContact OE2-NZ 3.68Å; E606-K633 PolarHBondContact OE2-NZ 2.98Å; E606-E763 HydrophobicContact CB-CG 4.29Å; E606-E763 WeakPolarHBondContact CB-OE1 3.45Å; E606-E763 PolarHBondContact N-OE1 3.18Å; E606-E763 PolarHBondContact N-OE2 3.19Å
607	E	96.3	Very high	92.2	Very high	73 Å²	73	36.2 Å²	36.2	34%	0.341	19%	0.194	S	C	.	.	H	α-helix	trans	-59	-41.3	-179.2	-168	59.8	-138.8	0	0	111.8	T605 L609 W610 E611 R701	T605-E607 VanDerWaalsContact C-N 3.31Å; T605-E607 PolarHBondContact O-N 2.8Å; E607-L609 VanDerWaalsContact C-N 3.29Å; E607-L609 PolarHBondContact O-N 3.33Å; E607-W610 WeakPolarHBondContact O-CB 3.36Å; E607-W610 PolarHBondContact O-N 3.26Å; E607-E611 PolarHBondContact O-N 3.26Å; E607-R701 VanDerWaalsContact CD-NH1 3.35Å; E607-R701 IonicContact OE1-CZ 3.65Å; E607-R701 IonicContact OE1-NH1 3.21Å; E607-R701 PolarHBondContact OE1-NH1 3.21Å; E607-R701 IonicContact OE1-NH2 3.42Å; E607-R701 PolarHBondContact OE1-NH2 2.76Å; E607-R701 IonicContact OE2-CZ 3.61Å; E607-R701 IonicContact OE2-NH1 3.69Å; E607-R701 PolarHBondContact OE2-NH1 2.73Å; E607-R701 IonicContact OE2-NH2 2.8Å
608	M	97.1	Very high	93	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-56.9	-41	176.1	-70.4	175.3	-176.4	0	0	112.5	P471 L474 Y551 H603 T605 E606 E611 C612	P471-M608 HydrophobicContact CB-CE 3.92Å; P471-M608 WeakPolarHBondContact O-CE 3.35Å; L474-M608 HydrophobicContact CD1-CB 4.07Å; L474-M608 VanDerWaalsContact CD1-O 3.23Å; L474-M608 WeakPolarHBondContact CD1-O 3.24Å; L474-M608 HydrophobicContact CD2-CB 3.76Å; L474-M608 HydrophobicContact CD2-CG 3.73Å; L474-M608 HydrophobicContact CD2-SD 3.79Å; L474-M608 HydrophobicContact CG-CB 3.61Å; L474-M608 HydrophobicContact CG-CG 3.69Å; L474-M608 HydrophobicContact CG-SD 4.41Å; Y551-M608 HydrophobicContact CD2-CE 4Å; Y551-M608 HydrophobicContact CD2-SD 3.74Å; Y551-M608 HydrophobicContact CE2-CE 3.77Å; Y551-M608 HydrophobicContact CE2-SD 3.99Å; H603-M608 WeakPolarHBondContact O-CE 3.13Å; H603-M608 VanDerWaalsContact O-SD 3.4Å; T605-M608 HydrophobicContact CG2-CE 4.34Å; T605-M608 WeakPolarHBondContact O-CB 3.43Å; T605-M608 PolarHBondContact O-N 3.46Å; T605-M608 VanDerWaalsContact OG1-CG 3.3Å; T605-M608 WeakPolarHBondContact OG1-CG 3.46Å; T605-M608 PolarHBondContact OG1-N 3.09Å; E606-M608 VanDerWaalsContact C-N 3.29Å; E606-M608 PolarHBondContact O-N 2.93Å; M608-E611 PolarHBondContact O-N 3.35Å; M608-C612 PolarHBondContact O-N 2.92Å; M608-C612 VanDerWaalsContact O-N 3.07Å; M608-C612 PolarHBondContact O-SG 3.13Å
609	L	97.7	Very high	93.8	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-71.3	-31	177.3	-79	80.4	0	0	0	112.4	L554 V604 T605 E606 E607 K613 Q614 L615 I761	L554-L609 HydrophobicContact CD1-CD1 4.07Å; L554-L609 HydrophobicContact CD2-CG 4.43Å; V604-L609 HydrophobicContact CG1-CD1 3.52Å; T605-L609 WeakPolarHBondContact O-CD1 3.34Å; E606-L609 PolarHBondContact O-N 3.3Å; E606-L609 VanDerWaalsContact O-N 3.11Å; E607-L609 VanDerWaalsContact C-N 3.29Å; E607-L609 PolarHBondContact O-N 3.33Å; L609-K613 PolarHBondContact O-N 2.95Å; L609-Q614 HydrophobicContact CB-CB 4.04Å; L609-Q614 HydrophobicContact CD2-CB 4.16Å; L609-Q614 HydrophobicContact CG-CB 4Å; L609-Q614 CarbonylContact O-C 3.57Å; L609-Q614 WeakPolarHBondContact O-CA 3.33Å; L609-Q614 PolarHBondContact O-N 3.25Å; L609-L615 HydrophobicContact CB-CB 4.47Å; L609-L615 HydrophobicContact CB-CD1 3.74Å; L609-L615 HydrophobicContact CB-CG 3.77Å; L609-L615 HydrophobicContact CD2-CD1 4.45Å; L609-L615 HydrophobicContact CD2-CG 4.25Å; L609-L615 PolarHBondContact O-N 2.86Å; L609-I761 HydrophobicContact CD1-CD1 4.02Å; L609-I761 HydrophobicContact CD1-CG1 4.14Å; L609-I761 HydrophobicContact CD2-CD1 3.61Å; L609-I761 HydrophobicContact CD2-CG1 4.49Å; L609-I761 HydrophobicContact CG-CD1 4.48Å
610	W	97	Very high	94.5	Very high	25 Å²	25	29.1 Å²	29.1	10%	0.095	15%	0.153	C	C	.	.	H	α-helix	trans	-68.5	-37.9	170.9	-67.6	112	0	0	0	112.1	E606 E607 L615 T626 F630 R701 L706	E606-W610 VanDerWaalsContact CG-NE1 3.32Å; E606-W610 PolarHBondContact O-N 2.93Å; E606-W610 PolarHBondContact OE1-NE1 3.05Å; E607-W610 WeakPolarHBondContact O-CB 3.36Å; E607-W610 PolarHBondContact O-N 3.26Å; W610-L615 HydrophobicContact CD2-CB 3.55Å; W610-L615 HydrophobicContact CD2-CD1 4.11Å; W610-L615 HydrophobicContact CD2-CG 4.49Å; W610-L615 HydrophobicContact CE3-CB 3.48Å; W610-L615 VanDerWaalsContact CE3-CB 3.48Å; W610-L615 HydrophobicContact CG-CB 4.2Å; W610-L615 HydrophobicContact CG-CD1 4.31Å; W610-L615 HydrophobicContact CH2-CB 3.98Å; W610-L615 HydrophobicContact CZ2-CB 4.04Å; W610-L615 HydrophobicContact CZ2-CD1 4.15Å; W610-L615 HydrophobicContact CZ3-CB 3.72Å; W610-T626 HydrophobicContact CH2-CG2 3.74Å; W610-T626 HydrophobicContact CZ2-CG2 4.44Å; W610-T626 HydrophobicContact CZ3-CG2 4.39Å; W610-F630 AromaticContact CH2-CZ 4Å; W610-F630 HydrophobicContact CH2-CZ 4Å; W610-F630 HydrophobicContact CZ2-CE1 4.15Å; W610-F630 AromaticContact CZ2-CZ 3.94Å; W610-F630 HydrophobicContact CZ2-CZ 3.94Å; W610-R701 HydrophobicContact CD2-CG 3.88Å; W610-R701 HydrophobicContact CE3-CG 3.8Å; W610-R701 VanDerWaalsContact CG-CZ 3.48Å; W610-R701 HydrophobicContact CH2-CB 3.87Å; W610-R701 HydrophobicContact CH2-CG 3.8Å; W610-R701 HydrophobicContact CZ2-CB 3.87Å; W610-R701 HydrophobicContact CZ2-CG 3.87Å; W610-R701 HydrophobicContact CZ3-CB 4.29Å; W610-R701 HydrophobicContact CZ3-CG 3.73Å; W610-L706 HydrophobicContact CH2-CD1 4.12Å
611	E	94.9	Very high	95.1	Very high	50 Å²	50	27.5 Å²	27.5	23%	0.234	15%	0.147	C	C	.	.	H	α-helix	trans	-63.1	-54.5	176.2	-71.7	-178.5	-176	0	0	112.6	S473 L474 K558 E607 M608 K613	S473-E611 WeakPolarHBondContact CA-OE1 3.3Å; S473-E611 WeakPolarHBondContact CB-OE1 3.28Å; S473-E611 VanDerWaalsContact OG-CD 3.28Å; S473-E611 PolarHBondContact OG-OE1 2.71Å; S473-E611 PolarHBondContact OG-OE2 3.23Å; L474-E611 PolarHBondContact N-OE2 3.24Å; K558-E611 IonicContact NZ-OE2 2.68Å; K558-E611 PolarHBondContact NZ-OE2 3.43Å; E607-E611 PolarHBondContact O-N 3.26Å; M608-E611 PolarHBondContact O-N 3.35Å; E611-K613 PolarHBondContact O-N 2.83Å
612	C	94.8	Very high	95.5	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	14.3	-178.7	66.5	0	0	0	0	114.3	L474 K558 M608 Q614	L474-C612 HydrophobicContact CD1-CB 3.5Å; L474-C612 VanDerWaalsContact CD1-CB 3.5Å; K558-C612 HydrophobicContact CB-CB 3.93Å; M608-C612 PolarHBondContact O-N 2.92Å; M608-C612 VanDerWaalsContact O-N 3.07Å; M608-C612 PolarHBondContact O-SG 3.13Å; C612-Q614 PolarHBondContact O-N 3.08Å; C612-Q614 VanDerWaalsContact SG-CG 3.56Å
613	K	95.3	Very high	95.8	Very high	78 Å²	78	25 Å²	25	34%	0.339	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	27.9	177.5	-69	-178.4	175	-179.7	0	114.8	F561 L609 E611 H618 T622	F561-K613 HydrophobicContact CD1-CD 4.08Å; F561-K613 HydrophobicContact CD2-CD 4.24Å; F561-K613 HydrophobicContact CE1-CD 4.07Å; F561-K613 HydrophobicContact CE2-CD 4.27Å; F561-K613 HydrophobicContact CG-CD 4.21Å; F561-K613 HydrophobicContact CZ-CD 4.21Å; F561-K613 VanDerWaalsContact CZ-CE 3.5Å; L609-K613 PolarHBondContact O-N 2.95Å; E611-K613 PolarHBondContact O-N 2.83Å; K613-H618 VanDerWaalsContact CB-CE1 3.47Å; K613-H618 WeakPolarHBondContact CB-CE1 3.26Å; K613-H618 PolarHBondContact O-CE1 2.97Å; K613-H618 PolarHBondContact O-NE2 3.36Å; K613-H618 VanDerWaalsContact O-NE2 3.09Å; K613-T622 WeakPolarHBondContact O-CG2 3.21Å
614	Q	96.9	Very high	96.1	Very high	6 Å²	6	23 Å²	23	3%	0.028	12%	0.121	C	C	.	.	S	Bend	trans	-86.1	-10.6	169.9	-67.5	-62.7	-55.3	0	0	112.9	L554 D568 F570 L609 C612 T622	L554-Q614 HydrophobicContact CD2-CG 3.96Å; D568-Q614 PolarHBondContact OD1-NE2 3.48Å; F570-Q614 VanDerWaalsContact CB-OE1 3.27Å; F570-Q614 HydrophobicContact CD2-CG 4.01Å; F570-Q614 HydrophobicContact CE2-CG 4.31Å; L609-Q614 HydrophobicContact CB-CB 4.04Å; L609-Q614 HydrophobicContact CD2-CB 4.16Å; L609-Q614 HydrophobicContact CG-CB 4Å; L609-Q614 CarbonylContact O-C 3.57Å; L609-Q614 WeakPolarHBondContact O-CA 3.33Å; L609-Q614 PolarHBondContact O-N 3.25Å; C612-Q614 PolarHBondContact O-N 3.08Å; C612-Q614 VanDerWaalsContact SG-CG 3.56Å; Q614-T622 VanDerWaalsContact C-CG2 3.42Å; Q614-T622 WeakPolarHBondContact O-CG2 3.4Å
615	L	97.9	Very high	96.2	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.021	13%	0.125	C	C	.	.	S	Bend	trans	-120.7	149.7	160.9	-65.5	169.3	0	0	0	110.3	E606 L609 W610 T626 F629	E606-L615 HydrophobicContact CG-CD1 3.99Å; L609-L615 HydrophobicContact CB-CB 4.47Å; L609-L615 HydrophobicContact CB-CD1 3.74Å; L609-L615 HydrophobicContact CB-CG 3.77Å; L609-L615 HydrophobicContact CD2-CD1 4.45Å; L609-L615 HydrophobicContact CD2-CG 4.25Å; L609-L615 PolarHBondContact O-N 2.86Å; W610-L615 HydrophobicContact CD2-CB 3.55Å; W610-L615 HydrophobicContact CD2-CD1 4.11Å; W610-L615 HydrophobicContact CD2-CG 4.49Å; W610-L615 HydrophobicContact CE3-CB 3.48Å; W610-L615 VanDerWaalsContact CE3-CB 3.48Å; W610-L615 HydrophobicContact CG-CB 4.2Å; W610-L615 HydrophobicContact CG-CD1 4.31Å; W610-L615 HydrophobicContact CH2-CB 3.98Å; W610-L615 HydrophobicContact CZ2-CB 4.04Å; W610-L615 HydrophobicContact CZ2-CD1 4.15Å; W610-L615 HydrophobicContact CZ3-CB 3.72Å; L615-T626 WeakPolarHBondContact CA-OG1 3.37Å; L615-T626 HydrophobicContact CD2-CG2 4.12Å; L615-F629 HydrophobicContact CD1-CD1 4.17Å; L615-F629 HydrophobicContact CD1-CD2 4.5Å; L615-F629 HydrophobicContact CD1-CE1 4.26Å; L615-F629 HydrophobicContact CD1-CG 4.32Å; L615-F629 HydrophobicContact CD1-CZ 4.47Å; L615-F629 HydrophobicContact CD2-CB 3.78Å; L615-F629 HydrophobicContact CD2-CD1 4.17Å; L615-F629 HydrophobicContact CD2-CD2 4.48Å; L615-F629 HydrophobicContact CD2-CG 3.89Å
616	G	96.9	Very high	96.3	Very high	8 Å²	8	23.3 Å²	23.3	8%	0.082	12%	0.124	C	C	.	.	S	Bend	trans	128.1	-170.7	-177.6	0	0	0	0	0	114.7	T622 L623 T626	G616-T622 CarbonylContact O-C 3.58Å; G616-T622 VanDerWaalsContact O-C 3.32Å; G616-L623 VanDerWaalsContact O-CA 3.26Å; G616-L623 WeakPolarHBondContact O-CA 3.39Å; G616-L623 PolarHBondContact O-N 3.02Å; G616-T626 PolarHBondContact N-OG1 2.91Å; G616-T626 PolarHBondContact O-OG1 2.98Å
617	A	95.8	Very high	96.3	Very high	32 Å²	32	22 Å²	22	26%	0.264	12%	0.118	S	C	.	.	S	Bend	trans	-125.8	27.1	-170.4	0	0	0	0	0	114.1	L623 L706 F709 W740	A617-L623 HydrophobicContact CB-CD1 4.07Å; A617-L706 HydrophobicContact CB-CD2 3.64Å; A617-F709 HydrophobicContact CB-CD1 3.87Å; A617-F709 HydrophobicContact CB-CE1 3.89Å; A617-W740 VanDerWaalsContact O-CH2 3.31Å; A617-W740 WeakPolarHBondContact O-CH2 3.5Å
618	H	92	Very high	96.5	Very high	89 Å²	89	18.6 Å²	18.6	41%	0.412	10%	0.101	S	C	.	.	S	Bend	trans	-86.6	-17.3	-179.9	51.8	-94.9	0	0	0	113.4	K613 T622	K613-H618 VanDerWaalsContact CB-CE1 3.47Å; K613-H618 WeakPolarHBondContact CB-CE1 3.26Å; K613-H618 PolarHBondContact O-CE1 2.97Å; K613-H618 PolarHBondContact O-NE2 3.36Å; K613-H618 VanDerWaalsContact O-NE2 3.09Å; H618-T622 PolarHBondContact NE2-OG1 3.4Å
619	S	93.3	Very high	96.5	Very high	28 Å²	28	18.6 Å²	18.6	20%	0.196	10%	0.101	C	C	.	.	S	Bend	trans	-134.4	160.8	171.2	89.4	0	0	0	0	110.6	S621 T622 L623	S619-S621 VanDerWaalsContact C-N 3.34Å; S619-S621 PolarHBondContact OG-N 3.14Å; S619-T622 PolarHBondContact OG-N 3.05Å; S619-T622 PolarHBondContact OG-OG1 3.21Å; S619-L623 WeakPolarHBondContact O-CB 3.46Å; S619-L623 PolarHBondContact O-N 3.46Å; S619-L623 VanDerWaalsContact O-N 3.14Å
620	P	95.9	Very high	96.5	Very high	17 Å²	17	18.6 Å²	18.6	11%	0.11	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-38.6	173.5	-18.9	31	0	0	0	112.9	L624 P729 V733 W740 Y741	P620-L624 WeakPolarHBondContact O-CB 3.47Å; P620-L624 PolarHBondContact O-N 3.02Å; P620-L624 VanDerWaalsContact O-N 3.1Å; P620-P729 HydrophobicContact CB-CB 3.99Å; P620-P729 HydrophobicContact CB-CG 4.35Å; P620-V733 HydrophobicContact CG-CG1 3.53Å; P620-W740 HydrophobicContact CB-CB 4.06Å; P620-W740 HydrophobicContact CB-CD2 4.49Å; P620-W740 HydrophobicContact CB-CE3 4.17Å; P620-W740 HydrophobicContact CG-CB 3.92Å; P620-W740 HydrophobicContact CG-CD2 3.96Å; P620-W740 HydrophobicContact CG-CE3 4Å; P620-W740 HydrophobicContact CG-CG 3.99Å; P620-Y741 WeakPolarHBondContact CA-OH 3.42Å; P620-Y741 HydrophobicContact CB-CE1 3.91Å; P620-Y741 WeakPolarHBondContact O-CE1 3.4Å; P620-Y741 PolarHBondContact O-OH 2.62Å
621	S	95.1	Very high	96.5	Very high	34 Å²	34	17.4 Å²	17.4	24%	0.238	10%	0.097	C	C	.	.	H	α-helix	trans	-66.5	-48.7	-179.7	-57	0	0	0	0	111	S619 L623 L624 T625	S619-S621 VanDerWaalsContact C-N 3.34Å; S619-S621 PolarHBondContact OG-N 3.14Å; S621-L623 VanDerWaalsContact C-N 3.34Å; S621-L623 PolarHBondContact O-N 3.47Å; S621-L624 WeakPolarHBondContact O-CB 3.46Å; S621-L624 PolarHBondContact O-N 2.88Å; S621-L624 VanDerWaalsContact O-N 3.13Å; S621-T625 PolarHBondContact O-N 3.31Å; S621-T625 PolarHBondContact O-OG1 3.46Å
622	T	96.4	Very high	96.6	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-39.9	178.9	-38.2	0	0	0	0	111.7	K613 Q614 G616 H618 S619 L624 T625 T626	K613-T622 WeakPolarHBondContact O-CG2 3.21Å; Q614-T622 VanDerWaalsContact C-CG2 3.42Å; Q614-T622 WeakPolarHBondContact O-CG2 3.4Å; G616-T622 CarbonylContact O-C 3.58Å; G616-T622 VanDerWaalsContact O-C 3.32Å; H618-T622 PolarHBondContact NE2-OG1 3.4Å; S619-T622 PolarHBondContact OG-N 3.05Å; S619-T622 PolarHBondContact OG-OG1 3.21Å; T622-L624 VanDerWaalsContact C-N 3.29Å; T622-L624 PolarHBondContact O-N 2.99Å; T622-T625 PolarHBondContact O-N 3.07Å; T622-T626 WeakPolarHBondContact O-CB 3.44Å; T622-T626 PolarHBondContact O-N 3.48Å; T622-T626 PolarHBondContact O-OG1 2.95Å
623	L	97.8	Very high	96.7	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.3	-38.9	176	178	60.1	0	0	0	111.4	G616 A617 S619 S621 T626 L627 L706 F709 Y710 W740 Y741	G616-L623 VanDerWaalsContact O-CA 3.26Å; G616-L623 WeakPolarHBondContact O-CA 3.39Å; G616-L623 PolarHBondContact O-N 3.02Å; A617-L623 HydrophobicContact CB-CD1 4.07Å; S619-L623 WeakPolarHBondContact O-CB 3.46Å; S619-L623 PolarHBondContact O-N 3.46Å; S619-L623 VanDerWaalsContact O-N 3.14Å; S621-L623 VanDerWaalsContact C-N 3.34Å; S621-L623 PolarHBondContact O-N 3.47Å; L623-T626 PolarHBondContact O-N 3.35Å; L623-L627 WeakPolarHBondContact O-CG 2.86Å; L623-L627 PolarHBondContact O-N 3.2Å; L623-L706 HydrophobicContact CD1-CB 4.29Å; L623-L706 HydrophobicContact CD1-CD2 4.08Å; L623-F709 HydrophobicContact CD1-CD1 4.47Å; L623-F709 HydrophobicContact CD2-CD1 3.6Å; L623-F709 HydrophobicContact CD2-CE1 4.07Å; L623-Y710 HydrophobicContact CD2-CD2 4.43Å; L623-W740 HydrophobicContact CD2-CE3 4.24Å; L623-W740 HydrophobicContact CD2-CZ3 4.16Å; L623-Y741 WeakPolarHBondContact CB-OH 3.45Å; L623-Y741 HydrophobicContact CD2-CE2 4.44Å; L623-Y741 WeakPolarHBondContact CD2-OH 3.33Å
624	L	97.5	Very high	96.6	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-68.9	-41.9	176.9	-161.6	70.6	0	0	0	111.9	P620 S621 T622 T626 L627 M628 Y710 Y726 L727 P729 Y741 I746 M754	P620-L624 WeakPolarHBondContact O-CB 3.47Å; P620-L624 PolarHBondContact O-N 3.02Å; P620-L624 VanDerWaalsContact O-N 3.1Å; S621-L624 WeakPolarHBondContact O-CB 3.46Å; S621-L624 PolarHBondContact O-N 2.88Å; S621-L624 VanDerWaalsContact O-N 3.13Å; T622-L624 VanDerWaalsContact C-N 3.29Å; T622-L624 PolarHBondContact O-N 2.99Å; L624-T626 VanDerWaalsContact C-N 3.31Å; L624-T626 PolarHBondContact O-N 2.67Å; L624-L627 PolarHBondContact O-N 2.82Å; L624-M628 WeakPolarHBondContact O-CB 3.26Å; L624-M628 PolarHBondContact O-N 3.09Å; L624-Y710 HydrophobicContact CD1-CE2 3.8Å; L624-Y726 HydrophobicContact CD1-CD1 3.94Å; L624-Y726 HydrophobicContact CG-CD1 4.28Å; L624-L727 WeakPolarHBondContact CD2-O 3.32Å; L624-P729 HydrophobicContact CD2-CG 4.45Å; L624-Y741 HydrophobicContact CB-CE1 4.37Å; L624-Y741 HydrophobicContact CD1-CE1 4.32Å; L624-I746 HydrophobicContact CD2-CD1 4.23Å; L624-I746 HydrophobicContact CD2-CG2 3.66Å; L624-M754 HydrophobicContact CB-CE 4.28Å; L624-M754 HydrophobicContact CD2-CE 4.26Å; L624-M754 HydrophobicContact CG-CE 4.14Å
625	T	97.9	Very high	96.5	Very high	11 Å²	11	17.5 Å²	17.5	7%	0.067	10%	0.095	C	C	.	.	H	α-helix	trans	-58.3	-42.6	170.6	-59.4	0	0	0	0	111.3	S621 T622 M628 F629 I758	S621-T625 PolarHBondContact O-N 3.31Å; S621-T625 PolarHBondContact O-OG1 3.46Å; T622-T625 PolarHBondContact O-N 3.07Å; T625-M628 WeakPolarHBondContact O-CB 3.31Å; T625-M628 PolarHBondContact O-N 3.29Å; T625-F629 WeakPolarHBondContact O-CB 3.45Å; T625-F629 PolarHBondContact O-N 2.73Å; T625-I758 HydrophobicContact CG2-CD1 4.41Å
626	T	98.5	Very high	96.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.8	-41.2	-178.6	-53.9	0	0	0	0	112.3	W610 L615 G616 T622 L623 L624 F629 F630 L706	W610-T626 HydrophobicContact CH2-CG2 3.74Å; W610-T626 HydrophobicContact CZ2-CG2 4.44Å; W610-T626 HydrophobicContact CZ3-CG2 4.39Å; L615-T626 WeakPolarHBondContact CA-OG1 3.37Å; L615-T626 HydrophobicContact CD2-CG2 4.12Å; G616-T626 PolarHBondContact N-OG1 2.91Å; G616-T626 PolarHBondContact O-OG1 2.98Å; T622-T626 WeakPolarHBondContact O-CB 3.44Å; T622-T626 PolarHBondContact O-N 3.48Å; T622-T626 PolarHBondContact O-OG1 2.95Å; L623-T626 PolarHBondContact O-N 3.35Å; L624-T626 VanDerWaalsContact C-N 3.31Å; L624-T626 PolarHBondContact O-N 2.67Å; T626-F629 PolarHBondContact O-N 3.39Å; T626-F630 HydrophobicContact CG2-CD2 4.3Å; T626-F630 HydrophobicContact CG2-CE2 3.66Å; T626-F630 HydrophobicContact CG2-CZ 3.87Å; T626-F630 WeakPolarHBondContact O-CD2 3.44Å; T626-F630 WeakPolarHBondContact O-CG 3.48Å; T626-F630 PolarHBondContact O-N 2.88Å; T626-L706 HydrophobicContact CG2-CD1 3.96Å
627	L	98.3	Very high	96.2	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-67.3	-38.3	171.8	-68.8	179	0	0	0	112	L623 L624 F629 F630 N631 Y710 F725	L623-L627 WeakPolarHBondContact O-CG 2.86Å; L623-L627 PolarHBondContact O-N 3.2Å; L624-L627 PolarHBondContact O-N 2.82Å; L627-F629 VanDerWaalsContact C-N 3.34Å; L627-F630 PolarHBondContact O-N 3.33Å; L627-N631 WeakPolarHBondContact O-CB 3.43Å; L627-N631 PolarHBondContact O-N 2.96Å; L627-N631 PolarHBondContact O-ND2 2.83Å; L627-Y710 HydrophobicContact CD1-CD1 3.36Å; L627-Y710 HydrophobicContact CD1-CD2 3.91Å; L627-Y710 HydrophobicContact CD1-CE1 3.97Å; L627-Y710 HydrophobicContact CD1-CE2 4.48Å; L627-Y710 HydrophobicContact CD1-CG 3.32Å; L627-F725 HydrophobicContact CB-CE1 4.35Å; L627-F725 HydrophobicContact CD1-CE1 4.35Å; L627-F725 HydrophobicContact CD1-CZ 4.49Å
628	M	98.4	Very high	96.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.2	-45.5	174.5	-165.4	172.8	-66.1	0	0	110.8	L624 T625 N631 T632 Y726 I746 M751 M754 L755 I758	L624-M628 WeakPolarHBondContact O-CB 3.26Å; L624-M628 PolarHBondContact O-N 3.09Å; T625-M628 WeakPolarHBondContact O-CB 3.31Å; T625-M628 PolarHBondContact O-N 3.29Å; M628-N631 PolarHBondContact O-N 3.12Å; M628-T632 PolarHBondContact O-N 3.47Å; M628-T632 PolarHBondContact O-OG1 3.21Å; M628-T632 VanDerWaalsContact O-OG1 3.13Å; M628-Y726 HydrophobicContact CB-CE1 3.87Å; M628-Y726 HydrophobicContact CE-CD1 3.95Å; M628-Y726 HydrophobicContact CE-CE1 4.02Å; M628-Y726 HydrophobicContact CE-CG 4.36Å; M628-Y726 HydrophobicContact CG-CE1 4.19Å; M628-I746 HydrophobicContact CE-CD1 3.84Å; M628-M751 HydrophobicContact CE-CB 4.45Å; M628-M751 HydrophobicContact CE-CE 4.21Å; M628-M751 HydrophobicContact CE-CG 3.86Å; M628-M751 HydrophobicContact SD-CG 4.38Å; M628-M754 HydrophobicContact CE-CB 4.19Å; M628-M754 HydrophobicContact CE-CE 3.7Å; M628-M754 HydrophobicContact CE-SD 3.87Å; M628-M754 HydrophobicContact SD-CB 3.63Å; M628-M754 HydrophobicContact SD-CE 4.21Å; M628-L755 HydrophobicContact SD-CB 4.2Å; M628-I758 HydrophobicContact CB-CD1 3.78Å; M628-I758 HydrophobicContact CG-CD1 3.73Å; M628-I758 HydrophobicContact SD-CD1 4.07Å
629	F	98.6	Very high	96.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.1	-51.1	175.4	175.2	-94.1	0	0	0	112.3	E606 L615 T625 T626 L627 N631 T632 K633 I758 I761 I764	E606-F629 HydrophobicContact CB-CZ 3.91Å; E606-F629 VanDerWaalsContact CD-CE1 3.41Å; E606-F629 VanDerWaalsContact CD-CZ 3.43Å; E606-F629 HydrophobicContact CG-CE1 3.83Å; E606-F629 HydrophobicContact CG-CE2 4.41Å; E606-F629 HydrophobicContact CG-CZ 3.51Å; E606-F629 WeakPolarHBondContact OE2-CE1 3.47Å; E606-F629 VanDerWaalsContact OE2-CZ 3.25Å; E606-F629 WeakPolarHBondContact OE2-CZ 3.29Å; L615-F629 HydrophobicContact CD1-CD1 4.17Å; L615-F629 HydrophobicContact CD1-CD2 4.5Å; L615-F629 HydrophobicContact CD1-CE1 4.26Å; L615-F629 HydrophobicContact CD1-CG 4.32Å; L615-F629 HydrophobicContact CD1-CZ 4.47Å; L615-F629 HydrophobicContact CD2-CB 3.78Å; L615-F629 HydrophobicContact CD2-CD1 4.17Å; L615-F629 HydrophobicContact CD2-CD2 4.48Å; L615-F629 HydrophobicContact CD2-CG 3.89Å; T625-F629 WeakPolarHBondContact O-CB 3.45Å; T625-F629 PolarHBondContact O-N 2.73Å; T626-F629 PolarHBondContact O-N 3.39Å; L627-F629 VanDerWaalsContact C-N 3.34Å; F629-N631 VanDerWaalsContact C-N 3.32Å; F629-N631 PolarHBondContact O-N 3.19Å; F629-T632 PolarHBondContact O-N 3.2Å; F629-K633 HydrophobicContact CE1-CD 4.05Å; F629-K633 HydrophobicContact CZ-CD 4.05Å; F629-K633 WeakPolarHBondContact O-CB 3.48Å; F629-K633 PolarHBondContact O-N 2.81Å; F629-I758 HydrophobicContact CB-CD1 4.33Å; F629-I758 HydrophobicContact CB-CG1 4.47Å; F629-I758 HydrophobicContact CD2-CG2 4.09Å; F629-I761 HydrophobicContact CD2-CD1 3.7Å; F629-I761 HydrophobicContact CE2-CD1 3.61Å; F629-I761 HydrophobicContact CE2-CG2 4.21Å; F629-I764 HydrophobicContact CD2-CD1 3.94Å; F629-I764 HydrophobicContact CD2-CG1 4.11Å; F629-I764 HydrophobicContact CE2-CD1 3.6Å; F629-I764 HydrophobicContact CE2-CG1 3.62Å; F629-I764 HydrophobicContact CZ-CD1 4.08Å; F629-I764 HydrophobicContact CZ-CG1 4.4Å
630	F	97.9	Very high	96.4	Very high	3 Å²	3	20 Å²	20	1%	0.013	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-36.8	176.6	-63.7	-35.8	0	0	0	113	W610 T626 L627 K633 Y634 Q692 R701 P703 L706	W610-F630 AromaticContact CH2-CZ 4Å; W610-F630 HydrophobicContact CH2-CZ 4Å; W610-F630 HydrophobicContact CZ2-CE1 4.15Å; W610-F630 AromaticContact CZ2-CZ 3.94Å; W610-F630 HydrophobicContact CZ2-CZ 3.94Å; T626-F630 HydrophobicContact CG2-CD2 4.3Å; T626-F630 HydrophobicContact CG2-CE2 3.66Å; T626-F630 HydrophobicContact CG2-CZ 3.87Å; T626-F630 WeakPolarHBondContact O-CD2 3.44Å; T626-F630 WeakPolarHBondContact O-CG 3.48Å; T626-F630 PolarHBondContact O-N 2.88Å; L627-F630 PolarHBondContact O-N 3.33Å; F630-K633 PolarHBondContact O-N 3.43Å; F630-Y634 HydrophobicContact CB-CD2 4.1Å; F630-Y634 HydrophobicContact CB-CE2 4.47Å; F630-Y634 HydrophobicContact CD1-CD2 4.33Å; F630-Y634 AromaticContact CD1-CE2 3.86Å; F630-Y634 HydrophobicContact CD1-CE2 3.86Å; F630-Y634 HydrophobicContact CG-CE2 4.47Å; F630-Y634 WeakPolarHBondContact O-CB 3.18Å; F630-Y634 WeakPolarHBondContact O-CD2 3.44Å; F630-Y634 PolarHBondContact O-N 2.9Å; F630-Q692 PolarHBondContact O-NE2 3Å; F630-R701 WeakPolarHBondContact CZ-O 3.43Å; F630-P703 HydrophobicContact CD1-CG 4.14Å; F630-P703 HydrophobicContact CD2-CB 3.73Å; F630-P703 HydrophobicContact CD2-CG 3.97Å; F630-P703 HydrophobicContact CE1-CG 4.08Å; F630-P703 HydrophobicContact CE2-CB 3.92Å; F630-P703 HydrophobicContact CE2-CG 3.91Å; F630-P703 HydrophobicContact CG-CB 4.16Å; F630-P703 HydrophobicContact CG-CG 4.09Å; F630-P703 HydrophobicContact CZ-CB 4.48Å; F630-P703 HydrophobicContact CZ-CG 3.97Å; F630-L706 HydrophobicContact CE2-CB 4.4Å; F630-L706 HydrophobicContact CE2-CD1 3.56Å; F630-L706 HydrophobicContact CZ-CD1 3.85Å
631	N	97.3	Very high	96.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-69.8	-34.5	176.8	-67.9	-32.5	0	0	0	111.7	L627 M628 F629 F635 L636 L637 L646 Q692 F725 Y726	L627-N631 WeakPolarHBondContact O-CB 3.43Å; L627-N631 PolarHBondContact O-N 2.96Å; L627-N631 PolarHBondContact O-ND2 2.83Å; M628-N631 PolarHBondContact O-N 3.12Å; F629-N631 VanDerWaalsContact C-N 3.32Å; F629-N631 PolarHBondContact O-N 3.19Å; N631-F635 HydrophobicContact CB-CD2 4.19Å; N631-F635 CarbonylContact O-C 3.57Å; N631-F635 WeakPolarHBondContact O-CA 3.44Å; N631-F635 VanDerWaalsContact O-CB 3.26Å; N631-F635 WeakPolarHBondContact O-CB 3.45Å; N631-F635 PolarHBondContact O-N 2.82Å; N631-F635 WeakPolarHBondContact OD1-CD2 3.47Å; N631-F635 WeakPolarHBondContact OD1-CE2 3.26Å; N631-L636 PolarHBondContact O-N 3.26Å; N631-L637 HydrophobicContact CB-CD1 4.16Å; N631-L637 PolarHBondContact O-N 3.18Å; N631-L646 HydrophobicContact CB-CD2 4.35Å; N631-L646 WeakPolarHBondContact ND2-CD2 3.39Å; N631-Q692 PolarHBondContact OD1-NE2 3.13Å; N631-F725 WeakPolarHBondContact ND2-CE1 3.47Å; N631-Y726 WeakPolarHBondContact CB-OH 3.02Å; N631-Y726 PolarHBondContact ND2-OH 2.95Å
632	T	97	Very high	96.4	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-68	-46.6	170.1	-57.6	0	0	0	0	111.3	M628 F629 L636 L637 H643 L755 I758 L759 I764	M628-T632 PolarHBondContact O-N 3.47Å; M628-T632 PolarHBondContact O-OG1 3.21Å; M628-T632 VanDerWaalsContact O-OG1 3.13Å; F629-T632 PolarHBondContact O-N 3.2Å; T632-L636 VanDerWaalsContact O-CA 3.24Å; T632-L636 WeakPolarHBondContact O-CA 3.43Å; T632-L636 PolarHBondContact O-N 3.34Å; T632-L637 WeakPolarHBondContact CA-O 3.21Å; T632-L637 WeakPolarHBondContact CG2-O 3.36Å; T632-L637 PolarHBondContact OG1-O 2.93Å; T632-H643 PolarHBondContact OG1-CE1 3.14Å; T632-H643 PolarHBondContact OG1-NE2 3.35Å; T632-H643 VanDerWaalsContact OG1-NE2 3.07Å; T632-L755 HydrophobicContact CG2-CD1 4.31Å; T632-L755 WeakPolarHBondContact OG1-CD1 3.29Å; T632-I758 HydrophobicContact CG2-CG2 3.86Å; T632-L759 HydrophobicContact CG2-CD2 4.09Å; T632-I764 HydrophobicContact CG2-CD1 4.18Å; T632-I764 HydrophobicContact CG2-CG2 3.64Å
633	K	95.7	Very high	96.4	Very high	41 Å²	41	24.6 Å²	24.6	18%	0.178	12%	0.122	C	C	.	.	H	α-helix	trans	-65.9	-55.4	-177	-163.8	172.2	-171.1	179.3	0	113.1	E606 F629 F630 I764 A767	E606-K633 IonicContact OE2-NZ 3.68Å; E606-K633 PolarHBondContact OE2-NZ 2.98Å; F629-K633 HydrophobicContact CE1-CD 4.05Å; F629-K633 HydrophobicContact CZ-CD 4.05Å; F629-K633 WeakPolarHBondContact O-CB 3.48Å; F629-K633 PolarHBondContact O-N 2.81Å; F630-K633 PolarHBondContact O-N 3.43Å; K633-I764 HydrophobicContact CB-CD1 3.5Å; K633-I764 HydrophobicContact CD-CD1 4.43Å; K633-I764 HydrophobicContact CG-CD1 3.94Å; K633-A767 HydrophobicContact CG-CB 4.47Å
634	Y	94.3	Very high	96.2	Very high	88 Å²	88	27.4 Å²	27.4	35%	0.345	14%	0.135	S	C	.	.	H	α-helix	trans	-96.3	-34.2	-169.1	-62.4	-75.4	0	0	0	113.4	F630 Q692 P703	F630-Y634 HydrophobicContact CB-CD2 4.1Å; F630-Y634 HydrophobicContact CB-CE2 4.47Å; F630-Y634 HydrophobicContact CD1-CD2 4.33Å; F630-Y634 AromaticContact CD1-CE2 3.86Å; F630-Y634 HydrophobicContact CD1-CE2 3.86Å; F630-Y634 HydrophobicContact CG-CE2 4.47Å; F630-Y634 WeakPolarHBondContact O-CB 3.18Å; F630-Y634 WeakPolarHBondContact O-CD2 3.44Å; F630-Y634 PolarHBondContact O-N 2.9Å; Y634-Q692 VanDerWaalsContact CB-CG 3.48Å; Y634-Q692 HydrophobicContact CD2-CG 3.78Å; Y634-Q692 HydrophobicContact CG-CG 3.79Å; Y634-P703 HydrophobicContact CE2-CG 4.38Å
635	F	93.9	Very high	96	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-92.7	-1.3	176.4	-56.2	-20.7	0	0	0	113.1	N631 L637 V651 I669 Y671 A690 Q692	N631-F635 HydrophobicContact CB-CD2 4.19Å; N631-F635 CarbonylContact O-C 3.57Å; N631-F635 WeakPolarHBondContact O-CA 3.44Å; N631-F635 VanDerWaalsContact O-CB 3.26Å; N631-F635 WeakPolarHBondContact O-CB 3.45Å; N631-F635 PolarHBondContact O-N 2.82Å; N631-F635 WeakPolarHBondContact OD1-CD2 3.47Å; N631-F635 WeakPolarHBondContact OD1-CE2 3.26Å; F635-L637 HydrophobicContact CB-CD2 4.4Å; F635-L637 HydrophobicContact CB-CG 4.08Å; F635-L637 PolarHBondContact O-N 3.13Å; F635-V651 HydrophobicContact CE2-CG1 4.37Å; F635-I669 HydrophobicContact CZ-CG2 4.08Å; F635-Y671 HydrophobicContact CB-CD1 3.87Å; F635-Y671 HydrophobicContact CB-CG 4.46Å; F635-Y671 VanDerWaalsContact CD2-CB 3.42Å; F635-Y671 HydrophobicContact CD2-CD1 4.19Å; F635-Y671 AromaticContact CD2-CG 3.94Å; F635-Y671 HydrophobicContact CD2-CG 3.94Å; F635-Y671 VanDerWaalsContact CE2-CB 3.42Å; F635-Y671 HydrophobicContact CE2-CG 4.33Å; F635-Y671 HydrophobicContact CG-CD1 4.04Å; F635-Y671 HydrophobicContact CG-CG 4.17Å; F635-A690 HydrophobicContact CB-CB 4.29Å; F635-A690 HydrophobicContact CD1-CB 3.53Å; F635-A690 HydrophobicContact CE1-CB 4.29Å; F635-A690 WeakPolarHBondContact CE1-O 3.4Å; F635-A690 HydrophobicContact CG-CB 4.27Å; F635-Q692 HydrophobicContact CD1-CG 4.2Å; F635-Q692 HydrophobicContact CE1-CB 4.34Å; F635-Q692 HydrophobicContact CE1-CG 3.62Å; F635-Q692 VanDerWaalsContact CE2-NE2 3.29Å; F635-Q692 HydrophobicContact CZ-CG 3.92Å; F635-Q692 VanDerWaalsContact CZ-NE2 3.28Å
636	L	93.7	Very high	95.8	Very high	54 Å²	54	32.8 Å²	32.8	28%	0.283	16%	0.158	S	C	.	.			trans	54.4	36.8	176.5	-60.3	169	0	0	0	113	N631 T632 K638 A771	N631-L636 PolarHBondContact O-N 3.26Å; T632-L636 VanDerWaalsContact O-CA 3.24Å; T632-L636 WeakPolarHBondContact O-CA 3.43Å; T632-L636 PolarHBondContact O-N 3.34Å; L636-K638 WeakPolarHBondContact O-CG 3.47Å; L636-K638 PolarHBondContact O-N 3.4Å; L636-A771 HydrophobicContact CD1-CB 3.49Å; L636-A771 VanDerWaalsContact CD1-CB 3.49Å; L636-A771 HydrophobicContact CD2-CB 4.06Å; L636-A771 HydrophobicContact CG-CB 4.43Å
637	L	94.3	Very high	95.5	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	16%	0.158	C	C	.	.			trans	-79.5	105.8	171.2	-49.4	-176.5	0	0	0	108.1	N631 T632 F635 Q642 H643 L646 Y671	N631-L637 HydrophobicContact CB-CD1 4.16Å; N631-L637 PolarHBondContact O-N 3.18Å; T632-L637 WeakPolarHBondContact CA-O 3.21Å; T632-L637 WeakPolarHBondContact CG2-O 3.36Å; T632-L637 PolarHBondContact OG1-O 2.93Å; F635-L637 HydrophobicContact CB-CD2 4.4Å; F635-L637 HydrophobicContact CB-CG 4.08Å; F635-L637 PolarHBondContact O-N 3.13Å; L637-Q642 HydrophobicContact CB-CB 4.01Å; L637-Q642 HydrophobicContact CD2-CB 4Å; L637-Q642 HydrophobicContact CG-CB 4.48Å; L637-H643 VanDerWaalsContact CB-NE2 3.34Å; L637-H643 WeakPolarHBondContact CB-NE2 3.36Å; L637-H643 PolarHBondContact O-NE2 3.33Å; L637-L646 HydrophobicContact CD1-CB 4.5Å; L637-L646 HydrophobicContact CD1-CD1 4.32Å; L637-L646 HydrophobicContact CD1-CD2 4.09Å; L637-Y671 HydrophobicContact CD2-CD1 4.42Å; L637-Y671 HydrophobicContact CD2-CE1 3.65Å
638	K	93.5	Very high	95.3	Very high	57 Å²	57	33.1 Å²	33.1	25%	0.248	16%	0.159	C	C	.	.			trans	-103.2	-4.8	-173.1	-45.8	-176.9	-167.2	-173.4	0	112.9	L636 I768 N772	L636-K638 WeakPolarHBondContact O-CG 3.47Å; L636-K638 PolarHBondContact O-N 3.4Å; K638-I768 HydrophobicContact CD-CD1 4.04Å; K638-I768 HydrophobicContact CD-CG1 3.85Å; K638-I768 HydrophobicContact CD-CG2 4.11Å; K638-I768 HydrophobicContact CG-CD1 4.07Å; K638-I768 HydrophobicContact CG-CG1 4.16Å; K638-N772 PolarHBondContact NZ-OD1 2.89Å
639	T	95.5	Very high	94.9	Very high	65 Å²	65	35.6 Å²	35.6	40%	0.399	18%	0.176	S	C	.	.	S	Bend	trans	-138.2	150.1	-171.7	60.5	0	0	0	0	112.5	D641 Q642 H643 L755	T639-D641 PolarHBondContact O-N 2.99Å; T639-Q642 VanDerWaalsContact N-OE1 3.07Å; T639-Q642 WeakPolarHBondContact O-CB 3.48Å; T639-Q642 PolarHBondContact O-N 3.16Å; T639-Q642 VanDerWaalsContact OG1-CG 3.24Å; T639-Q642 WeakPolarHBondContact OG1-CG 3.41Å; T639-Q642 PolarHBondContact OG1-N 3.31Å; T639-Q642 PolarHBondContact OG1-OE1 2.95Å; T639-H643 PolarHBondContact O-CD2 2.81Å; T639-H643 PolarHBondContact O-N 3.09Å; T639-H643 VanDerWaalsContact O-N 3.15Å; T639-L755 VanDerWaalsContact C-CD2 3.44Å
640	V	96.9	Very high	94.4	Very high	31 Å²	31	39.5 Å²	39.5	19%	0.188	19%	0.193	C	C	.	.	H	α-helix	trans	-56.8	-35.7	178.6	-178.5	0	0	0	0	111.6	Q642 H643 M644 R748 M751 L755	V640-Q642 PolarHBondContact O-N 3.48Å; V640-H643 PolarHBondContact O-N 2.92Å; V640-M644 HydrophobicContact CG1-CG 4.08Å; V640-M644 VanDerWaalsContact O-CB 3.3Å; V640-M644 WeakPolarHBondContact O-CB 3.33Å; V640-M644 WeakPolarHBondContact O-CG 3.46Å; V640-M644 PolarHBondContact O-N 3.2Å; V640-R748 HydrophobicContact CG1-CG 3.89Å; V640-M751 HydrophobicContact CG1-CB 4.26Å; V640-M751 HydrophobicContact CG1-CG 3.98Å; V640-M751 HydrophobicContact CG1-SD 3.88Å; V640-L755 HydrophobicContact CG2-CD2 3.99Å
641	D	95.9	Very high	94	Very high	75 Å²	75	39.6 Å²	39.6	40%	0.401	19%	0.194	S	C	.	.	H	α-helix	trans	-69.4	-26.6	175.6	-70.2	-51.9	0	0	0	114.4	T639 K645 R748	T639-D641 PolarHBondContact O-N 2.99Å; D641-K645 WeakPolarHBondContact O-CB 3.4Å; D641-K645 WeakPolarHBondContact O-CD 3.43Å; D641-K645 WeakPolarHBondContact O-CG 3.49Å; D641-K645 PolarHBondContact O-N 3.18Å; D641-R748 IonicContact OD1-CZ 2.71Å; D641-R748 VanDerWaalsContact OD1-CZ 3.22Å; D641-R748 IonicContact OD1-NH1 2.69Å; D641-R748 PolarHBondContact OD1-NH1 3.07Å; D641-R748 IonicContact OD1-NH2 2.65Å; D641-R748 PolarHBondContact OD1-NH2 3.38Å; D641-R748 IonicContact OD2-NH1 2.74Å
642	Q	94.7	Very high	93.6	Very high	74 Å²	74	44 Å²	44	35%	0.346	22%	0.217	S	C	.	.	H	α-helix	trans	-74.4	-41.5	172.1	-74.6	163.5	-35.4	0	0	111	L637 T639 V640 K645 L646	L637-Q642 HydrophobicContact CB-CB 4.01Å; L637-Q642 HydrophobicContact CD2-CB 4Å; L637-Q642 HydrophobicContact CG-CB 4.48Å; T639-Q642 VanDerWaalsContact N-OE1 3.07Å; T639-Q642 WeakPolarHBondContact O-CB 3.48Å; T639-Q642 PolarHBondContact O-N 3.16Å; T639-Q642 VanDerWaalsContact OG1-CG 3.24Å; T639-Q642 WeakPolarHBondContact OG1-CG 3.41Å; T639-Q642 PolarHBondContact OG1-N 3.31Å; T639-Q642 PolarHBondContact OG1-OE1 2.95Å; V640-Q642 PolarHBondContact O-N 3.48Å; Q642-K645 PolarHBondContact O-N 2.91Å; Q642-L646 PolarHBondContact O-N 3.25Å
643	H	96.2	Very high	93.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-39.4	175.4	-74.8	-97.2	0	0	0	112.6	T632 L637 T639 V640 K645 L646 Y726 M751 L755	T632-H643 PolarHBondContact OG1-CE1 3.14Å; T632-H643 PolarHBondContact OG1-NE2 3.35Å; T632-H643 VanDerWaalsContact OG1-NE2 3.07Å; L637-H643 VanDerWaalsContact CB-NE2 3.34Å; L637-H643 WeakPolarHBondContact CB-NE2 3.36Å; L637-H643 PolarHBondContact O-NE2 3.33Å; T639-H643 PolarHBondContact O-CD2 2.81Å; T639-H643 PolarHBondContact O-N 3.09Å; T639-H643 VanDerWaalsContact O-N 3.15Å; V640-H643 PolarHBondContact O-N 2.92Å; H643-K645 PolarHBondContact O-N 3.3Å; H643-L646 VanDerWaalsContact O-CB 3.25Å; H643-L646 WeakPolarHBondContact O-CB 3.43Å; H643-L646 PolarHBondContact O-N 3.34Å; H643-L646 VanDerWaalsContact O-N 3.12Å; H643-Y726 HydrophobicContact CB-CE2 3.93Å; H643-Y726 AromaticContact ND1-CE2 3.8Å; H643-Y726 AromaticContact ND1-CZ 3.5Å; H643-Y726 PolarHBondContact ND1-OH 2.78Å; H643-M751 HydrophobicContact CB-CE 3.88Å; H643-M751 HydrophobicContact CB-CG 4.26Å; H643-M751 HydrophobicContact CB-SD 3.33Å; H643-M751 WeakPolarHBondContact CB-SD 3.24Å; H643-L755 WeakPolarHBondContact NE2-CD1 3.38Å
644	M	94.7	Very high	92.9	Very high	58 Å²	58	51.6 Å²	51.6	29%	0.286	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-25.5	172.8	-73.3	-91.9	118.4	0	0	113.1	V640 M751	V640-M644 HydrophobicContact CG1-CG 4.08Å; V640-M644 VanDerWaalsContact O-CB 3.3Å; V640-M644 WeakPolarHBondContact O-CB 3.33Å; V640-M644 WeakPolarHBondContact O-CG 3.46Å; V640-M644 PolarHBondContact O-N 3.2Å; M644-M751 HydrophobicContact CE-CB 4.34Å; M644-M751 HydrophobicContact CE-CE 3.51Å; M644-M751 HydrophobicContact CE-SD 3.56Å; M644-M751 VanDerWaalsContact CE-SD 3.56Å; M644-M751 HydrophobicContact CG-SD 3.78Å
645	K	92.9	Very high	92.6	Very high	126 Å²	126	50.7 Å²	50.7	55%	0.548	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-10	175.5	-74.1	167.7	-168.7	172.6	0	113.4	D641 Q642 H643 K650	D641-K645 WeakPolarHBondContact O-CB 3.4Å; D641-K645 WeakPolarHBondContact O-CD 3.43Å; D641-K645 WeakPolarHBondContact O-CG 3.49Å; D641-K645 PolarHBondContact O-N 3.18Å; Q642-K645 PolarHBondContact O-N 2.91Å; H643-K645 PolarHBondContact O-N 3.3Å; K645-K650 PolarHBondContact O-NZ 2.91Å
646	L	93.8	Very high	92.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.264	C	S	.	.			trans	-71.7	139.4	176.5	-165.2	64.6	0	0	0	110	N631 L637 Q642 H643 V651 Y671 T724 F725 Y726	N631-L646 HydrophobicContact CB-CD2 4.35Å; N631-L646 WeakPolarHBondContact ND2-CD2 3.39Å; L637-L646 HydrophobicContact CD1-CB 4.5Å; L637-L646 HydrophobicContact CD1-CD1 4.32Å; L637-L646 HydrophobicContact CD1-CD2 4.09Å; Q642-L646 PolarHBondContact O-N 3.25Å; H643-L646 VanDerWaalsContact O-CB 3.25Å; H643-L646 WeakPolarHBondContact O-CB 3.43Å; H643-L646 PolarHBondContact O-N 3.34Å; H643-L646 VanDerWaalsContact O-N 3.12Å; L646-V651 HydrophobicContact CD1-CG2 3.5Å; L646-V651 VanDerWaalsContact CD1-CG2 3.5Å; L646-V651 HydrophobicContact CD2-CG2 4.4Å; L646-V651 HydrophobicContact CG-CG2 3.94Å; L646-Y671 HydrophobicContact CD1-CD2 3.37Å; L646-Y671 HydrophobicContact CD1-CE2 3.4Å; L646-Y671 HydrophobicContact CD1-CG 4.1Å; L646-T724 CarbonylContact O-C 3.6Å; L646-F725 HydrophobicContact CB-CB 4.03Å; L646-F725 HydrophobicContact CD2-CB 4.06Å; L646-F725 HydrophobicContact CD2-CD1 3.72Å; L646-F725 HydrophobicContact CD2-CD2 4.09Å; L646-F725 HydrophobicContact CD2-CE1 4.15Å; L646-F725 HydrophobicContact CD2-CE2 4.48Å; L646-F725 HydrophobicContact CD2-CG 3.68Å; L646-F725 HydrophobicContact CG-CB 3.83Å; L646-F725 HydrophobicContact CG-CD1 4.39Å; L646-F725 HydrophobicContact CG-CD2 4.11Å; L646-F725 HydrophobicContact CG-CG 3.86Å; L646-F725 WeakPolarHBondContact O-CB 3.47Å; L646-F725 PolarHBondContact O-N 3.07Å; L646-Y726 HydrophobicContact CB-CE2 4.22Å; L646-Y726 HydrophobicContact CD2-CE2 3.78Å; L646-Y726 WeakPolarHBondContact CD2-OH 3.18Å
647	A	92.8	Very high	91.6	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.			trans	-145.5	154.6	177.6	0	0	0	0	0	112.5	S649 K650 V651 N722 T724	A647-S649 VanDerWaalsContact C-N 3.26Å; A647-S649 PolarHBondContact O-N 2.74Å; A647-K650 HydrophobicContact CB-CD 4.13Å; A647-K650 HydrophobicContact CB-CG 4.25Å; A647-K650 WeakPolarHBondContact O-CA 3.34Å; A647-K650 WeakPolarHBondContact O-CB 3.47Å; A647-K650 PolarHBondContact O-N 3.17Å; A647-V651 PolarHBondContact O-N 3.35Å; A647-N722 VanDerWaalsContact CB-O 3.25Å; A647-N722 WeakPolarHBondContact CB-O 3.35Å; A647-T724 VanDerWaalsContact CA-O 3.27Å; A647-T724 WeakPolarHBondContact CA-O 3.48Å
648	F	93.3	Very high	90.6	Very high	9 Å²	9	60.3 Å²	60.3	4%	0.039	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-52.1	-41.3	179.3	-71.1	-72.8	0	0	0	113	K650 V651 Y710 L711 V718 R721 T724 F725 L727	F648-K650 PolarHBondContact O-N 2.72Å; F648-V651 PolarHBondContact O-N 3.48Å; F648-Y710 HydrophobicContact CE1-CD1 4.14Å; F648-Y710 AromaticContact CE1-CE1 3.57Å; F648-Y710 HydrophobicContact CE1-CE1 3.57Å; F648-Y710 AromaticContact CZ-CE1 3.65Å; F648-Y710 HydrophobicContact CZ-CE1 3.65Å; F648-L711 HydrophobicContact CD1-CD2 3.69Å; F648-L711 HydrophobicContact CE1-CD2 3.72Å; F648-V718 HydrophobicContact CD2-CG2 4.39Å; F648-V718 WeakPolarHBondContact CD2-O 3.18Å; F648-V718 HydrophobicContact CE2-CB 4.12Å; F648-V718 HydrophobicContact CE2-CG2 3.8Å; F648-V718 HydrophobicContact CZ-CG2 4.04Å; F648-R721 HydrophobicContact CD2-CB 4.43Å; F648-R721 PolarHBondContact N-O 3.37Å; F648-T724 WeakPolarHBondContact CD2-O 3.43Å; F648-T724 PolarHBondContact N-O 2.99Å; F648-T724 VanDerWaalsContact N-O 3.15Å; F648-F725 HydrophobicContact CD1-CD2 4.26Å; F648-F725 HydrophobicContact CE1-CD2 4.5Å; F648-F725 VanDerWaalsContact CZ-O 3.29Å; F648-F725 WeakPolarHBondContact CZ-O 3.34Å; F648-L727 HydrophobicContact CE2-CD1 3.98Å; F648-L727 HydrophobicContact CE2-CD2 4.48Å; F648-L727 HydrophobicContact CE2-CG 4.18Å; F648-L727 HydrophobicContact CZ-CD1 3.93Å; F648-L727 HydrophobicContact CZ-CG 4.28Å
649	S	89.7	Confident	89.8	Confident	51 Å²	51	63.6 Å²	63.6	36%	0.357	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-68.3	-11.3	177.4	69.4	0	0	0	0	115.2	A647 R721 N722	A647-S649 VanDerWaalsContact C-N 3.26Å; A647-S649 PolarHBondContact O-N 2.74Å; S649-R721 PolarHBondContact N-O 3.25Å; S649-R721 PolarHBondContact OG-O 3.14Å; S649-N722 VanDerWaalsContact OG-CA 3.31Å; S649-N722 WeakPolarHBondContact OG-CA 3.4Å; S649-N722 WeakPolarHBondContact OG-CB 3.33Å
650	K	88.3	Confident	89.2	Confident	82 Å²	82	66 Å²	66	36%	0.357	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-100.9	-5.2	179.3	-54.7	175.8	-167.1	170.4	0	113	K645 A647 F648 Y671	K645-K650 PolarHBondContact O-NZ 2.91Å; A647-K650 HydrophobicContact CB-CD 4.13Å; A647-K650 HydrophobicContact CB-CG 4.25Å; A647-K650 WeakPolarHBondContact O-CA 3.34Å; A647-K650 WeakPolarHBondContact O-CB 3.47Å; A647-K650 PolarHBondContact O-N 3.17Å; F648-K650 PolarHBondContact O-N 2.72Å; K650-Y671 HydrophobicContact CB-CD2 4.32Å; K650-Y671 HydrophobicContact CB-CE2 4.4Å
651	V	90.5	Very high	88.3	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.03	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	94.3	-173.2	-177.8	0	0	0	0	109.4	F635 L646 A647 F648 I669 R670 Y707 F725	F635-V651 HydrophobicContact CE2-CG1 4.37Å; L646-V651 HydrophobicContact CD1-CG2 3.5Å; L646-V651 VanDerWaalsContact CD1-CG2 3.5Å; L646-V651 HydrophobicContact CD2-CG2 4.4Å; L646-V651 HydrophobicContact CG-CG2 3.94Å; A647-V651 PolarHBondContact O-N 3.35Å; F648-V651 PolarHBondContact O-N 3.48Å; V651-I669 HydrophobicContact CG1-CG2 3.29Å; V651-R670 WeakPolarHBondContact CA-O 3.42Å; V651-Y707 HydrophobicContact CG1-CE1 3.86Å; V651-Y707 HydrophobicContact CG1-CE2 4.32Å; V651-Y707 PolarHBondContact O-OH 3.05Å; V651-Y707 VanDerWaalsContact O-OH 3.08Å; V651-F725 HydrophobicContact CB-CD2 4.25Å; V651-F725 HydrophobicContact CB-CE2 3.9Å; V651-F725 HydrophobicContact CG1-CE2 3.83Å; V651-F725 HydrophobicContact CG2-CD2 3.83Å; V651-F725 HydrophobicContact CG2-CE2 3.79Å
652	L	87.6	Confident	87.4	Confident	94 Å²	94	69.2 Å²	69.2	49%	0.492	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	152.2	-159.4	-59.5	178.7	0	0	0	113.5	I669 R670	L652-I669 CarbonylContact O-C 3.56Å; L652-I669 WeakPolarHBondContact O-CA 3.35Å; L652-R670 PolarHBondContact N-O 3.49Å; L652-R670 PolarHBondContact O-N 3.45Å
653	R	90.6	Very high	86.6	Confident	121 Å²	121	74.8 Å²	74.8	46%	0.457	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.3	171.1	-179.8	-172.1	-58.5	-145.4	-7.2	110.1	T667 D708	R653-T667 HydrophobicContact CG-CG2 3.87Å; R653-D708 IonicContact CZ-OD1 3.5Å; R653-D708 IonicContact CZ-OD2 2.7Å; R653-D708 IonicContact NH1-OD1 3.61Å; R653-D708 IonicContact NH1-OD2 2.69Å; R653-D708 PolarHBondContact NH1-OD2 2.78Å; R653-D708 IonicContact NH2-OD1 3.49Å; R653-D708 PolarHBondContact NH2-OD1 3.4Å; R653-D708 IonicContact NH2-OD2 2.69Å; R653-D708 PolarHBondContact NH2-OD2 3.16Å
654	Q	88.7	Confident	85.8	Confident	80 Å²	80	78.2 Å²	78.2	37%	0.374	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	cis	129.3	17.2	-17.7	-76.2	168.7	-37.9	0	0	116.5	K656 S668 R670	Q654-K656 HydrophobicContact CG-CG 4.49Å; Q654-S668 WeakPolarHBondContact CA-O 3.44Å; Q654-S668 PolarHBondContact O-N 2.69Å; Q654-S668 PolarHBondContact O-OG 2.94Å; Q654-R670 HydrophobicContact CB-CG 4.27Å
655	T	88.3	Confident	85.2	Confident	69 Å²	69	81.8 Å²	81.8	42%	0.423	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.1	165.2	-53.2	0	0	0	0	111.6	K665 S666 T667	T655-K665 HydrophobicContact CG2-CB 4.04Å; T655-S666 CarbonylContact C-O 3.51Å; T655-S666 WeakPolarHBondContact CA-O 3.48Å; T655-T667 PolarHBondContact OG1-OG1 3.48Å
656	K	82.6	Confident	84.8	Confident	64 Å²	64	78.6 Å²	78.6	28%	0.278	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.5	166.7	-77.1	174.9	167.6	172.8	0	109.4	Q654 K665 S666 R670 D686 E691	Q654-K656 HydrophobicContact CG-CG 4.49Å; K656-K665 CarbonylContact O-C 3.46Å; K656-K665 WeakPolarHBondContact O-CA 3.44Å; K656-S666 PolarHBondContact N-O 3.42Å; K656-S666 PolarHBondContact O-N 3.13Å; K656-R670 VanDerWaalsContact CE-NH2 3.32Å; K656-D686 WeakPolarHBondContact CE-OD2 3.35Å; K656-D686 IonicContact NZ-OD1 3.72Å; K656-D686 IonicContact NZ-OD2 2.67Å; K656-D686 PolarHBondContact NZ-OD2 2.9Å; K656-E691 IonicContact NZ-OE1 3.87Å; K656-E691 PolarHBondContact NZ-OE1 3.43Å
657	K	82.3	Confident	84.6	Confident	150 Å²	150	79.4 Å²	79.4	65%	0.652	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.1	166.5	-63.9	179.9	-175.7	174.8	0	108.8	P659	K657-P659 WeakPolarHBondContact O-CD 3.21Å
658	N	74.2	Confident	84.6	Confident	54 Å²	54	79.4 Å²	79.4	29%	0.289	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	122.6	175.8	-176.2	-22.7	0	0	0	110	S660 N661 D664	N658-S660 PolarHBondContact O-N 3.28Å; N658-S660 WeakPolarHBondContact OD1-CB 3.39Å; N658-S660 PolarHBondContact OD1-N 3.35Å; N658-N661 CarbonylContact O-C 3.18Å; N658-N661 PolarHBondContact O-N 3.29Å; N658-D664 HydrophobicContact CB-CB 3.87Å; N658-D664 VanDerWaalsContact CB-OD2 3.29Å; N658-D664 WeakPolarHBondContact CB-OD2 3.48Å; N658-D664 PolarHBondContact N-O 2.83Å; N658-D664 PolarHBondContact ND2-OD2 3.32Å
659	P	77.4	Confident	84.6	Confident	127 Å²	127	79 Å²	79	83%	0.825	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-33.4	179.4	-24.7	34.9	0	0	0	113.5	K657	K657-P659 WeakPolarHBondContact O-CD 3.21Å
660	S	81.2	Confident	84.7	Confident	116 Å²	116	76.8 Å²	76.8	81%	0.811	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-18.7	-179.1	-54.5	0	0	0	0	113.2	N658	N658-S660 PolarHBondContact O-N 3.28Å; N658-S660 WeakPolarHBondContact OD1-CB 3.39Å; N658-S660 PolarHBondContact OD1-N 3.35Å
661	N	78.5	Confident	84.7	Confident	75 Å²	75	73.3 Å²	73.3	40%	0.401	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	94.1	178.6	179.9	4.5	0	0	0	110.9	N658 K663 D664	N658-N661 CarbonylContact O-C 3.18Å; N658-N661 PolarHBondContact O-N 3.29Å; N661-K663 PolarHBondContact O-N 3.2Å; N661-K663 WeakPolarHBondContact OD1-CB 3.41Å; N661-K663 PolarHBondContact OD1-N 3.08Å; N661-D664 HydrophobicContact CB-CB 4.11Å; N661-D664 WeakPolarHBondContact O-CB 3.45Å; N661-D664 PolarHBondContact O-N 2.86Å
662	P	78.3	Confident	84.3	Confident	98 Å²	98	74.8 Å²	74.8	64%	0.636	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	-8.7	-177.2	-26.6	36	0	0	0	116.4
663	K	76.9	Confident	83.6	Confident	191 Å²	191	75.1 Å²	75.1	83%	0.83	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	-28.1	171	-63.8	-177	178.2	-179.7	0	112.3	N661	N661-K663 PolarHBondContact O-N 3.2Å; N661-K663 WeakPolarHBondContact OD1-CB 3.41Å; N661-K663 PolarHBondContact OD1-N 3.08Å
664	D	78.8	Confident	82.2	Confident	72 Å²	72	72.2 Å²	72.2	39%	0.385	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	130.6	176.6	174.7	28.1	0	0	0	110.4	N658 N661	N658-D664 HydrophobicContact CB-CB 3.87Å; N658-D664 VanDerWaalsContact CB-OD2 3.29Å; N658-D664 WeakPolarHBondContact CB-OD2 3.48Å; N658-D664 PolarHBondContact N-O 2.83Å; N658-D664 PolarHBondContact ND2-OD2 3.32Å; N661-D664 HydrophobicContact CB-CB 4.11Å; N661-D664 WeakPolarHBondContact O-CB 3.45Å; N661-D664 PolarHBondContact O-N 2.86Å
665	K	82.6	Confident	80.6	Confident	133 Å²	133	73.4 Å²	73.4	58%	0.578	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	107	-172.3	-64.8	178.1	-170.3	169.8	0	108.3	T655 K656	T655-K665 HydrophobicContact CG2-CB 4.04Å; K656-K665 CarbonylContact O-C 3.46Å; K656-K665 WeakPolarHBondContact O-CA 3.44Å
666	S	83.8	Confident	78.6	Confident	59 Å²	59	73.7 Å²	73.7	41%	0.413	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.3	169.1	-177.7	0	0	0	0	108.9	T655 K656	T655-S666 CarbonylContact C-O 3.51Å; T655-S666 WeakPolarHBondContact CA-O 3.48Å; K656-S666 PolarHBondContact N-O 3.42Å; K656-S666 PolarHBondContact O-N 3.13Å
667	T	90.4	Very high	76.9	Confident	18 Å²	18	77.8 Å²	77.8	11%	0.11	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.1	167.6	-51.7	0	0	0	0	109.1	R653 T655 E694 I704	R653-T667 HydrophobicContact CG-CG2 3.87Å; T655-T667 PolarHBondContact OG1-OG1 3.48Å; T667-E694 PolarHBondContact O-N 2.97Å; T667-I704 HydrophobicContact CG2-CD1 3.87Å; T667-I704 HydrophobicContact CG2-CG2 4.47Å; T667-I704 WeakPolarHBondContact O-CD1 3.4Å
668	S	92.3	Very high	75.4	Confident	0 Å²	0	74 Å²	74	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	161.7	171.2	63.7	0	0	0	0	111.6	Q654 R670 E691 Q692	Q654-S668 WeakPolarHBondContact CA-O 3.44Å; Q654-S668 PolarHBondContact O-N 2.69Å; Q654-S668 PolarHBondContact O-OG 2.94Å; S668-R670 PolarHBondContact OG-NH2 2.93Å; S668-R670 VanDerWaalsContact OG-NH2 3.14Å; S668-E691 WeakPolarHBondContact CB-OE2 3.39Å; S668-E691 PolarHBondContact OG-OE2 3.44Å; S668-Q692 CarbonylContact C-O 3.58Å; S668-Q692 WeakPolarHBondContact CA-O 3.42Å; S668-Q692 VanDerWaalsContact CB-O 3.3Å; S668-Q692 WeakPolarHBondContact CB-O 3.43Å
669	I	93.5	Very high	74.2	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.005	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.8	158.3	-55.1	160.2	0	0	0	107.2	F635 V651 L652 E691 Q692 I704 Y707	F635-I669 HydrophobicContact CZ-CG2 4.08Å; V651-I669 HydrophobicContact CG1-CG2 3.29Å; L652-I669 CarbonylContact O-C 3.56Å; L652-I669 WeakPolarHBondContact O-CA 3.35Å; I669-E691 CarbonylContact O-C 3.46Å; I669-E691 WeakPolarHBondContact O-CA 3.37Å; I669-Q692 HydrophobicContact CB-CB 4.29Å; I669-Q692 PolarHBondContact N-O 2.96Å; I669-Q692 PolarHBondContact O-N 2.82Å; I669-I704 HydrophobicContact CD1-CG1 4.24Å; I669-I704 HydrophobicContact CG1-CG1 4.15Å; I669-Y707 HydrophobicContact CD1-CD1 3.49Å; I669-Y707 VanDerWaalsContact CD1-CD1 3.49Å; I669-Y707 HydrophobicContact CD1-CE1 4.44Å; I669-Y707 HydrophobicContact CD1-CG 3.84Å; I669-Y707 HydrophobicContact CG1-CD1 3.93Å; I669-Y707 HydrophobicContact CG2-CD1 4.33Å; I669-Y707 HydrophobicContact CG2-CE1 4.26Å
670	R	91.1	Very high	72.7	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.015	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.5	172.5	-61.6	-168.8	-166.1	-66.7	-61.6	111.7	V651 L652 Q654 K656 S668 D686 Y689 A690 E691	V651-R670 WeakPolarHBondContact CA-O 3.42Å; L652-R670 PolarHBondContact N-O 3.49Å; L652-R670 PolarHBondContact O-N 3.45Å; Q654-R670 HydrophobicContact CB-CG 4.27Å; K656-R670 VanDerWaalsContact CE-NH2 3.32Å; S668-R670 PolarHBondContact OG-NH2 2.93Å; S668-R670 VanDerWaalsContact OG-NH2 3.14Å; R670-D686 IonicContact CZ-OD1 2.75Å; R670-D686 IonicContact NH1-OD1 3.51Å; R670-D686 PolarHBondContact NH1-OD1 3.07Å; R670-D686 IonicContact NH1-OD2 2.69Å; R670-Y689 HydrophobicContact CB-CD1 3.8Å; R670-Y689 HydrophobicContact CB-CE1 4.48Å; R670-Y689 HydrophobicContact CB-CG 4.37Å; R670-Y689 HydrophobicContact CG-CD1 4.37Å; R670-A690 WeakPolarHBondContact CA-O 3.1Å; R670-E691 HydrophobicContact CG-CG 4.4Å; R670-E691 VanDerWaalsContact CZ-CD 3.49Å; R670-E691 IonicContact CZ-OE1 3.11Å; R670-E691 VanDerWaalsContact CZ-OE1 3.3Å; R670-E691 IonicContact CZ-OE2 2.71Å; R670-E691 IonicContact NH1-OE1 2.76Å; R670-E691 PolarHBondContact NH1-OE1 2.83Å; R670-E691 IonicContact NH1-OE2 3.3Å; R670-E691 IonicContact NH2-OE1 2.69Å; R670-E691 PolarHBondContact NH2-OE1 3.23Å; R670-E691 VanDerWaalsContact NH2-OE1 3.11Å; R670-E691 IonicContact NH2-OE2 3.67Å; R670-E691 PolarHBondContact NH2-OE2 2.87Å
671	Y	88.2	Confident	71.4	Confident	9 Å²	9	78.8 Å²	78.8	4%	0.035	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.2	157.4	167.4	-110.1	0	0	0	109.3	F635 L637 L646 K650 K673 A674 Y689 A690	F635-Y671 HydrophobicContact CB-CD1 3.87Å; F635-Y671 HydrophobicContact CB-CG 4.46Å; F635-Y671 VanDerWaalsContact CD2-CB 3.42Å; F635-Y671 HydrophobicContact CD2-CD1 4.19Å; F635-Y671 AromaticContact CD2-CG 3.94Å; F635-Y671 HydrophobicContact CD2-CG 3.94Å; F635-Y671 VanDerWaalsContact CE2-CB 3.42Å; F635-Y671 HydrophobicContact CE2-CG 4.33Å; F635-Y671 HydrophobicContact CG-CD1 4.04Å; F635-Y671 HydrophobicContact CG-CG 4.17Å; L637-Y671 HydrophobicContact CD2-CD1 4.42Å; L637-Y671 HydrophobicContact CD2-CE1 3.65Å; L646-Y671 HydrophobicContact CD1-CD2 3.37Å; L646-Y671 HydrophobicContact CD1-CE2 3.4Å; L646-Y671 HydrophobicContact CD1-CG 4.1Å; K650-Y671 HydrophobicContact CB-CD2 4.32Å; K650-Y671 HydrophobicContact CB-CE2 4.4Å; Y671-K673 PolarHBondContact O-N 2.9Å; Y671-A674 WeakPolarHBondContact OH-CB 3.45Å; Y671-Y689 CarbonylContact O-C 3.52Å; Y671-Y689 WeakPolarHBondContact O-CA 3.14Å; Y671-A690 PolarHBondContact N-O 3.19Å; Y671-A690 PolarHBondContact O-N 3.22Å
672	L	82.1	Confident	70.7	Confident	36 Å²	36	80.5 Å²	80.5	19%	0.188	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.3	172.6	-178.4	56.3	0	0	0	108.9	A674 L675 V684 M688 Y689	L672-A674 PolarHBondContact O-N 2.9Å; L672-L675 HydrophobicContact CD2-CD1 3.81Å; L672-L675 HydrophobicContact CG-CD1 4.26Å; L672-V684 HydrophobicContact CD1-CG1 3.67Å; L672-V684 HydrophobicContact CD2-CG1 4.4Å; L672-V684 HydrophobicContact CD2-CG2 4.42Å; L672-M688 HydrophobicContact CD1-CB 3.89Å; L672-M688 HydrophobicContact CD1-CE 4.25Å; L672-Y689 HydrophobicContact CB-CD1 3.99Å; L672-Y689 HydrophobicContact CB-CE1 3.74Å; L672-Y689 HydrophobicContact CD1-CD1 4.2Å; L672-Y689 HydrophobicContact CD1-CE1 4.02Å; L672-Y689 HydrophobicContact CD1-CE2 4.42Å; L672-Y689 HydrophobicContact CD1-CG 4.5Å; L672-Y689 HydrophobicContact CG-CE1 4.36Å
673	K	74.8	Confident	70	Confident	100 Å²	100	84.6 Å²	84.6	44%	0.435	46%	0.464	S	S	.	.			trans	-59.8	108.4	178.8	-62.3	164.8	-170.8	153.2	0	108.3	Y671 L675 D687 M688 Y689 A690	Y671-K673 PolarHBondContact O-N 2.9Å; K673-L675 PolarHBondContact O-N 3.31Å; K673-D687 PolarHBondContact NZ-O 2.89Å; K673-M688 WeakPolarHBondContact CB-O 3.41Å; K673-M688 WeakPolarHBondContact CD-O 3.38Å; K673-M688 VanDerWaalsContact CG-O 3.3Å; K673-M688 WeakPolarHBondContact CG-O 3.38Å; K673-M688 PolarHBondContact N-O 2.85Å; K673-M688 VanDerWaalsContact N-O 3.08Å; K673-Y689 VanDerWaalsContact CE-O 3.24Å; K673-Y689 WeakPolarHBondContact CE-O 3.45Å; K673-Y689 PolarHBondContact NZ-O 3.32Å; K673-A690 HydrophobicContact CG-CB 4.28Å
674	A	60.2	Low	69.8	Low	60 Å²	60	78.8 Å²	78.8	50%	0.496	45%	0.445	S	S	.	.			trans	-74.6	92.1	-156.7	0	0	0	0	0	114.9	Y671 L672	Y671-A674 WeakPolarHBondContact OH-CB 3.45Å; L672-A674 PolarHBondContact O-N 2.9Å
675	L	56	Low	69.7	Low	105 Å²	105	78.6 Å²	78.6	55%	0.55	45%	0.446	S	S	.	.			trans	42.4	85.5	133	-70.6	122.7	0	0	0	117	L672 K673 H678	L672-L675 HydrophobicContact CD2-CD1 3.81Å; L672-L675 HydrophobicContact CG-CD1 4.26Å; K673-L675 PolarHBondContact O-N 3.31Å; L675-H678 HydrophobicContact CD2-CB 4.05Å
676	G	44.7	Very low	69.3	Low	76 Å²	76	76.1 Å²	76.1	78%	0.784	44%	0.439	S	S	*	.	S	Bend	trans	-105.3	-32	163.1	0	0	0	0	0	114.8
677	I	48.1	Very low	69	Low	150 Å²	150	78.6 Å²	78.6	77%	0.769	45%	0.448	S	S	*	.	S	Bend	trans	-142.5	28	-169	-27.9	177.9	0	0	0	113.6	Q679	I677-Q679 PolarHBondContact O-N 3.39Å
678	H	49.5	Very low	68.5	Low	69 Å²	69	78.7 Å²	78.7	32%	0.319	45%	0.447	S	S	.	.			trans	-81.1	103.2	169.2	-60.6	-59	0	0	0	109.3	L675 Q682 M688	L675-H678 HydrophobicContact CD2-CB 4.05Å; H678-Q682 HydrophobicContact CB-CB 4.5Å; H678-Q682 PolarHBondContact ND1-OE1 2.98Å; H678-M688 WeakPolarHBondContact CE1-CE 3.38Å; H678-M688 WeakPolarHBondContact NE2-CE 3.3Å
679	Q	49.5	Very low	68.2	Low	164 Å²	164	81.8 Å²	81.8	77%	0.766	46%	0.459	S	S	*	.			trans	-57.1	138.4	170.4	-59.5	-175.4	35.3	0	0	109.2	I677 G681 Q682	I677-Q679 PolarHBondContact O-N 3.39Å; Q679-G681 PolarHBondContact O-N 3.04Å; Q679-Q682 PolarHBondContact O-N 3.46Å
680	T	46.4	Very low	68	Low	160 Å²	160	82.1 Å²	82.1	98%	0.982	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	102.2	-172.2	-41.6	0	0	0	0	111.1
681	G	54.9	Low	68	Low	74 Å²	74	84.8 Å²	84.8	76%	0.763	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.9	-11.6	-175.4	0	0	0	0	0	115.4	Q679 K683	Q679-G681 PolarHBondContact O-N 3.04Å; G681-K683 PolarHBondContact O-N 3.34Å
682	Q	63	Low	68.3	Low	112 Å²	112	84.5 Å²	84.5	52%	0.523	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-64.8	124.9	172.9	-169.5	174.1	9	0	0	110.7	H678 Q679 V684	H678-Q682 HydrophobicContact CB-CB 4.5Å; H678-Q682 PolarHBondContact ND1-OE1 2.98Å; Q679-Q682 PolarHBondContact O-N 3.46Å; Q682-V684 PolarHBondContact O-N 2.92Å
683	K	64.4	Low	68.7	Low	184 Å²	184	86.4 Å²	86.4	80%	0.8	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-67.4	131.1	175.1	-66.7	-175.7	179.8	-178.9	0	109.7	G681 T685	G681-K683 PolarHBondContact O-N 3.34Å; K683-T685 PolarHBondContact O-N 3.06Å
684	V	70.9	Confident	69.5	Low	69 Å²	69	84.5 Å²	84.5	42%	0.418	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-69.4	121.4	172.8	179.4	0	0	0	0	109.2	L672 Q682 M688 Y689	L672-V684 HydrophobicContact CD1-CG1 3.67Å; L672-V684 HydrophobicContact CD2-CG1 4.4Å; L672-V684 HydrophobicContact CD2-CG2 4.42Å; Q682-V684 PolarHBondContact O-N 2.92Å; V684-M688 HydrophobicContact CB-CE 4.41Å; V684-M688 HydrophobicContact CB-SD 4.42Å; V684-M688 HydrophobicContact CG1-CB 4.3Å; V684-M688 HydrophobicContact CG1-CE 4.09Å; V684-M688 HydrophobicContact CG1-SD 4.17Å; V684-M688 HydrophobicContact CG2-CE 4.2Å; V684-Y689 HydrophobicContact CG1-CD2 4.48Å; V684-Y689 HydrophobicContact CG1-CE2 3.61Å
685	T	76.9	Confident	71	Confident	67 Å²	67	84.1 Å²	84.1	41%	0.411	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-100.6	163.2	177.5	51.8	0	0	0	0	111.3	K683 D687 M688	K683-T685 PolarHBondContact O-N 3.06Å; T685-D687 VanDerWaalsContact C-N 3.31Å; T685-D687 WeakPolarHBondContact CB-OD1 3.44Å; T685-D687 PolarHBondContact O-N 3Å; T685-D687 PolarHBondContact OG1-OD1 3.18Å; T685-M688 PolarHBondContact N-SD 3.24Å; T685-M688 VanDerWaalsContact N-SD 3.44Å; T685-M688 WeakPolarHBondContact O-CB 3.46Å; T685-M688 PolarHBondContact O-N 2.96Å
686	D	75	Confident	72.5	Confident	81 Å²	81	84 Å²	84	43%	0.433	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-68.8	-28.6	-167.9	-162	43.8	0	0	0	113	K656 R670 M688 Y689	K656-D686 WeakPolarHBondContact CE-OD2 3.35Å; K656-D686 IonicContact NZ-OD1 3.72Å; K656-D686 IonicContact NZ-OD2 2.67Å; K656-D686 PolarHBondContact NZ-OD2 2.9Å; R670-D686 IonicContact CZ-OD1 2.75Å; R670-D686 IonicContact NH1-OD1 3.51Å; R670-D686 PolarHBondContact NH1-OD1 3.07Å; R670-D686 IonicContact NH1-OD2 2.69Å; D686-M688 VanDerWaalsContact C-N 3.28Å; D686-M688 PolarHBondContact O-N 3.08Å; D686-Y689 PolarHBondContact O-N 3.42Å
687	D	76.3	Confident	74.8	Confident	112 Å²	112	89.2 Å²	89.2	60%	0.599	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-65.7	-24.1	174.2	58.2	-68.6	0	0	0	114.1	K673 T685 Y689	K673-D687 PolarHBondContact NZ-O 2.89Å; T685-D687 VanDerWaalsContact C-N 3.31Å; T685-D687 WeakPolarHBondContact CB-OD1 3.44Å; T685-D687 PolarHBondContact O-N 3Å; T685-D687 PolarHBondContact OG1-OD1 3.18Å; D687-Y689 PolarHBondContact O-N 3.26Å
688	M	81.9	Confident	76.9	Confident	20 Å²	20	84.7 Å²	84.7	10%	0.099	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-70.5	-15.7	175.6	-62.2	176.9	50.5	0	0	112.5	L672 K673 H678 V684 T685 D686	L672-M688 HydrophobicContact CD1-CB 3.89Å; L672-M688 HydrophobicContact CD1-CE 4.25Å; K673-M688 WeakPolarHBondContact CB-O 3.41Å; K673-M688 WeakPolarHBondContact CD-O 3.38Å; K673-M688 VanDerWaalsContact CG-O 3.3Å; K673-M688 WeakPolarHBondContact CG-O 3.38Å; K673-M688 PolarHBondContact N-O 2.85Å; K673-M688 VanDerWaalsContact N-O 3.08Å; H678-M688 WeakPolarHBondContact CE1-CE 3.38Å; H678-M688 WeakPolarHBondContact NE2-CE 3.3Å; V684-M688 HydrophobicContact CB-CE 4.41Å; V684-M688 HydrophobicContact CB-SD 4.42Å; V684-M688 HydrophobicContact CG1-CB 4.3Å; V684-M688 HydrophobicContact CG1-CE 4.09Å; V684-M688 HydrophobicContact CG1-SD 4.17Å; V684-M688 HydrophobicContact CG2-CE 4.2Å; T685-M688 PolarHBondContact N-SD 3.24Å; T685-M688 VanDerWaalsContact N-SD 3.44Å; T685-M688 WeakPolarHBondContact O-CB 3.46Å; T685-M688 PolarHBondContact O-N 2.96Å; D686-M688 VanDerWaalsContact C-N 3.28Å; D686-M688 PolarHBondContact O-N 3.08Å
689	Y	85.4	Confident	78.9	Confident	64 Å²	64	84.9 Å²	84.9	25%	0.251	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	150.3	172.7	-65.9	-85	0	0	0	111.6	R670 Y671 L672 K673 V684 D686 D687	R670-Y689 HydrophobicContact CB-CD1 3.8Å; R670-Y689 HydrophobicContact CB-CE1 4.48Å; R670-Y689 HydrophobicContact CB-CG 4.37Å; R670-Y689 HydrophobicContact CG-CD1 4.37Å; Y671-Y689 CarbonylContact O-C 3.52Å; Y671-Y689 WeakPolarHBondContact O-CA 3.14Å; L672-Y689 HydrophobicContact CB-CD1 3.99Å; L672-Y689 HydrophobicContact CB-CE1 3.74Å; L672-Y689 HydrophobicContact CD1-CD1 4.2Å; L672-Y689 HydrophobicContact CD1-CE1 4.02Å; L672-Y689 HydrophobicContact CD1-CE2 4.42Å; L672-Y689 HydrophobicContact CD1-CG 4.5Å; L672-Y689 HydrophobicContact CG-CE1 4.36Å; K673-Y689 VanDerWaalsContact CE-O 3.24Å; K673-Y689 WeakPolarHBondContact CE-O 3.45Å; K673-Y689 PolarHBondContact NZ-O 3.32Å; V684-Y689 HydrophobicContact CG1-CD2 4.48Å; V684-Y689 HydrophobicContact CG1-CE2 3.61Å; D686-Y689 PolarHBondContact O-N 3.42Å; D687-Y689 PolarHBondContact O-N 3.26Å
690	A	88.6	Confident	81	Confident	8 Å²	8	84 Å²	84	7%	0.066	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	138.9	157.3	0	0	0	0	0	108.3	F635 R670 Y671 K673	F635-A690 HydrophobicContact CB-CB 4.29Å; F635-A690 HydrophobicContact CD1-CB 3.53Å; F635-A690 HydrophobicContact CE1-CB 4.29Å; F635-A690 WeakPolarHBondContact CE1-O 3.4Å; F635-A690 HydrophobicContact CG-CB 4.27Å; R670-A690 WeakPolarHBondContact CA-O 3.1Å; Y671-A690 PolarHBondContact N-O 3.19Å; Y671-A690 PolarHBondContact O-N 3.22Å; K673-A690 HydrophobicContact CG-CB 4.28Å
691	E	91.2	Very high	83.4	Confident	61 Å²	61	79.5 Å²	79.5	29%	0.285	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.9	-178.6	-58.1	-155.1	-147.5	0	0	111.2	K656 S668 I669 R670	K656-E691 IonicContact NZ-OE1 3.87Å; K656-E691 PolarHBondContact NZ-OE1 3.43Å; S668-E691 WeakPolarHBondContact CB-OE2 3.39Å; S668-E691 PolarHBondContact OG-OE2 3.44Å; I669-E691 CarbonylContact O-C 3.46Å; I669-E691 WeakPolarHBondContact O-CA 3.37Å; R670-E691 HydrophobicContact CG-CG 4.4Å; R670-E691 VanDerWaalsContact CZ-CD 3.49Å; R670-E691 IonicContact CZ-OE1 3.11Å; R670-E691 VanDerWaalsContact CZ-OE1 3.3Å; R670-E691 IonicContact CZ-OE2 2.71Å; R670-E691 IonicContact NH1-OE1 2.76Å; R670-E691 PolarHBondContact NH1-OE1 2.83Å; R670-E691 IonicContact NH1-OE2 3.3Å; R670-E691 IonicContact NH2-OE1 2.69Å; R670-E691 PolarHBondContact NH2-OE1 3.23Å; R670-E691 VanDerWaalsContact NH2-OE1 3.11Å; R670-E691 IonicContact NH2-OE2 3.67Å; R670-E691 PolarHBondContact NH2-OE2 2.87Å
692	Q	93.9	Very high	85.4	Confident	2 Å²	2	76 Å²	76	1%	0.009	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.1	161.9	-73.3	169.5	18.9	0	0	107.8	F630 N631 Y634 F635 S668 I669 P703	F630-Q692 PolarHBondContact O-NE2 3Å; N631-Q692 PolarHBondContact OD1-NE2 3.13Å; Y634-Q692 VanDerWaalsContact CB-CG 3.48Å; Y634-Q692 HydrophobicContact CD2-CG 3.78Å; Y634-Q692 HydrophobicContact CG-CG 3.79Å; F635-Q692 HydrophobicContact CD1-CG 4.2Å; F635-Q692 HydrophobicContact CE1-CB 4.34Å; F635-Q692 HydrophobicContact CE1-CG 3.62Å; F635-Q692 VanDerWaalsContact CE2-NE2 3.29Å; F635-Q692 HydrophobicContact CZ-CG 3.92Å; F635-Q692 VanDerWaalsContact CZ-NE2 3.28Å; S668-Q692 CarbonylContact C-O 3.58Å; S668-Q692 WeakPolarHBondContact CA-O 3.42Å; S668-Q692 VanDerWaalsContact CB-O 3.3Å; S668-Q692 WeakPolarHBondContact CB-O 3.43Å; I669-Q692 HydrophobicContact CB-CB 4.29Å; I669-Q692 PolarHBondContact N-O 2.96Å; I669-Q692 PolarHBondContact O-N 2.82Å; Q692-P703 HydrophobicContact CB-CB 4.15Å
693	T	91.7	Very high	86.9	Confident	77 Å²	77	71 Å²	71	47%	0.472	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	158.4	-177.9	49.8	0	0	0	0	112.7
694	E	92.1	Very high	88.4	Confident	59 Å²	59	62.2 Å²	62.2	28%	0.276	33%	0.331	S	S	.	.			trans	-63.3	134.2	168.3	-162.4	153.2	-156.7	0	0	110.3	T667 P696 I704 K705	T667-E694 PolarHBondContact O-N 2.97Å; E694-P696 VanDerWaalsContact O-CD 3.3Å; E694-P696 WeakPolarHBondContact O-CD 3.12Å; E694-I704 HydrophobicContact CB-CD1 3.75Å; E694-I704 HydrophobicContact CB-CG1 4.33Å; E694-I704 HydrophobicContact CG-CD1 4.38Å; E694-K705 VanDerWaalsContact OE1-CE 3.31Å; E694-K705 WeakPolarHBondContact OE1-CE 3.34Å; E694-K705 IonicContact OE1-NZ 2.81Å; E694-K705 PolarHBondContact OE1-NZ 3.21Å
695	N	91.1	Very high	89.6	Confident	52 Å²	52	62.6 Å²	62.6	28%	0.278	33%	0.327	S	S	.	.			trans	-98.6	100.6	163.1	-176.7	-19.8	0	0	0	107.7	E697 N698 C702	N695-E697 PolarHBondContact OD1-N 3.32Å; N695-E697 VanDerWaalsContact OD1-N 3.07Å; N695-N698 PolarHBondContact OD1-N 3.11Å; N695-C702 HydrophobicContact CB-CB 4Å; N695-C702 PolarHBondContact N-SG 2.82Å; N695-C702 WeakPolarHBondContact O-CB 3.47Å
696	P	87.6	Confident	90.6	Very high	103 Å²	103	59.8 Å²	59.8	67%	0.669	31%	0.309	S	S	*	.	S	Bend	trans	-78.7	-21.6	178.7	32.3	-35.3	0	0	0	112.8	E694	E694-P696 VanDerWaalsContact O-CD 3.3Å; E694-P696 WeakPolarHBondContact O-CD 3.12Å
697	E	92.1	Very high	91.6	Very high	185 Å²	185	56.6 Å²	56.6	86%	0.864	29%	0.292	S	S	*	.	S	Bend	trans	-76.3	-37.7	-176.4	-56.6	-177.2	163	0	0	111.6	N695	N695-E697 PolarHBondContact OD1-N 3.32Å; N695-E697 VanDerWaalsContact OD1-N 3.07Å
698	N	92	Very high	92.5	Very high	56 Å²	56	54.1 Å²	54.1	30%	0.299	28%	0.278	S	S	.	.			trans	-128.8	87.9	175.9	-168.6	-24.8	0	0	0	111.7	N695 L700 R701 C702	N695-N698 PolarHBondContact OD1-N 3.11Å; N698-L700 PolarHBondContact O-N 3.41Å; N698-L700 PolarHBondContact OD1-N 3.37Å; N698-L700 VanDerWaalsContact OD1-N 3.17Å; N698-R701 HydrophobicContact CB-CB 4.42Å; N698-R701 CarbonylContact O-C 3.58Å; N698-R701 PolarHBondContact O-N 3.47Å; N698-R701 VanDerWaalsContact O-N 3.11Å; N698-R701 PolarHBondContact OD1-N 2.91Å; N698-C702 PolarHBondContact O-N 3.2Å; N698-C702 VanDerWaalsContact O-N 3.14Å
699	P	92.9	Very high	93.1	Very high	73 Å²	73	56.5 Å²	56.5	47%	0.474	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-58.2	-27	177.5	-27.4	36.2	0	0	0	114.8	R701 C702	P699-R701 VanDerWaalsContact C-N 3.33Å; P699-C702 WeakPolarHBondContact O-CB 3.36Å; P699-C702 PolarHBondContact O-N 3.35Å
700	L	93.4	Very high	93.7	Very high	144 Å²	144	53.5 Å²	53.5	75%	0.754	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-76.6	-19.8	179.6	-63.6	177.2	0	0	0	113.2	N698	N698-L700 PolarHBondContact O-N 3.41Å; N698-L700 PolarHBondContact OD1-N 3.37Å; N698-L700 VanDerWaalsContact OD1-N 3.17Å
701	R	96.1	Very high	94	Very high	67 Å²	67	54.8 Å²	54.8	25%	0.253	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-107.7	7.8	172.4	-58.7	-169.5	-177.7	176.7	2.7	113	E607 W610 F630 N698 P699 P703	E607-R701 VanDerWaalsContact CD-NH1 3.35Å; E607-R701 IonicContact OE1-CZ 3.65Å; E607-R701 IonicContact OE1-NH1 3.21Å; E607-R701 PolarHBondContact OE1-NH1 3.21Å; E607-R701 IonicContact OE1-NH2 3.42Å; E607-R701 PolarHBondContact OE1-NH2 2.76Å; E607-R701 IonicContact OE2-CZ 3.61Å; E607-R701 IonicContact OE2-NH1 3.69Å; E607-R701 PolarHBondContact OE2-NH1 2.73Å; E607-R701 IonicContact OE2-NH2 2.8Å; W610-R701 HydrophobicContact CD2-CG 3.88Å; W610-R701 HydrophobicContact CE3-CG 3.8Å; W610-R701 VanDerWaalsContact CG-CZ 3.48Å; W610-R701 HydrophobicContact CH2-CB 3.87Å; W610-R701 HydrophobicContact CH2-CG 3.8Å; W610-R701 HydrophobicContact CZ2-CB 3.87Å; W610-R701 HydrophobicContact CZ2-CG 3.87Å; W610-R701 HydrophobicContact CZ3-CB 4.29Å; W610-R701 HydrophobicContact CZ3-CG 3.73Å; F630-R701 WeakPolarHBondContact CZ-O 3.43Å; N698-R701 HydrophobicContact CB-CB 4.42Å; N698-R701 CarbonylContact O-C 3.58Å; N698-R701 PolarHBondContact O-N 3.47Å; N698-R701 VanDerWaalsContact O-N 3.11Å; N698-R701 PolarHBondContact OD1-N 2.91Å; P699-R701 VanDerWaalsContact C-N 3.33Å; R701-P703 WeakPolarHBondContact O-CD 2.9Å
702	C	96.2	Very high	94.1	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.295	C	S	.	.			trans	-78.1	119.7	-175.2	178.8	0	0	0	0	111.7	N695 N698 P699 I704 K705 L706	N695-C702 HydrophobicContact CB-CB 4Å; N695-C702 PolarHBondContact N-SG 2.82Å; N695-C702 WeakPolarHBondContact O-CB 3.47Å; N698-C702 PolarHBondContact O-N 3.2Å; N698-C702 VanDerWaalsContact O-N 3.14Å; P699-C702 WeakPolarHBondContact O-CB 3.36Å; P699-C702 PolarHBondContact O-N 3.35Å; C702-I704 PolarHBondContact O-N 3.4Å; C702-I704 VanDerWaalsContact O-N 3.1Å; C702-K705 HydrophobicContact CB-CB 4.17Å; C702-K705 HydrophobicContact CB-CG 3.88Å; C702-K705 PolarHBondContact O-N 2.92Å; C702-K705 VanDerWaalsContact O-N 3.16Å; C702-L706 WeakPolarHBondContact O-CB 3.34Å; C702-L706 WeakPolarHBondContact O-CG 3.26Å; C702-L706 PolarHBondContact O-N 3.02Å
703	P	96.3	Very high	94.2	Very high	6 Å²	6	58.2 Å²	58.2	4%	0.039	30%	0.296	C	S	.	.	H	α-helix	trans	-54.4	-35.5	180	-26.3	34.5	0	0	0	113.2	F630 Y634 Q692 R701 Y707	F630-P703 HydrophobicContact CD1-CG 4.14Å; F630-P703 HydrophobicContact CD2-CB 3.73Å; F630-P703 HydrophobicContact CD2-CG 3.97Å; F630-P703 HydrophobicContact CE1-CG 4.08Å; F630-P703 HydrophobicContact CE2-CB 3.92Å; F630-P703 HydrophobicContact CE2-CG 3.91Å; F630-P703 HydrophobicContact CG-CB 4.16Å; F630-P703 HydrophobicContact CG-CG 4.09Å; F630-P703 HydrophobicContact CZ-CB 4.48Å; F630-P703 HydrophobicContact CZ-CG 3.97Å; Y634-P703 HydrophobicContact CE2-CG 4.38Å; Q692-P703 HydrophobicContact CB-CB 4.15Å; R701-P703 WeakPolarHBondContact O-CD 2.9Å; P703-Y707 VanDerWaalsContact O-CB 3.3Å; P703-Y707 WeakPolarHBondContact O-CB 3.39Å; P703-Y707 PolarHBondContact O-N 3.34Å
704	I	95.2	Very high	94.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-46.1	-178.7	-51.7	-157.9	0	0	0	112.1	T667 I669 E694 C702 L706 Y707 D708	T667-I704 HydrophobicContact CG2-CD1 3.87Å; T667-I704 HydrophobicContact CG2-CG2 4.47Å; T667-I704 WeakPolarHBondContact O-CD1 3.4Å; I669-I704 HydrophobicContact CD1-CG1 4.24Å; I669-I704 HydrophobicContact CG1-CG1 4.15Å; E694-I704 HydrophobicContact CB-CD1 3.75Å; E694-I704 HydrophobicContact CB-CG1 4.33Å; E694-I704 HydrophobicContact CG-CD1 4.38Å; C702-I704 PolarHBondContact O-N 3.4Å; C702-I704 VanDerWaalsContact O-N 3.1Å; I704-L706 VanDerWaalsContact C-N 3.34Å; I704-Y707 PolarHBondContact O-N 2.86Å; I704-D708 WeakPolarHBondContact O-CB 3.4Å; I704-D708 PolarHBondContact O-N 3.35Å
705	K	95.7	Very high	94.5	Very high	78 Å²	78	52.5 Å²	52.5	34%	0.339	27%	0.266	S	S	.	.	H	α-helix	trans	-68.3	-36.6	177.9	-55.9	-48.9	-168.9	-156.2	0	111.3	E694 C702 D708 F709	E694-K705 VanDerWaalsContact OE1-CE 3.31Å; E694-K705 WeakPolarHBondContact OE1-CE 3.34Å; E694-K705 IonicContact OE1-NZ 2.81Å; E694-K705 PolarHBondContact OE1-NZ 3.21Å; C702-K705 HydrophobicContact CB-CB 4.17Å; C702-K705 HydrophobicContact CB-CG 3.88Å; C702-K705 PolarHBondContact O-N 2.92Å; C702-K705 VanDerWaalsContact O-N 3.16Å; K705-D708 PolarHBondContact O-N 3.2Å; K705-F709 WeakPolarHBondContact O-CB 3.24Å; K705-F709 PolarHBondContact O-N 3.16Å
706	L	97.3	Very high	94.5	Very high	7 Å²	7	55.8 Å²	55.8	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-69.8	-38.7	178	-68.5	165.6	0	0	0	111.9	W610 A617 L623 T626 F630 C702 I704 F709 Y710	W610-L706 HydrophobicContact CH2-CD1 4.12Å; A617-L706 HydrophobicContact CB-CD2 3.64Å; L623-L706 HydrophobicContact CD1-CB 4.29Å; L623-L706 HydrophobicContact CD1-CD2 4.08Å; T626-L706 HydrophobicContact CG2-CD1 3.96Å; F630-L706 HydrophobicContact CE2-CB 4.4Å; F630-L706 HydrophobicContact CE2-CD1 3.56Å; F630-L706 HydrophobicContact CZ-CD1 3.85Å; C702-L706 WeakPolarHBondContact O-CB 3.34Å; C702-L706 WeakPolarHBondContact O-CG 3.26Å; C702-L706 PolarHBondContact O-N 3.02Å; I704-L706 VanDerWaalsContact C-N 3.34Å; L706-F709 PolarHBondContact O-N 3.13Å; L706-Y710 PolarHBondContact O-N 3.12Å
707	Y	96.3	Very high	94.6	Very high	15 Å²	15	55.3 Å²	55.3	6%	0.059	28%	0.278	C	S	.	.	H	α-helix	trans	-68.1	-39.5	171.7	-177.7	-132.8	0	0	0	112.7	V651 I669 P703 I704 F709 Y710 L711 F725	V651-Y707 HydrophobicContact CG1-CE1 3.86Å; V651-Y707 HydrophobicContact CG1-CE2 4.32Å; V651-Y707 PolarHBondContact O-OH 3.05Å; V651-Y707 VanDerWaalsContact O-OH 3.08Å; I669-Y707 HydrophobicContact CD1-CD1 3.49Å; I669-Y707 VanDerWaalsContact CD1-CD1 3.49Å; I669-Y707 HydrophobicContact CD1-CE1 4.44Å; I669-Y707 HydrophobicContact CD1-CG 3.84Å; I669-Y707 HydrophobicContact CG1-CD1 3.93Å; I669-Y707 HydrophobicContact CG2-CD1 4.33Å; I669-Y707 HydrophobicContact CG2-CE1 4.26Å; P703-Y707 VanDerWaalsContact O-CB 3.3Å; P703-Y707 WeakPolarHBondContact O-CB 3.39Å; P703-Y707 PolarHBondContact O-N 3.34Å; I704-Y707 PolarHBondContact O-N 2.86Å; Y707-F709 VanDerWaalsContact C-N 3.33Å; Y707-F709 PolarHBondContact O-N 2.87Å; Y707-Y710 HydrophobicContact CD2-CD1 4.24Å; Y707-Y710 HydrophobicContact CE2-CD1 4.41Å; Y707-Y710 PolarHBondContact O-N 3.48Å; Y707-L711 HydrophobicContact CD1-CD1 4.03Å; Y707-L711 HydrophobicContact CD2-CD1 4.34Å; Y707-L711 HydrophobicContact CD2-CG 4.13Å; Y707-L711 HydrophobicContact CE1-CD1 3.68Å; Y707-L711 HydrophobicContact CE1-CG 4.41Å; Y707-L711 HydrophobicContact CE2-CD1 3.98Å; Y707-L711 HydrophobicContact CE2-CD2 4.04Å; Y707-L711 HydrophobicContact CE2-CG 3.78Å; Y707-L711 HydrophobicContact CG-CD1 4.37Å; Y707-L711 WeakPolarHBondContact O-CB 3.44Å; Y707-L711 WeakPolarHBondContact O-CG 3.25Å; Y707-L711 PolarHBondContact O-N 2.94Å; Y707-F725 HydrophobicContact CD2-CE2 4.17Å; Y707-F725 AromaticContact CD2-CZ 3.94Å; Y707-F725 HydrophobicContact CD2-CZ 3.94Å; Y707-F725 AromaticContact CE2-CE2 3.41Å; Y707-F725 HydrophobicContact CE2-CE2 3.41Å; Y707-F725 VanDerWaalsContact CE2-CE2 3.41Å; Y707-F725 AromaticContact CE2-CZ 3.65Å; Y707-F725 HydrophobicContact CE2-CZ 3.65Å; Y707-F725 AromaticContact CZ-CE2 3.97Å
708	D	94.8	Very high	94.4	Very high	60 Å²	60	46.5 Å²	46.5	32%	0.321	24%	0.237	S	C	.	.	H	α-helix	trans	-60.4	-43.2	172.7	-80.8	-24.4	0	0	0	111.7	R653 I704 K705 L711 F712	R653-D708 IonicContact CZ-OD1 3.5Å; R653-D708 IonicContact CZ-OD2 2.7Å; R653-D708 IonicContact NH1-OD1 3.61Å; R653-D708 IonicContact NH1-OD2 2.69Å; R653-D708 PolarHBondContact NH1-OD2 2.78Å; R653-D708 IonicContact NH2-OD1 3.49Å; R653-D708 PolarHBondContact NH2-OD1 3.4Å; R653-D708 IonicContact NH2-OD2 2.69Å; R653-D708 PolarHBondContact NH2-OD2 3.16Å; I704-D708 WeakPolarHBondContact O-CB 3.4Å; I704-D708 PolarHBondContact O-N 3.35Å; K705-D708 PolarHBondContact O-N 3.2Å; D708-L711 PolarHBondContact O-N 2.6Å; D708-F712 WeakPolarHBondContact O-CB 3.42Å; D708-F712 PolarHBondContact O-N 2.67Å
709	F	96.2	Very high	93.9	Very high	70 Å²	70	48.2 Å²	48.2	31%	0.307	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-40	177.4	-172.2	-117.2	0	0	0	111.9	A617 L623 K705 L706 Y707 F712 K713 W740	A617-F709 HydrophobicContact CB-CD1 3.87Å; A617-F709 HydrophobicContact CB-CE1 3.89Å; L623-F709 HydrophobicContact CD1-CD1 4.47Å; L623-F709 HydrophobicContact CD2-CD1 3.6Å; L623-F709 HydrophobicContact CD2-CE1 4.07Å; K705-F709 WeakPolarHBondContact O-CB 3.24Å; K705-F709 PolarHBondContact O-N 3.16Å; L706-F709 PolarHBondContact O-N 3.13Å; Y707-F709 VanDerWaalsContact C-N 3.33Å; Y707-F709 PolarHBondContact O-N 2.87Å; F709-F712 WeakPolarHBondContact O-CB 3.3Å; F709-F712 PolarHBondContact O-N 2.78Å; F709-K713 HydrophobicContact CE1-CG 4.34Å; F709-K713 VanDerWaalsContact CE2-CE 3.5Å; F709-K713 HydrophobicContact CE2-CG 4.3Å; F709-K713 HydrophobicContact CZ-CD 4.42Å; F709-K713 HydrophobicContact CZ-CG 4.23Å; F709-K713 WeakPolarHBondContact O-CB 3.23Å; F709-K713 VanDerWaalsContact O-CG 3.26Å; F709-K713 WeakPolarHBondContact O-CG 3.48Å; F709-K713 PolarHBondContact O-N 2.99Å; F709-W740 HydrophobicContact CE1-CE3 4.34Å; F709-W740 AromaticContact CE1-CH2 3.69Å; F709-W740 HydrophobicContact CE1-CH2 3.69Å; F709-W740 AromaticContact CE1-CZ3 3.59Å; F709-W740 HydrophobicContact CE1-CZ3 3.59Å; F709-W740 AromaticContact CZ-CH2 3.88Å; F709-W740 HydrophobicContact CZ-CH2 3.88Å; F709-W740 HydrophobicContact CZ-CZ2 4.31Å; F709-W740 HydrophobicContact CZ-CZ3 4.18Å
710	Y	96.6	Very high	93.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-49.6	171.4	178.3	-116.9	0	0	0	112.1	L623 L624 L627 F648 L706 Y707 F712 K713 C714 F725 L727 Y741	L623-Y710 HydrophobicContact CD2-CD2 4.43Å; L624-Y710 HydrophobicContact CD1-CE2 3.8Å; L627-Y710 HydrophobicContact CD1-CD1 3.36Å; L627-Y710 HydrophobicContact CD1-CD2 3.91Å; L627-Y710 HydrophobicContact CD1-CE1 3.97Å; L627-Y710 HydrophobicContact CD1-CE2 4.48Å; L627-Y710 HydrophobicContact CD1-CG 3.32Å; F648-Y710 HydrophobicContact CE1-CD1 4.14Å; F648-Y710 AromaticContact CE1-CE1 3.57Å; F648-Y710 HydrophobicContact CE1-CE1 3.57Å; F648-Y710 AromaticContact CZ-CE1 3.65Å; F648-Y710 HydrophobicContact CZ-CE1 3.65Å; L706-Y710 PolarHBondContact O-N 3.12Å; Y707-Y710 HydrophobicContact CD2-CD1 4.24Å; Y707-Y710 HydrophobicContact CE2-CD1 4.41Å; Y707-Y710 PolarHBondContact O-N 3.48Å; Y710-F712 PolarHBondContact O-N 3.33Å; Y710-K713 CarbonylContact O-C 3.45Å; Y710-K713 PolarHBondContact O-N 2.82Å; Y710-K713 VanDerWaalsContact O-N 3.13Å; Y710-C714 WeakPolarHBondContact O-CB 3.5Å; Y710-C714 PolarHBondContact O-N 2.93Å; Y710-C714 PolarHBondContact O-SG 3.39Å; Y710-F725 HydrophobicContact CE1-CE1 4.35Å; Y710-F725 WeakPolarHBondContact CE1-O 3.38Å; Y710-F725 PolarHBondContact OH-O 2.88Å; Y710-L727 PolarHBondContact OH-N 3.06Å; Y710-Y741 AromaticContact CD2-CD2 3.98Å; Y710-Y741 HydrophobicContact CD2-CD2 3.98Å; Y710-Y741 HydrophobicContact CD2-CE1 4.4Å; Y710-Y741 AromaticContact CD2-CE2 3.38Å; Y710-Y741 HydrophobicContact CD2-CE2 3.38Å; Y710-Y741 AromaticContact CD2-CZ 3.62Å; Y710-Y741 HydrophobicContact CE2-CD1 4.14Å; Y710-Y741 AromaticContact CE2-CD2 3.8Å; Y710-Y741 HydrophobicContact CE2-CD2 3.8Å; Y710-Y741 AromaticContact CE2-CE1 3.9Å; Y710-Y741 HydrophobicContact CE2-CE1 3.9Å; Y710-Y741 AromaticContact CE2-CE2 3.54Å; Y710-Y741 HydrophobicContact CE2-CE2 3.54Å; Y710-Y741 HydrophobicContact CE2-CG 4.09Å; Y710-Y741 AromaticContact CE2-CZ 3.59Å
711	L	94.8	Very high	93.2	Very high	36 Å²	36	43.7 Å²	43.7	19%	0.188	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-28.9	174.9	-74.4	175.1	0	0	0	112.9	F648 Y707 D708 K719	F648-L711 HydrophobicContact CD1-CD2 3.69Å; F648-L711 HydrophobicContact CE1-CD2 3.72Å; Y707-L711 HydrophobicContact CD1-CD1 4.03Å; Y707-L711 HydrophobicContact CD2-CD1 4.34Å; Y707-L711 HydrophobicContact CD2-CG 4.13Å; Y707-L711 HydrophobicContact CE1-CD1 3.68Å; Y707-L711 HydrophobicContact CE1-CG 4.41Å; Y707-L711 HydrophobicContact CE2-CD1 3.98Å; Y707-L711 HydrophobicContact CE2-CD2 4.04Å; Y707-L711 HydrophobicContact CE2-CG 3.78Å; Y707-L711 HydrophobicContact CG-CD1 4.37Å; Y707-L711 WeakPolarHBondContact O-CB 3.44Å; Y707-L711 WeakPolarHBondContact O-CG 3.25Å; Y707-L711 PolarHBondContact O-N 2.94Å; D708-L711 PolarHBondContact O-N 2.6Å; L711-K719 WeakPolarHBondContact O-CE 3.5Å; L711-K719 PolarHBondContact O-NZ 2.89Å
712	F	94.8	Very high	92.9	Very high	127 Å²	127	46 Å²	46	56%	0.557	24%	0.24	S	C	*	.	H	α-helix	trans	-71.3	-46.2	173.2	178	-99.2	0	0	0	111.5	D708 F709 Y710 C714	D708-F712 WeakPolarHBondContact O-CB 3.42Å; D708-F712 PolarHBondContact O-N 2.67Å; F709-F712 WeakPolarHBondContact O-CB 3.3Å; F709-F712 PolarHBondContact O-N 2.78Å; Y710-F712 PolarHBondContact O-N 3.33Å; F712-C714 VanDerWaalsContact C-N 3.3Å; F712-C714 PolarHBondContact O-N 2.97Å
713	K	96	Very high	92.7	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.03	26%	0.263	C	S	.	.	H	α-helix	trans	-76.6	-8.4	179.9	-65.4	-68.8	-168.5	160	0	114.8	F709 Y710 P735 S737 I739 W740 Y741	F709-K713 HydrophobicContact CE1-CG 4.34Å; F709-K713 VanDerWaalsContact CE2-CE 3.5Å; F709-K713 HydrophobicContact CE2-CG 4.3Å; F709-K713 HydrophobicContact CZ-CD 4.42Å; F709-K713 HydrophobicContact CZ-CG 4.23Å; F709-K713 WeakPolarHBondContact O-CB 3.23Å; F709-K713 VanDerWaalsContact O-CG 3.26Å; F709-K713 WeakPolarHBondContact O-CG 3.48Å; F709-K713 PolarHBondContact O-N 2.99Å; Y710-K713 CarbonylContact O-C 3.45Å; Y710-K713 PolarHBondContact O-N 2.82Å; Y710-K713 VanDerWaalsContact O-N 3.13Å; K713-P735 PolarHBondContact NZ-O 3.11Å; K713-S737 PolarHBondContact NZ-O 3Å; K713-I739 WeakPolarHBondContact O-CA 3.4Å; K713-W740 HydrophobicContact CB-CB 4.03Å; K713-W740 HydrophobicContact CB-CD2 4.43Å; K713-W740 HydrophobicContact CB-CG 4.19Å; K713-W740 HydrophobicContact CD-CB 4.44Å; K713-W740 HydrophobicContact CD-CD2 3.75Å; K713-W740 HydrophobicContact CD-CE3 4.34Å; K713-W740 HydrophobicContact CD-CG 3.73Å; K713-W740 HydrophobicContact CG-CD2 3.98Å; K713-W740 HydrophobicContact CG-CE3 4.1Å; K713-W740 HydrophobicContact CG-CG 4.13Å; K713-W740 PolarHBondContact O-N 2.88Å; K713-Y741 HydrophobicContact CB-CD2 4.28Å; K713-Y741 HydrophobicContact CB-CE2 4.14Å
714	C	96	Very high	92.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-80.5	145.1	174.7	-77.1	0	0	0	0	112.4	Y710 F712 Q716 V718 L727	Y710-C714 WeakPolarHBondContact O-CB 3.5Å; Y710-C714 PolarHBondContact O-N 2.93Å; Y710-C714 PolarHBondContact O-SG 3.39Å; F712-C714 VanDerWaalsContact C-N 3.3Å; F712-C714 PolarHBondContact O-N 2.97Å; C714-Q716 PolarHBondContact O-N 2.96Å; C714-Q716 PolarHBondContact O-NE2 3.04Å; C714-V718 HydrophobicContact CB-CG2 3.81Å; C714-L727 HydrophobicContact CB-CD1 4.42Å
715	P	94.1	Very high	92.6	Very high	17 Å²	17	50.4 Å²	50.4	11%	0.11	26%	0.264	C	S	.	.			trans	-58.1	136.2	170.2	-21.4	32.5	0	0	0	111.2	S717 V718 I739 Y741 V743	P715-S717 PolarHBondContact O-N 2.84Å; P715-V718 HydrophobicContact CB-CG1 4.48Å; P715-V718 WeakPolarHBondContact O-CG2 3.28Å; P715-V718 PolarHBondContact O-N 2.86Å; P715-I739 HydrophobicContact CG-CG2 4.02Å; P715-Y741 WeakPolarHBondContact CD-O 3.34Å; P715-Y741 WeakPolarHBondContact CG-O 3.37Å; P715-V743 HydrophobicContact CB-CG1 4.02Å; P715-V743 HydrophobicContact CG-CG1 4.07Å
716	Q	89.3	Confident	92.7	Very high	121 Å²	121	46.9 Å²	46.9	57%	0.565	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-60.7	-25.9	-172.3	-53.9	-51.6	-54.5	0	0	113.3	C714 V718 K719	C714-Q716 PolarHBondContact O-N 2.96Å; C714-Q716 PolarHBondContact O-NE2 3.04Å; Q716-V718 PolarHBondContact O-N 2.87Å; Q716-K719 WeakPolarHBondContact O-CB 3.36Å; Q716-K719 PolarHBondContact O-N 3.05Å; Q716-K719 VanDerWaalsContact OE1-CE 3.24Å
717	S	89.9	Confident	92.7	Very high	92 Å²	92	46.5 Å²	46.5	64%	0.643	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-66.4	-14.1	177.3	51.5	0	0	0	0	115.3	P715	P715-S717 PolarHBondContact O-N 2.84Å
718	V	89.4	Confident	92.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-89.2	-14	176	-48.5	0	0	0	0	112.9	F648 C714 P715 Q716 G720 R721 L727 V743	F648-V718 HydrophobicContact CD2-CG2 4.39Å; F648-V718 WeakPolarHBondContact CD2-O 3.18Å; F648-V718 HydrophobicContact CE2-CB 4.12Å; F648-V718 HydrophobicContact CE2-CG2 3.8Å; F648-V718 HydrophobicContact CZ-CG2 4.04Å; C714-V718 HydrophobicContact CB-CG2 3.81Å; P715-V718 HydrophobicContact CB-CG1 4.48Å; P715-V718 WeakPolarHBondContact O-CG2 3.28Å; P715-V718 PolarHBondContact O-N 2.86Å; Q716-V718 PolarHBondContact O-N 2.87Å; V718-G720 PolarHBondContact O-N 2.94Å; V718-R721 WeakPolarHBondContact O-CB 3.36Å; V718-R721 PolarHBondContact O-N 3.27Å; V718-L727 HydrophobicContact CB-CD1 4.05Å; V718-L727 HydrophobicContact CG1-CD1 3.88Å; V718-L727 HydrophobicContact CG1-CD2 4.42Å; V718-L727 HydrophobicContact CG2-CD1 3.64Å; V718-V743 HydrophobicContact CG1-CB 4.29Å; V718-V743 HydrophobicContact CG1-CG1 4.07Å
719	K	81.2	Confident	92.8	Very high	92 Å²	92	46 Å²	46	40%	0.4	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	118	-177.3	-64.6	-176.1	176.5	-179.4	0	109.9	L711 Q716	L711-K719 WeakPolarHBondContact O-CE 3.5Å; L711-K719 PolarHBondContact O-NZ 2.89Å; Q716-K719 WeakPolarHBondContact O-CB 3.36Å; Q716-K719 PolarHBondContact O-N 3.05Å; Q716-K719 VanDerWaalsContact OE1-CE 3.24Å
720	G	81.8	Confident	92.6	Very high	58 Å²	58	46.5 Å²	46.5	60%	0.598	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	0.5	-174.4	0	0	0	0	0	115.1	V718	V718-G720 PolarHBondContact O-N 2.94Å
721	R	89.7	Confident	91.9	Very high	65 Å²	65	51.3 Å²	51.3	25%	0.245	28%	0.283	C	S	.	.			trans	-57.8	142.6	169.8	-83	-179.1	76.5	169	0.4	111.5	F648 S649 V718 D723 V743	F648-R721 HydrophobicContact CD2-CB 4.43Å; F648-R721 PolarHBondContact N-O 3.37Å; S649-R721 PolarHBondContact N-O 3.25Å; S649-R721 PolarHBondContact OG-O 3.14Å; V718-R721 WeakPolarHBondContact O-CB 3.36Å; V718-R721 PolarHBondContact O-N 3.27Å; R721-D723 WeakPolarHBondContact CB-OD1 3.11Å; R721-D723 IonicContact CZ-OD1 2.74Å; R721-D723 IonicContact CZ-OD2 3.53Å; R721-D723 IonicContact NE-OD1 3.27Å; R721-D723 PolarHBondContact NE-OD1 2.69Å; R721-D723 IonicContact NE-OD2 2.69Å; R721-D723 PolarHBondContact NE-OD2 3.27Å; R721-D723 IonicContact NH2-OD1 2.74Å; R721-D723 IonicContact NH2-OD2 3.85Å; R721-D723 PolarHBondContact NH2-OD2 3.16Å; R721-V743 PolarHBondContact NH1-O 2.71Å
722	N	90.3	Very high	91.3	Very high	114 Å²	114	56.4 Å²	56.4	61%	0.61	32%	0.315	S	S	*	.	S	Bend	trans	-110.1	-1.4	-175.4	64.6	-12.9	0	0	0	113.7	A647 S649	A647-N722 VanDerWaalsContact CB-O 3.25Å; A647-N722 WeakPolarHBondContact CB-O 3.35Å; S649-N722 VanDerWaalsContact OG-CA 3.31Å; S649-N722 WeakPolarHBondContact OG-CA 3.4Å; S649-N722 WeakPolarHBondContact OG-CB 3.33Å
723	D	90.9	Very high	90.8	Very high	87 Å²	87	52.4 Å²	52.4	47%	0.465	30%	0.301	S	S	.	.	S	Bend	trans	-110.6	-21.3	-173.4	67.5	-44.9	0	0	0	114.2	R721	R721-D723 WeakPolarHBondContact CB-OD1 3.11Å; R721-D723 IonicContact CZ-OD1 2.74Å; R721-D723 IonicContact CZ-OD2 3.53Å; R721-D723 IonicContact NE-OD1 3.27Å; R721-D723 PolarHBondContact NE-OD1 2.69Å; R721-D723 IonicContact NE-OD2 2.69Å; R721-D723 PolarHBondContact NE-OD2 3.27Å; R721-D723 IonicContact NH2-OD1 2.74Å; R721-D723 IonicContact NH2-OD2 3.85Å; R721-D723 PolarHBondContact NH2-OD2 3.16Å
724	T	94.5	Very high	90.1	Very high	11 Å²	11	54.4 Å²	54.4	7%	0.067	32%	0.319	C	S	.	.			trans	-146.7	154.5	179.3	-174.4	0	0	0	0	113.5	L646 A647 F648 Y726 L727	L646-T724 CarbonylContact O-C 3.6Å; A647-T724 VanDerWaalsContact CA-O 3.27Å; A647-T724 WeakPolarHBondContact CA-O 3.48Å; F648-T724 WeakPolarHBondContact CD2-O 3.43Å; F648-T724 PolarHBondContact N-O 2.99Å; F648-T724 VanDerWaalsContact N-O 3.15Å; T724-Y726 PolarHBondContact OG1-O 3.42Å; T724-L727 HydrophobicContact CG2-CD2 3.95Å
725	F	96.1	Very high	89.3	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.009	35%	0.35	C	S	.	.	S	Bend	trans	-123.8	-39.4	171.2	-178.1	-88.1	0	0	0	112.2	L627 N631 L646 F648 V651 Y707 Y710	L627-F725 HydrophobicContact CB-CE1 4.35Å; L627-F725 HydrophobicContact CD1-CE1 4.35Å; L627-F725 HydrophobicContact CD1-CZ 4.49Å; N631-F725 WeakPolarHBondContact ND2-CE1 3.47Å; L646-F725 HydrophobicContact CB-CB 4.03Å; L646-F725 HydrophobicContact CD2-CB 4.06Å; L646-F725 HydrophobicContact CD2-CD1 3.72Å; L646-F725 HydrophobicContact CD2-CD2 4.09Å; L646-F725 HydrophobicContact CD2-CE1 4.15Å; L646-F725 HydrophobicContact CD2-CE2 4.48Å; L646-F725 HydrophobicContact CD2-CG 3.68Å; L646-F725 HydrophobicContact CG-CB 3.83Å; L646-F725 HydrophobicContact CG-CD1 4.39Å; L646-F725 HydrophobicContact CG-CD2 4.11Å; L646-F725 HydrophobicContact CG-CG 3.86Å; L646-F725 WeakPolarHBondContact O-CB 3.47Å; L646-F725 PolarHBondContact O-N 3.07Å; F648-F725 HydrophobicContact CD1-CD2 4.26Å; F648-F725 HydrophobicContact CE1-CD2 4.5Å; F648-F725 VanDerWaalsContact CZ-O 3.29Å; F648-F725 WeakPolarHBondContact CZ-O 3.34Å; V651-F725 HydrophobicContact CB-CD2 4.25Å; V651-F725 HydrophobicContact CB-CE2 3.9Å; V651-F725 HydrophobicContact CG1-CE2 3.83Å; V651-F725 HydrophobicContact CG2-CD2 3.83Å; V651-F725 HydrophobicContact CG2-CE2 3.79Å; Y707-F725 HydrophobicContact CD2-CE2 4.17Å; Y707-F725 AromaticContact CD2-CZ 3.94Å; Y707-F725 HydrophobicContact CD2-CZ 3.94Å; Y707-F725 AromaticContact CE2-CE2 3.41Å; Y707-F725 HydrophobicContact CE2-CE2 3.41Å; Y707-F725 VanDerWaalsContact CE2-CE2 3.41Å; Y707-F725 AromaticContact CE2-CZ 3.65Å; Y707-F725 HydrophobicContact CE2-CZ 3.65Å; Y707-F725 AromaticContact CZ-CE2 3.97Å; Y710-F725 HydrophobicContact CE1-CE1 4.35Å; Y710-F725 WeakPolarHBondContact CE1-O 3.38Å; Y710-F725 PolarHBondContact OH-O 2.88Å
726	Y	97.3	Very high	88.9	Confident	3 Å²	3	65 Å²	65	1%	0.012	38%	0.38	C	S	.	.			trans	-96.6	112.7	-175.1	-57	-86.1	0	0	0	110.6	L624 M628 N631 H643 L646 T724 P745 I746 M751	L624-Y726 HydrophobicContact CD1-CD1 3.94Å; L624-Y726 HydrophobicContact CG-CD1 4.28Å; M628-Y726 HydrophobicContact CB-CE1 3.87Å; M628-Y726 HydrophobicContact CE-CD1 3.95Å; M628-Y726 HydrophobicContact CE-CE1 4.02Å; M628-Y726 HydrophobicContact CE-CG 4.36Å; M628-Y726 HydrophobicContact CG-CE1 4.19Å; N631-Y726 WeakPolarHBondContact CB-OH 3.02Å; N631-Y726 PolarHBondContact ND2-OH 2.95Å; H643-Y726 HydrophobicContact CB-CE2 3.93Å; H643-Y726 AromaticContact ND1-CE2 3.8Å; H643-Y726 AromaticContact ND1-CZ 3.5Å; H643-Y726 PolarHBondContact ND1-OH 2.78Å; L646-Y726 HydrophobicContact CB-CE2 4.22Å; L646-Y726 HydrophobicContact CD2-CE2 3.78Å; L646-Y726 WeakPolarHBondContact CD2-OH 3.18Å; T724-Y726 PolarHBondContact OG1-O 3.42Å; Y726-P745 VanDerWaalsContact O-CA 3.32Å; Y726-P745 WeakPolarHBondContact O-CA 3.49Å; Y726-I746 HydrophobicContact CG-CD1 4.39Å; Y726-I746 PolarHBondContact O-N 3Å; Y726-I746 VanDerWaalsContact O-N 3.15Å; Y726-M751 HydrophobicContact CD2-CE 3.38Å; Y726-M751 HydrophobicContact CE2-CE 4Å; Y726-M751 HydrophobicContact CG-CE 3.87Å
727	L	97.4	Very high	89	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	147.7	-176.2	-60.6	174.5	0	0	0	111.7	L624 F648 Y710 C714 V718 T724 P729 Y741 Q744	L624-L727 WeakPolarHBondContact CD2-O 3.32Å; F648-L727 HydrophobicContact CE2-CD1 3.98Å; F648-L727 HydrophobicContact CE2-CD2 4.48Å; F648-L727 HydrophobicContact CE2-CG 4.18Å; F648-L727 HydrophobicContact CZ-CD1 3.93Å; F648-L727 HydrophobicContact CZ-CG 4.28Å; Y710-L727 PolarHBondContact OH-N 3.06Å; C714-L727 HydrophobicContact CB-CD1 4.42Å; V718-L727 HydrophobicContact CB-CD1 4.05Å; V718-L727 HydrophobicContact CG1-CD1 3.88Å; V718-L727 HydrophobicContact CG1-CD2 4.42Å; V718-L727 HydrophobicContact CG2-CD1 3.64Å; T724-L727 HydrophobicContact CG2-CD2 3.95Å; L727-P729 WeakPolarHBondContact O-CD 3.33Å; L727-Y741 HydrophobicContact CB-CD1 4.44Å; L727-Y741 HydrophobicContact CB-CG 4.39Å; L727-Y741 WeakPolarHBondContact O-CD1 3.37Å; L727-Q744 CarbonylContact C-O 3.57Å; L727-Q744 VanDerWaalsContact CA-O 3.29Å; L727-Q744 WeakPolarHBondContact CA-O 3.42Å
728	T	96.6	Very high	89	Confident	37 Å²	37	60.7 Å²	60.7	23%	0.227	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	124.6	-179.1	-53.6	0	0	0	0	110.8	S742 Q744 P745 I746	T728-S742 PolarHBondContact O-N 2.68Å; T728-S742 PolarHBondContact O-OG 3.49Å; T728-Q744 PolarHBondContact N-O 3.37Å; T728-Q744 PolarHBondContact OG1-O 3.25Å; T728-P745 PolarHBondContact OG1-O 3.31Å; T728-I746 WeakPolarHBondContact OG1-CA 3.24Å; T728-I746 PolarHBondContact OG1-N 2.6Å
729	P	95.3	Very high	89.2	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.175	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	142.3	169.2	-32.7	39.8	0	0	0	113.4	P620 L624 L727 Y741	P620-P729 HydrophobicContact CB-CB 3.99Å; P620-P729 HydrophobicContact CB-CG 4.35Å; L624-P729 HydrophobicContact CD2-CG 4.45Å; L727-P729 WeakPolarHBondContact O-CD 3.33Å; P729-Y741 HydrophobicContact CG-CD1 4.4Å; P729-Y741 HydrophobicContact CG-CE1 4.22Å
730	E	92.4	Very high	90	Very high	80 Å²	80	60 Å²	60	37%	0.374	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-73.9	124.8	165.9	-68.2	-62.4	165.9	0	0	109.6	V732 V733 W740 S742	E730-V732 VanDerWaalsContact C-N 3.26Å; E730-V732 PolarHBondContact O-N 2.84Å; E730-V732 VanDerWaalsContact O-N 3.16Å; E730-V733 HydrophobicContact CB-CB 4.3Å; E730-W740 PolarHBondContact N-O 2.68Å; E730-S742 WeakPolarHBondContact OE1-CA 3.45Å; E730-S742 WeakPolarHBondContact OE1-CB 3.39Å; E730-S742 PolarHBondContact OE1-N 3.31Å
731	P	82	Confident	90.7	Very high	102 Å²	102	57.2 Å²	57.2	66%	0.662	33%	0.332	S	S	*	.	S	Bend	trans	-63.1	-24.1	-170.5	-26.6	35.2	0	0	0	115.9	L573	L573-P731 HydrophobicContact CD1-CB 4.46Å
732	V	81.4	Confident	90.9	Very high	143 Å²	143	55.1 Å²	55.1	87%	0.867	33%	0.327	S	S	*	.	S	Bend	trans	-133.9	104.5	177.5	-179.1	0	0	0	0	107.9	E730	E730-V732 VanDerWaalsContact C-N 3.26Å; E730-V732 PolarHBondContact O-N 2.84Å; E730-V732 VanDerWaalsContact O-N 3.16Å
733	V	84.5	Confident	91.2	Very high	43 Å²	43	52.6 Å²	52.6	26%	0.261	32%	0.315	S	S	.	.			trans	-146.8	132	-178.5	67.5	0	0	0	0	112.3	P620 E730 I739 W740	P620-V733 HydrophobicContact CG-CG1 3.53Å; E730-V733 HydrophobicContact CB-CB 4.3Å; V733-I739 VanDerWaalsContact CG2-O 3.3Å; V733-I739 WeakPolarHBondContact CG2-O 3.43Å; V733-W740 HydrophobicContact CG1-CG 4.43Å; V733-W740 HydrophobicContact CG2-CG 4.43Å
734	A	82	Confident	91.4	Very high	49 Å²	49	54.1 Å²	54.1	41%	0.405	32%	0.32	S	S	.	.			trans	-74	148.1	178.3	0	0	0	0	0	111.4	N736 S737 W740	A734-N736 WeakPolarHBondContact CB-OD1 3.49Å; A734-N736 PolarHBondContact O-N 3.1Å; A734-S737 WeakPolarHBondContact O-CB 3.46Å; A734-S737 PolarHBondContact O-N 3.14Å; A734-W740 PolarHBondContact O-NE1 3.21Å
735	P	80.3	Confident	91.5	Very high	100 Å²	100	56.3 Å²	56.3	65%	0.649	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.8	-179.6	-27.4	35.5	0	0	0	113.9	K713 S737 W740	K713-P735 PolarHBondContact NZ-O 3.11Å; P735-S737 VanDerWaalsContact C-N 3.33Å; P735-W740 WeakPolarHBondContact O-CZ2 3.45Å; P735-W740 PolarHBondContact O-NE1 3.23Å
736	N	85.3	Confident	91.5	Very high	140 Å²	140	56.6 Å²	56.6	75%	0.749	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-4.8	176.7	65.6	-16.1	0	0	0	114.5	A734	A734-N736 WeakPolarHBondContact CB-OD1 3.49Å; A734-N736 PolarHBondContact O-N 3.1Å
737	S	90.4	Very high	91.5	Very high	30 Å²	30	58.6 Å²	58.6	21%	0.21	35%	0.35	C	S	.	.			trans	-56.9	139.3	177.9	179.5	0	0	0	0	111.5	K713 A734 P735 I739	K713-S737 PolarHBondContact NZ-O 3Å; A734-S737 WeakPolarHBondContact O-CB 3.46Å; A734-S737 PolarHBondContact O-N 3.14Å; P735-S737 VanDerWaalsContact C-N 3.33Å; S737-I739 VanDerWaalsContact C-N 3.26Å; S737-I739 PolarHBondContact O-N 2.85Å; S737-I739 PolarHBondContact OG-N 3.43Å; S737-I739 PolarHBondContact OG-O 2.83Å
738	P	91	Very high	91.5	Very high	91 Å²	91	65 Å²	65	59%	0.591	38%	0.375	S	S	*	.	S	Bend	trans	-68.7	-23.5	175.6	28.8	-35.5	0	0	0	113.1
739	I	93.5	Very high	91.4	Very high	72 Å²	72	69.4 Å²	69.4	37%	0.369	39%	0.392	S	S	.	.			trans	-126.8	135	-178.7	-60.8	176.7	0	0	0	109	K713 P715 V733 S737 Y741	K713-I739 WeakPolarHBondContact O-CA 3.4Å; P715-I739 HydrophobicContact CG-CG2 4.02Å; V733-I739 VanDerWaalsContact CG2-O 3.3Å; V733-I739 WeakPolarHBondContact CG2-O 3.43Å; S737-I739 VanDerWaalsContact C-N 3.26Å; S737-I739 PolarHBondContact O-N 2.85Å; S737-I739 PolarHBondContact OG-N 3.43Å; S737-I739 PolarHBondContact OG-O 2.83Å; I739-Y741 WeakPolarHBondContact CG2-O 3.33Å
740	W	96.4	Very high	91.4	Very high	6 Å²	6	71.9 Å²	71.9	2%	0.023	40%	0.402	C	S	.	.			trans	-119.6	-9.2	177.7	-76	-1.9	0	0	0	114.4	A617 P620 L623 F709 K713 E730 V733 A734 P735	A617-W740 VanDerWaalsContact O-CH2 3.31Å; A617-W740 WeakPolarHBondContact O-CH2 3.5Å; P620-W740 HydrophobicContact CB-CB 4.06Å; P620-W740 HydrophobicContact CB-CD2 4.49Å; P620-W740 HydrophobicContact CB-CE3 4.17Å; P620-W740 HydrophobicContact CG-CB 3.92Å; P620-W740 HydrophobicContact CG-CD2 3.96Å; P620-W740 HydrophobicContact CG-CE3 4Å; P620-W740 HydrophobicContact CG-CG 3.99Å; L623-W740 HydrophobicContact CD2-CE3 4.24Å; L623-W740 HydrophobicContact CD2-CZ3 4.16Å; F709-W740 HydrophobicContact CE1-CE3 4.34Å; F709-W740 AromaticContact CE1-CH2 3.69Å; F709-W740 HydrophobicContact CE1-CH2 3.69Å; F709-W740 AromaticContact CE1-CZ3 3.59Å; F709-W740 HydrophobicContact CE1-CZ3 3.59Å; F709-W740 AromaticContact CZ-CH2 3.88Å; F709-W740 HydrophobicContact CZ-CH2 3.88Å; F709-W740 HydrophobicContact CZ-CZ2 4.31Å; F709-W740 HydrophobicContact CZ-CZ3 4.18Å; K713-W740 HydrophobicContact CB-CB 4.03Å; K713-W740 HydrophobicContact CB-CD2 4.43Å; K713-W740 HydrophobicContact CB-CG 4.19Å; K713-W740 HydrophobicContact CD-CB 4.44Å; K713-W740 HydrophobicContact CD-CD2 3.75Å; K713-W740 HydrophobicContact CD-CE3 4.34Å; K713-W740 HydrophobicContact CD-CG 3.73Å; K713-W740 HydrophobicContact CG-CD2 3.98Å; K713-W740 HydrophobicContact CG-CE3 4.1Å; K713-W740 HydrophobicContact CG-CG 4.13Å; K713-W740 PolarHBondContact O-N 2.88Å; E730-W740 PolarHBondContact N-O 2.68Å; V733-W740 HydrophobicContact CG1-CG 4.43Å; V733-W740 HydrophobicContact CG2-CG 4.43Å; A734-W740 PolarHBondContact O-NE1 3.21Å; P735-W740 WeakPolarHBondContact O-CZ2 3.45Å; P735-W740 PolarHBondContact O-NE1 3.23Å
741	Y	97.1	Very high	91.6	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	146	-173.1	-56.8	-83.2	0	0	0	111.2	P620 L623 L624 Y710 K713 P715 L727 P729 I739	P620-Y741 WeakPolarHBondContact CA-OH 3.42Å; P620-Y741 HydrophobicContact CB-CE1 3.91Å; P620-Y741 WeakPolarHBondContact O-CE1 3.4Å; P620-Y741 PolarHBondContact O-OH 2.62Å; L623-Y741 WeakPolarHBondContact CB-OH 3.45Å; L623-Y741 HydrophobicContact CD2-CE2 4.44Å; L623-Y741 WeakPolarHBondContact CD2-OH 3.33Å; L624-Y741 HydrophobicContact CB-CE1 4.37Å; L624-Y741 HydrophobicContact CD1-CE1 4.32Å; Y710-Y741 AromaticContact CD2-CD2 3.98Å; Y710-Y741 HydrophobicContact CD2-CD2 3.98Å; Y710-Y741 HydrophobicContact CD2-CE1 4.4Å; Y710-Y741 AromaticContact CD2-CE2 3.38Å; Y710-Y741 HydrophobicContact CD2-CE2 3.38Å; Y710-Y741 AromaticContact CD2-CZ 3.62Å; Y710-Y741 HydrophobicContact CE2-CD1 4.14Å; Y710-Y741 AromaticContact CE2-CD2 3.8Å; Y710-Y741 HydrophobicContact CE2-CD2 3.8Å; Y710-Y741 AromaticContact CE2-CE1 3.9Å; Y710-Y741 HydrophobicContact CE2-CE1 3.9Å; Y710-Y741 AromaticContact CE2-CE2 3.54Å; Y710-Y741 HydrophobicContact CE2-CE2 3.54Å; Y710-Y741 HydrophobicContact CE2-CG 4.09Å; Y710-Y741 AromaticContact CE2-CZ 3.59Å; K713-Y741 HydrophobicContact CB-CD2 4.28Å; K713-Y741 HydrophobicContact CB-CE2 4.14Å; P715-Y741 WeakPolarHBondContact CD-O 3.34Å; P715-Y741 WeakPolarHBondContact CG-O 3.37Å; L727-Y741 HydrophobicContact CB-CD1 4.44Å; L727-Y741 HydrophobicContact CB-CG 4.39Å; L727-Y741 WeakPolarHBondContact O-CD1 3.37Å; P729-Y741 HydrophobicContact CG-CD1 4.4Å; P729-Y741 HydrophobicContact CG-CE1 4.22Å; I739-Y741 WeakPolarHBondContact CG2-O 3.33Å
742	S	95.2	Very high	92.4	Very high	20 Å²	20	63.7 Å²	63.7	14%	0.14	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	178.3	171.2	74.2	0	0	0	0	111.7	T728 E730 Q744	T728-S742 PolarHBondContact O-N 2.68Å; T728-S742 PolarHBondContact O-OG 3.49Å; E730-S742 WeakPolarHBondContact OE1-CA 3.45Å; E730-S742 WeakPolarHBondContact OE1-CB 3.39Å; E730-S742 PolarHBondContact OE1-N 3.31Å; S742-Q744 VanDerWaalsContact C-N 3.28Å; S742-Q744 PolarHBondContact OG-N 3.44Å; S742-Q744 VanDerWaalsContact OG-N 3.15Å
743	V	95	Very high	93.1	Very high	61 Å²	61	58.1 Å²	58.1	37%	0.37	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	0.6	169.5	-61.5	0	0	0	0	113.6	P715 V718 R721	P715-V743 HydrophobicContact CB-CG1 4.02Å; P715-V743 HydrophobicContact CG-CG1 4.07Å; V718-V743 HydrophobicContact CG1-CB 4.29Å; V718-V743 HydrophobicContact CG1-CG1 4.07Å; R721-V743 PolarHBondContact NH1-O 2.71Å
744	Q	96.3	Very high	93.7	Very high	119 Å²	119	57.1 Å²	57.1	56%	0.556	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	146	-178.2	-59.6	-60.8	-12.3	0	0	111.3	L727 T728 S742	L727-Q744 CarbonylContact C-O 3.57Å; L727-Q744 VanDerWaalsContact CA-O 3.29Å; L727-Q744 WeakPolarHBondContact CA-O 3.42Å; T728-Q744 PolarHBondContact N-O 3.37Å; T728-Q744 PolarHBondContact OG1-O 3.25Å; S742-Q744 VanDerWaalsContact C-N 3.28Å; S742-Q744 PolarHBondContact OG-N 3.44Å; S742-Q744 VanDerWaalsContact OG-N 3.15Å
745	P	96.5	Very high	94.4	Very high	57 Å²	57	55 Å²	55	37%	0.37	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	150.8	169.9	32.4	-34.8	0	0	0	111.4	Y726 T728	Y726-P745 VanDerWaalsContact O-CA 3.32Å; Y726-P745 WeakPolarHBondContact O-CA 3.49Å; T728-P745 PolarHBondContact OG1-O 3.31Å
746	I	96.6	Very high	95.2	Very high	8 Å²	8	51 Å²	51	4%	0.041	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-60.7	153.8	167.1	55.9	172.2	0	0	0	111.2	L624 M628 Y726 T728 M751 M754	L624-I746 HydrophobicContact CD2-CD1 4.23Å; L624-I746 HydrophobicContact CD2-CG2 3.66Å; M628-I746 HydrophobicContact CE-CD1 3.84Å; Y726-I746 HydrophobicContact CG-CD1 4.39Å; Y726-I746 PolarHBondContact O-N 3Å; Y726-I746 VanDerWaalsContact O-N 3.15Å; T728-I746 WeakPolarHBondContact OG1-CA 3.24Å; T728-I746 PolarHBondContact OG1-N 2.6Å; I746-M751 HydrophobicContact CD1-CB 3.91Å; I746-M751 HydrophobicContact CD1-CE 3.83Å; I746-M751 HydrophobicContact CD1-CG 4.47Å; I746-M751 HydrophobicContact CG1-CB 4.47Å; I746-M751 HydrophobicContact CG1-CE 4.05Å; I746-M754 HydrophobicContact CD1-SD 4Å
747	S	96.2	Very high	95.8	Very high	46 Å²	46	45 Å²	45	32%	0.322	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-68.3	155.2	178.4	90.6	0	0	0	0	111.7	E749 Q750 M751	S747-E749 PolarHBondContact O-N 2.56Å; S747-E749 PolarHBondContact OG-N 3.26Å; S747-Q750 PolarHBondContact O-N 3.09Å; S747-Q750 WeakPolarHBondContact OG-CG 3.27Å; S747-Q750 PolarHBondContact OG-N 2.87Å; S747-M751 WeakPolarHBondContact O-CB 3.36Å; S747-M751 PolarHBondContact O-N 3.41Å
748	R	96.9	Very high	96.2	Very high	134 Å²	134	43.8 Å²	43.8	51%	0.506	23%	0.228	S	C	.	.	H	α-helix	trans	-56.2	-35	172.6	173.5	171.7	-73.4	-97.6	-3.3	112.1	V640 D641 G752	V640-R748 HydrophobicContact CG1-CG 3.89Å; D641-R748 IonicContact OD1-CZ 2.71Å; D641-R748 VanDerWaalsContact OD1-CZ 3.22Å; D641-R748 IonicContact OD1-NH1 2.69Å; D641-R748 PolarHBondContact OD1-NH1 3.07Å; D641-R748 IonicContact OD1-NH2 2.65Å; D641-R748 PolarHBondContact OD1-NH2 3.38Å; D641-R748 IonicContact OD2-NH1 2.74Å; R748-G752 PolarHBondContact O-N 3.17Å
749	E	95.8	Very high	96.4	Very high	129 Å²	129	41.9 Å²	41.9	60%	0.603	21%	0.212	S	C	*	.	H	α-helix	trans	-71.5	-49.2	179.7	176.8	175.6	-152.2	0	0	111.8	S747 M751 G752 Q753	S747-E749 PolarHBondContact O-N 2.56Å; S747-E749 PolarHBondContact OG-N 3.26Å; E749-M751 VanDerWaalsContact C-N 3.3Å; E749-M751 PolarHBondContact O-N 3.44Å; E749-G752 WeakPolarHBondContact O-CA 3.44Å; E749-G752 PolarHBondContact O-N 2.97Å; E749-Q753 WeakPolarHBondContact O-CG 3.44Å; E749-Q753 PolarHBondContact O-N 3.1Å
750	Q	95.3	Very high	96.5	Very high	80 Å²	80	38.6 Å²	38.6	37%	0.374	20%	0.195	S	C	.	.	H	α-helix	trans	-56.9	-45.1	173.9	-72.5	170.8	-39	0	0	111	S747 G752 Q753 M754	S747-Q750 PolarHBondContact O-N 3.09Å; S747-Q750 WeakPolarHBondContact OG-CG 3.27Å; S747-Q750 PolarHBondContact OG-N 2.87Å; Q750-G752 VanDerWaalsContact C-N 3.31Å; Q750-G752 PolarHBondContact O-N 2.85Å; Q750-Q753 PolarHBondContact O-N 3.4Å; Q750-M754 WeakPolarHBondContact O-CB 3.42Å; Q750-M754 VanDerWaalsContact O-CG 3.24Å; Q750-M754 WeakPolarHBondContact O-CG 3.3Å; Q750-M754 PolarHBondContact O-N 3.2Å
751	M	97	Very high	96.5	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-37.2	174.9	-177.2	174.1	-75.6	0	0	112.5	M628 V640 H643 M644 Y726 I746 S747 E749 L755	M628-M751 HydrophobicContact CE-CB 4.45Å; M628-M751 HydrophobicContact CE-CE 4.21Å; M628-M751 HydrophobicContact CE-CG 3.86Å; M628-M751 HydrophobicContact SD-CG 4.38Å; V640-M751 HydrophobicContact CG1-CB 4.26Å; V640-M751 HydrophobicContact CG1-CG 3.98Å; V640-M751 HydrophobicContact CG1-SD 3.88Å; H643-M751 HydrophobicContact CB-CE 3.88Å; H643-M751 HydrophobicContact CB-CG 4.26Å; H643-M751 HydrophobicContact CB-SD 3.33Å; H643-M751 WeakPolarHBondContact CB-SD 3.24Å; M644-M751 HydrophobicContact CE-CB 4.34Å; M644-M751 HydrophobicContact CE-CE 3.51Å; M644-M751 HydrophobicContact CE-SD 3.56Å; M644-M751 VanDerWaalsContact CE-SD 3.56Å; M644-M751 HydrophobicContact CG-SD 3.78Å; Y726-M751 HydrophobicContact CD2-CE 3.38Å; Y726-M751 HydrophobicContact CE2-CE 4Å; Y726-M751 HydrophobicContact CG-CE 3.87Å; I746-M751 HydrophobicContact CD1-CB 3.91Å; I746-M751 HydrophobicContact CD1-CE 3.83Å; I746-M751 HydrophobicContact CD1-CG 4.47Å; I746-M751 HydrophobicContact CG1-CB 4.47Å; I746-M751 HydrophobicContact CG1-CE 4.05Å; S747-M751 WeakPolarHBondContact O-CB 3.36Å; S747-M751 PolarHBondContact O-N 3.41Å; E749-M751 VanDerWaalsContact C-N 3.3Å; E749-M751 PolarHBondContact O-N 3.44Å; M751-L755 WeakPolarHBondContact O-CB 3.47Å; M751-L755 PolarHBondContact O-N 3.15Å
752	G	97.1	Very high	96.4	Very high	8 Å²	8	39.7 Å²	39.7	8%	0.082	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-49.8	173.4	0	0	0	0	0	112.4	R748 E749 Q750 M754 L755 T756	R748-G752 PolarHBondContact O-N 3.17Å; E749-G752 WeakPolarHBondContact O-CA 3.44Å; E749-G752 PolarHBondContact O-N 2.97Å; Q750-G752 VanDerWaalsContact C-N 3.31Å; Q750-G752 PolarHBondContact O-N 2.85Å; G752-M754 PolarHBondContact O-N 3.22Å; G752-L755 PolarHBondContact O-N 2.89Å; G752-T756 VanDerWaalsContact O-CB 3.31Å; G752-T756 WeakPolarHBondContact O-CB 3.19Å; G752-T756 PolarHBondContact O-N 2.74Å; G752-T756 PolarHBondContact O-OG1 3.2Å; G752-T756 VanDerWaalsContact O-OG1 3.12Å
753	Q	96.4	Very high	96.3	Very high	25 Å²	25	40.8 Å²	40.8	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-44.7	177.7	-66.6	173.8	0.3	0	0	111.9	H583 E749 Q750 R757	H583-Q753 HydrophobicContact CB-CB 4.48Å; H583-Q753 HydrophobicContact CB-CG 3.96Å; E749-Q753 WeakPolarHBondContact O-CG 3.44Å; E749-Q753 PolarHBondContact O-N 3.1Å; Q750-Q753 PolarHBondContact O-N 3.4Å; Q753-R757 PolarHBondContact O-N 3.1Å
754	M	97.1	Very high	96.3	Very high	22 Å²	22	37.9 Å²	37.9	11%	0.108	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-51.4	175.3	-68	169.1	74.7	0	0	112	L624 M628 I746 Q750 G752 T756 R757 I758	L624-M754 HydrophobicContact CB-CE 4.28Å; L624-M754 HydrophobicContact CD2-CE 4.26Å; L624-M754 HydrophobicContact CG-CE 4.14Å; M628-M754 HydrophobicContact CE-CB 4.19Å; M628-M754 HydrophobicContact CE-CE 3.7Å; M628-M754 HydrophobicContact CE-SD 3.87Å; M628-M754 HydrophobicContact SD-CB 3.63Å; M628-M754 HydrophobicContact SD-CE 4.21Å; I746-M754 HydrophobicContact CD1-SD 4Å; Q750-M754 WeakPolarHBondContact O-CB 3.42Å; Q750-M754 VanDerWaalsContact O-CG 3.24Å; Q750-M754 WeakPolarHBondContact O-CG 3.3Å; Q750-M754 PolarHBondContact O-N 3.2Å; G752-M754 PolarHBondContact O-N 3.22Å; M754-T756 PolarHBondContact O-N 2.94Å; M754-R757 PolarHBondContact O-N 3.01Å; M754-I758 WeakPolarHBondContact O-CG1 3.32Å; M754-I758 PolarHBondContact O-N 3.08Å
755	L	97.8	Very high	96.2	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-39.4	-175.2	-179.5	59.7	0	0	0	112.3	M628 T632 T639 V640 H643 M751 G752 R757 I758 L759	M628-L755 HydrophobicContact SD-CB 4.2Å; T632-L755 HydrophobicContact CG2-CD1 4.31Å; T632-L755 WeakPolarHBondContact OG1-CD1 3.29Å; T639-L755 VanDerWaalsContact C-CD2 3.44Å; V640-L755 HydrophobicContact CG2-CD2 3.99Å; H643-L755 WeakPolarHBondContact NE2-CD1 3.38Å; M751-L755 WeakPolarHBondContact O-CB 3.47Å; M751-L755 PolarHBondContact O-N 3.15Å; G752-L755 PolarHBondContact O-N 2.89Å; L755-R757 VanDerWaalsContact C-N 3.31Å; L755-R757 PolarHBondContact O-N 3.11Å; L755-I758 WeakPolarHBondContact O-CB 3.37Å; L755-I758 PolarHBondContact O-N 2.73Å; L755-I758 VanDerWaalsContact O-N 3.09Å; L755-L759 HydrophobicContact CD1-CD1 4.3Å; L755-L759 HydrophobicContact CD1-CD2 4.42Å; L755-L759 HydrophobicContact CD1-CG 4.06Å; L755-L759 HydrophobicContact CG-CD1 3.93Å; L755-L759 HydrophobicContact CG-CG 4.19Å; L755-L759 WeakPolarHBondContact O-CG 3.49Å; L755-L759 PolarHBondContact O-N 3.49Å
756	T	97.3	Very high	95.9	Very high	17 Å²	17	34.9 Å²	34.9	10%	0.104	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-43	175.3	-74.1	0	0	0	0	111.8	H583 L586 K587 G752 M754 I758 L759 V760	H583-T756 PolarHBondContact CE1-OG1 3.24Å; H583-T756 WeakPolarHBondContact ND1-CB 3.06Å; H583-T756 PolarHBondContact ND1-OG1 3.34Å; H583-T756 VanDerWaalsContact ND1-OG1 3.16Å; L586-T756 HydrophobicContact CB-CG2 3.36Å; K587-T756 HydrophobicContact CB-CG2 4.32Å; G752-T756 VanDerWaalsContact O-CB 3.31Å; G752-T756 WeakPolarHBondContact O-CB 3.19Å; G752-T756 PolarHBondContact O-N 2.74Å; G752-T756 PolarHBondContact O-OG1 3.2Å; G752-T756 VanDerWaalsContact O-OG1 3.12Å; M754-T756 PolarHBondContact O-N 2.94Å; T756-I758 VanDerWaalsContact C-N 3.33Å; T756-I758 PolarHBondContact O-N 3.5Å; T756-L759 PolarHBondContact O-N 3.04Å; T756-V760 WeakPolarHBondContact O-CG2 3.35Å
757	R	97.1	Very high	95.6	Very high	15 Å²	15	35.7 Å²	35.7	6%	0.057	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-37.9	175.2	-66.4	-170.3	-59	-129.7	16.8	112	Y550 F570 L586 Q753 M754 L755	Y550-R757 HydrophobicContact CE1-CB 4.11Å; Y550-R757 WeakPolarHBondContact CE1-O 3.5Å; F570-R757 PolarHBondContact O-NH1 3.49Å; F570-R757 PolarHBondContact O-NH2 3.38Å; L586-R757 HydrophobicContact CD1-CG 4.09Å; Q753-R757 PolarHBondContact O-N 3.1Å; M754-R757 PolarHBondContact O-N 3.01Å; L755-R757 VanDerWaalsContact C-N 3.31Å; L755-R757 PolarHBondContact O-N 3.11Å
758	I	97.8	Very high	95.3	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-67.1	-40.6	178.3	-70.1	163.2	0	0	0	112.3	T625 M628 F629 T632 M754 L755 T756 V760 I761 I764	T625-I758 HydrophobicContact CG2-CD1 4.41Å; M628-I758 HydrophobicContact CB-CD1 3.78Å; M628-I758 HydrophobicContact CG-CD1 3.73Å; M628-I758 HydrophobicContact SD-CD1 4.07Å; F629-I758 HydrophobicContact CB-CD1 4.33Å; F629-I758 HydrophobicContact CB-CG1 4.47Å; F629-I758 HydrophobicContact CD2-CG2 4.09Å; T632-I758 HydrophobicContact CG2-CG2 3.86Å; M754-I758 WeakPolarHBondContact O-CG1 3.32Å; M754-I758 PolarHBondContact O-N 3.08Å; L755-I758 WeakPolarHBondContact O-CB 3.37Å; L755-I758 PolarHBondContact O-N 2.73Å; L755-I758 VanDerWaalsContact O-N 3.09Å; T756-I758 VanDerWaalsContact C-N 3.33Å; T756-I758 PolarHBondContact O-N 3.5Å; I758-V760 PolarHBondContact O-N 2.69Å; I758-I761 WeakPolarHBondContact O-CB 3.31Å; I758-I761 WeakPolarHBondContact O-CG1 3.31Å; I758-I761 PolarHBondContact O-N 2.81Å; I758-I764 HydrophobicContact CG2-CD1 4.3Å; I758-I764 HydrophobicContact CG2-CG1 4.13Å; I758-I764 WeakPolarHBondContact O-CG1 3.37Å
759	L	96.5	Very high	94.8	Very high	51 Å²	51	30 Å²	30	27%	0.267	16%	0.155	S	C	.	.	H	α-helix	trans	-67.4	-15.6	-177.7	-71.1	170.3	0	0	0	114.3	T632 L755 T756 I764 Q765 I768	T632-L759 HydrophobicContact CG2-CD2 4.09Å; L755-L759 HydrophobicContact CD1-CD1 4.3Å; L755-L759 HydrophobicContact CD1-CD2 4.42Å; L755-L759 HydrophobicContact CD1-CG 4.06Å; L755-L759 HydrophobicContact CG-CD1 3.93Å; L755-L759 HydrophobicContact CG-CG 4.19Å; L755-L759 WeakPolarHBondContact O-CG 3.49Å; L755-L759 PolarHBondContact O-N 3.49Å; T756-L759 PolarHBondContact O-N 3.04Å; L759-I764 HydrophobicContact CD2-CG2 4.28Å; L759-Q765 WeakPolarHBondContact O-CG 3.3Å; L759-Q765 PolarHBondContact O-NE2 2.75Å; L759-Q765 VanDerWaalsContact O-NE2 3.17Å; L759-I768 HydrophobicContact CD2-CD1 3.83Å
760	V	95.3	Very high	94.4	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.018	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-17.8	176.9	176.4	0	0	0	0	112.2	D547 Y550 L586 V589 S602 T756 I758 Q765	D547-V760 HydrophobicContact CB-CG1 3.61Å; Y550-V760 HydrophobicContact CD1-CB 4.32Å; Y550-V760 HydrophobicContact CD1-CG1 4.07Å; L586-V760 HydrophobicContact CB-CG2 4.39Å; L586-V760 HydrophobicContact CD1-CG2 4.4Å; L586-V760 HydrophobicContact CD2-CG2 4.09Å; V589-V760 HydrophobicContact CG1-CG2 4.46Å; S602-V760 WeakPolarHBondContact CB-O 3.19Å; S602-V760 PolarHBondContact OG-O 3.17Å; T756-V760 WeakPolarHBondContact O-CG2 3.35Å; I758-V760 PolarHBondContact O-N 2.69Å; V760-Q765 PolarHBondContact O-NE2 2.71Å
761	I	95.9	Very high	93.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	S	Bend	trans	-71	134	-174.1	-56.8	167.7	0	0	0	110.8	V604 L609 F629 I758 E763 I764 Q765	V604-I761 HydrophobicContact CG1-CG1 4.14Å; L609-I761 HydrophobicContact CD1-CD1 4.02Å; L609-I761 HydrophobicContact CD1-CG1 4.14Å; L609-I761 HydrophobicContact CD2-CD1 3.61Å; L609-I761 HydrophobicContact CD2-CG1 4.49Å; L609-I761 HydrophobicContact CG-CD1 4.48Å; F629-I761 HydrophobicContact CD2-CD1 3.7Å; F629-I761 HydrophobicContact CE2-CD1 3.61Å; F629-I761 HydrophobicContact CE2-CG2 4.21Å; I758-I761 WeakPolarHBondContact O-CB 3.31Å; I758-I761 WeakPolarHBondContact O-CG1 3.31Å; I758-I761 PolarHBondContact O-N 2.81Å; I761-E763 WeakPolarHBondContact CG2-OE2 3.13Å; I761-E763 PolarHBondContact O-N 2.85Å; I761-I764 HydrophobicContact CB-CB 4.33Å; I761-I764 HydrophobicContact CB-CG1 3.98Å; I761-I764 HydrophobicContact CG2-CG1 4.43Å; I761-I764 WeakPolarHBondContact O-CA 3.01Å; I761-I764 WeakPolarHBondContact O-CB 3.37Å; I761-I764 PolarHBondContact O-N 3.14Å; I761-Q765 PolarHBondContact O-N 3.18Å
762	R	94.4	Very high	93.1	Very high	30 Å²	30	29.3 Å²	29.3	11%	0.113	16%	0.164	C	C	.	.	H	α-helix	trans	-50	-53.3	-176.2	-171	-171.6	-60.2	164.3	6.5	112.7	P471 N472 P601 S602 V604 I764 Q765 E766	P471-R762 PolarHBondContact O-NH2 2.75Å; N472-R762 PolarHBondContact OD1-NH1 3.29Å; P601-R762 HydrophobicContact CB-CG 3.89Å; S602-R762 PolarHBondContact O-NE 3.37Å; S602-R762 PolarHBondContact O-NH2 2.95Å; V604-R762 WeakPolarHBondContact O-CB 3.45Å; V604-R762 PolarHBondContact O-N 3.42Å; R762-I764 PolarHBondContact O-N 2.98Å; R762-Q765 PolarHBondContact O-N 2.92Å; R762-E766 WeakPolarHBondContact CG-OE1 3.42Å; R762-E766 WeakPolarHBondContact O-CG 3.22Å; R762-E766 PolarHBondContact O-N 3.11Å
763	E	94.8	Very high	92.1	Very high	42 Å²	42	31.5 Å²	31.5	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-68.1	-19.2	-177.6	-60.9	88.5	151.6	0	0	113.2	T605 E606 I761 A767	T605-E763 WeakPolarHBondContact CA-OE2 3.14Å; T605-E763 WeakPolarHBondContact CB-OE1 3.41Å; E606-E763 HydrophobicContact CB-CG 4.29Å; E606-E763 WeakPolarHBondContact CB-OE1 3.45Å; E606-E763 PolarHBondContact N-OE1 3.18Å; E606-E763 PolarHBondContact N-OE2 3.19Å; I761-E763 WeakPolarHBondContact CG2-OE2 3.13Å; I761-E763 PolarHBondContact O-N 2.85Å; E763-A767 WeakPolarHBondContact O-CB 3.48Å; E763-A767 PolarHBondContact O-N 2.54Å
764	I	95.1	Very high	90.8	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-78.7	-45	170.9	-63	-63	0	0	0	109.9	F629 T632 K633 I758 L759 I761 R762 A767 I768	F629-I764 HydrophobicContact CD2-CD1 3.94Å; F629-I764 HydrophobicContact CD2-CG1 4.11Å; F629-I764 HydrophobicContact CE2-CD1 3.6Å; F629-I764 HydrophobicContact CE2-CG1 3.62Å; F629-I764 HydrophobicContact CZ-CD1 4.08Å; F629-I764 HydrophobicContact CZ-CG1 4.4Å; T632-I764 HydrophobicContact CG2-CD1 4.18Å; T632-I764 HydrophobicContact CG2-CG2 3.64Å; K633-I764 HydrophobicContact CB-CD1 3.5Å; K633-I764 HydrophobicContact CD-CD1 4.43Å; K633-I764 HydrophobicContact CG-CD1 3.94Å; I758-I764 HydrophobicContact CG2-CD1 4.3Å; I758-I764 HydrophobicContact CG2-CG1 4.13Å; I758-I764 WeakPolarHBondContact O-CG1 3.37Å; L759-I764 HydrophobicContact CD2-CG2 4.28Å; I761-I764 HydrophobicContact CB-CB 4.33Å; I761-I764 HydrophobicContact CB-CG1 3.98Å; I761-I764 HydrophobicContact CG2-CG1 4.43Å; I761-I764 WeakPolarHBondContact O-CA 3.01Å; I761-I764 WeakPolarHBondContact O-CB 3.37Å; I761-I764 PolarHBondContact O-N 3.14Å; R762-I764 PolarHBondContact O-N 2.98Å; I764-A767 PolarHBondContact O-N 3.25Å; I764-I768 HydrophobicContact CG2-CD1 3.73Å; I764-I768 HydrophobicContact CG2-CG1 4.45Å; I764-I768 VanDerWaalsContact O-CB 3.28Å; I764-I768 WeakPolarHBondContact O-CB 3.3Å; I764-I768 WeakPolarHBondContact O-CG1 3.29Å; I764-I768 PolarHBondContact O-N 3.07Å
765	Q	92.6	Very high	89	Confident	14 Å²	14	38.7 Å²	38.7	7%	0.065	23%	0.232	C	C	.	.	H	α-helix	trans	-63.4	-41.1	176.9	-64	-178.4	-3.5	0	0	111.7	P591 L759 V760 I761 R762 I768 A769	P591-Q765 HydrophobicContact CG-CB 4.42Å; P591-Q765 HydrophobicContact CG-CG 4.15Å; L759-Q765 WeakPolarHBondContact O-CG 3.3Å; L759-Q765 PolarHBondContact O-NE2 2.75Å; L759-Q765 VanDerWaalsContact O-NE2 3.17Å; V760-Q765 PolarHBondContact O-NE2 2.71Å; I761-Q765 PolarHBondContact O-N 3.18Å; R762-Q765 PolarHBondContact O-N 2.92Å; Q765-I768 PolarHBondContact O-N 2.69Å; Q765-A769 WeakPolarHBondContact O-CB 3.47Å; Q765-A769 PolarHBondContact O-N 3.19Å
766	E	90.8	Very high	86.7	Confident	98 Å²	98	46.4 Å²	46.4	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-60.7	-51.6	173.2	-71.7	168.6	-178.8	0	0	111.9	R762 I768 A769 V770	R762-E766 WeakPolarHBondContact CG-OE1 3.42Å; R762-E766 WeakPolarHBondContact O-CG 3.22Å; R762-E766 PolarHBondContact O-N 3.11Å; E766-I768 VanDerWaalsContact C-N 3.27Å; E766-I768 PolarHBondContact O-N 2.76Å; E766-A769 PolarHBondContact O-N 3.36Å; E766-A769 VanDerWaalsContact O-N 3.13Å; E766-V770 WeakPolarHBondContact O-CG2 3.42Å; E766-V770 PolarHBondContact O-N 2.9Å
767	A	90.8	Very high	84	Confident	26 Å²	26	56.6 Å²	56.6	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-37.7	177.5	0	0	0	0	0	112.3	K633 E763 I764 A771	K633-A767 HydrophobicContact CG-CB 4.47Å; E763-A767 WeakPolarHBondContact O-CB 3.48Å; E763-A767 PolarHBondContact O-N 2.54Å; I764-A767 PolarHBondContact O-N 3.25Å; A767-A771 VanDerWaalsContact O-CB 3.29Å; A767-A771 WeakPolarHBondContact O-CB 3.42Å; A767-A771 PolarHBondContact O-N 2.8Å; A767-A771 VanDerWaalsContact O-N 3.15Å
768	I	89.2	Confident	83.4	Confident	25 Å²	25	58.7 Å²	58.7	13%	0.128	33%	0.329	C	S	.	.	H	α-helix	trans	-64.9	-43.4	174.3	-76.5	173.2	0	0	0	111.5	K638 L759 I764 Q765 E766 N772	K638-I768 HydrophobicContact CD-CD1 4.04Å; K638-I768 HydrophobicContact CD-CG1 3.85Å; K638-I768 HydrophobicContact CD-CG2 4.11Å; K638-I768 HydrophobicContact CG-CD1 4.07Å; K638-I768 HydrophobicContact CG-CG1 4.16Å; L759-I768 HydrophobicContact CD2-CD1 3.83Å; I764-I768 HydrophobicContact CG2-CD1 3.73Å; I764-I768 HydrophobicContact CG2-CG1 4.45Å; I764-I768 VanDerWaalsContact O-CB 3.28Å; I764-I768 WeakPolarHBondContact O-CB 3.3Å; I764-I768 WeakPolarHBondContact O-CG1 3.29Å; I764-I768 PolarHBondContact O-N 3.07Å; Q765-I768 PolarHBondContact O-N 2.69Å; E766-I768 VanDerWaalsContact C-N 3.27Å; E766-I768 PolarHBondContact O-N 2.76Å; I768-N772 PolarHBondContact O-N 2.64Å; I768-N772 VanDerWaalsContact O-N 3.12Å; I768-N772 PolarHBondContact O-ND2 3.41Å; I768-N772 PolarHBondContact O-OD1 3.22Å
769	A	86.9	Confident	82.6	Confident	35 Å²	35	61.6 Å²	61.6	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-69.9	-46.4	-178.9	0	0	0	0	0	112.2	V599 Q765 E766 A771 N772 A773	V599-A769 HydrophobicContact CG2-CB 4.43Å; Q765-A769 WeakPolarHBondContact O-CB 3.47Å; Q765-A769 PolarHBondContact O-N 3.19Å; E766-A769 PolarHBondContact O-N 3.36Å; E766-A769 VanDerWaalsContact O-N 3.13Å; A769-A771 VanDerWaalsContact C-N 3.34Å; A769-A771 PolarHBondContact O-N 2.67Å; A769-N772 PolarHBondContact O-N 3.02Å; A769-A773 PolarHBondContact O-N 2.95Å
770	V	86.9	Confident	81.8	Confident	96 Å²	96	62.2 Å²	62.2	58%	0.582	35%	0.35	S	S	*	.	H	α-helix	trans	-58.2	-46.6	175.8	171.9	0	0	0	0	110.6	E766 N772 A773 S774	E766-V770 WeakPolarHBondContact O-CG2 3.42Å; E766-V770 PolarHBondContact O-N 2.9Å; V770-N772 VanDerWaalsContact C-N 3.33Å; V770-N772 PolarHBondContact O-N 3.29Å; V770-A773 PolarHBondContact O-N 2.74Å; V770-S774 PolarHBondContact O-N 3.3Å; V770-S774 PolarHBondContact O-OG 2.94Å
771	A	83.8	Confident	81	Confident	23 Å²	23	65.6 Å²	65.6	19%	0.19	37%	0.369	C	S	.	.	H	α-helix	trans	-63	-36.9	178.1	0	0	0	0	0	113.3	L636 A767 A769 T775	L636-A771 HydrophobicContact CD1-CB 3.49Å; L636-A771 VanDerWaalsContact CD1-CB 3.49Å; L636-A771 HydrophobicContact CD2-CB 4.06Å; L636-A771 HydrophobicContact CG-CB 4.43Å; A767-A771 VanDerWaalsContact O-CB 3.29Å; A767-A771 WeakPolarHBondContact O-CB 3.42Å; A767-A771 PolarHBondContact O-N 2.8Å; A767-A771 VanDerWaalsContact O-N 3.15Å; A769-A771 VanDerWaalsContact C-N 3.34Å; A769-A771 PolarHBondContact O-N 2.67Å; A771-T775 PolarHBondContact O-N 3.47Å; A771-T775 PolarHBondContact O-OG1 2.76Å
772	N	81.2	Confident	80.1	Confident	77 Å²	77	69.8 Å²	69.8	41%	0.412	39%	0.392	S	S	.	.	H	α-helix	trans	-67.4	-41	175	-68.9	-4.4	0	0	0	111.4	K638 I768 A769 V770 T775	K638-N772 PolarHBondContact NZ-OD1 2.89Å; I768-N772 PolarHBondContact O-N 2.64Å; I768-N772 VanDerWaalsContact O-N 3.12Å; I768-N772 PolarHBondContact O-ND2 3.41Å; I768-N772 PolarHBondContact O-OD1 3.22Å; A769-N772 PolarHBondContact O-N 3.02Å; V770-N772 VanDerWaalsContact C-N 3.33Å; V770-N772 PolarHBondContact O-N 3.29Å; N772-T775 WeakPolarHBondContact CA-OG1 3.47Å; N772-T775 PolarHBondContact O-N 3.17Å; N772-T775 VanDerWaalsContact O-N 3.1Å; N772-T775 PolarHBondContact O-OG1 2.96Å; N772-T775 VanDerWaalsContact O-OG1 3.09Å
773	A	76.9	Confident	79.2	Confident	55 Å²	55	72.4 Å²	72.4	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-63.2	-41.3	175.8	0	0	0	0	0	111.6	A769 V770 T775 M776	A769-A773 PolarHBondContact O-N 2.95Å; V770-A773 PolarHBondContact O-N 2.74Å; A773-T775 PolarHBondContact O-N 3.27Å; A773-T775 VanDerWaalsContact O-N 3.1Å; A773-M776 PolarHBondContact O-N 2.89Å
774	S	68.8	Low	78.1	Confident	85 Å²	85	74.6 Å²	74.6	59%	0.594	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	3.5	173	-54.3	0	0	0	0	115.1	V770	V770-S774 PolarHBondContact O-N 3.3Å; V770-S774 PolarHBondContact O-OG 2.94Å
775	T	60.2	Low	76.7	Confident	112 Å²	112	80.2 Å²	80.2	69%	0.687	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	6	171.4	22.3	0	0	0	0	114	A771 N772 A773	A771-T775 PolarHBondContact O-N 3.47Å; A771-T775 PolarHBondContact O-OG1 2.76Å; N772-T775 WeakPolarHBondContact CA-OG1 3.47Å; N772-T775 PolarHBondContact O-N 3.17Å; N772-T775 VanDerWaalsContact O-N 3.1Å; N772-T775 PolarHBondContact O-OG1 2.96Å; N772-T775 VanDerWaalsContact O-OG1 3.09Å; A773-T775 PolarHBondContact O-N 3.27Å; A773-T775 VanDerWaalsContact O-N 3.1Å
776	M	49.7	Very low	75.4	Confident	166 Å²	166	85.8 Å²	85.8	82%	0.818	49%	0.491	S	S	*	.			trans	-108	8.4	171.8	-65.7	-166	174	0	0	113.7	A773	A773-M776 PolarHBondContact O-N 2.89Å
777	H	40.2	Very low	74	Confident	231 Å²	231	84.6 Å²	84.6	100%	1.069	49%	0.494	S	S	*	.			trans	-124.2	0	175	-69.7	-58.8	0	0	0	110.2

Retrieved 777 of 777 residues in 436 ms (Link to these results)

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