G4V7X9_SCHMA Loading...

Adducin related protein

AlphaFold DB , UniProt , Accession G4V7X9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 779 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	38.7	Very low	252 Å²	252	155.7 Å²	155.7	100%	1.241	81%	0.806	S	S	*	*				0	103.2	0	-78.6	171.9	163.4	0	0	107.6
2	A	33.8	Very low	39.3	Very low	86 Å²	86	148.4 Å²	148.4	71%	0.711	77%	0.774	S	S	*	*			trans	-95.5	155.1	171	0	0	0	0	0	108.9
3	V	40.5	Very low	40.2	Very low	136 Å²	136	149.5 Å²	149.5	82%	0.824	77%	0.769	S	S	*	*			trans	-128.7	87.8	165.6	-177.8	0	0	0	0	106.5	V5	V3-V5 HydrophobicContact CG1-CG2 4.41Å
4	D	34.9	Very low	41.4	Very low	136 Å²	136	151.8 Å²	151.8	73%	0.727	77%	0.771	S	S	*	*			trans	-71.4	129.1	167.7	-77.7	-56.2	0	0	0	109.4
5	V	40.5	Very low	42.7	Very low	115 Å²	115	150.8 Å²	150.8	70%	0.697	77%	0.766	S	S	*	*			trans	-133.3	83.8	156.8	-174	0	0	0	0	108	V3 K7	V3-V5 HydrophobicContact CG1-CG2 4.41Å; V5-K7 PolarHBondContact O-N 2.62Å
6	H	36.9	Very low	43.8	Very low	170 Å²	170	148.7 Å²	148.7	79%	0.787	76%	0.757	S	S	*	*			trans	-57.7	125.3	158.1	-96.7	-99.7	0	0	0	108.9
7	K	37.5	Very low	44.7	Very low	181 Å²	181	148.9 Å²	148.9	79%	0.787	75%	0.747	S	S	*	*			trans	-130.3	99.6	156.2	-103.5	-176.2	175.5	179.2	0	108.7	V5 V9	V5-K7 PolarHBondContact O-N 2.62Å; K7-V9 PolarHBondContact O-N 3.44Å
8	E	34.6	Very low	45.4	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.864	72%	0.723	S	S	*	*			trans	-57.5	127.8	161.3	-65.3	178.3	119.5	0	0	108.4
9	V	42.4	Very low	46.2	Very low	104 Å²	104	141.6 Å²	141.6	63%	0.63	71%	0.712	S	S	*	*			trans	-122.4	103.7	168	176.4	0	0	0	0	107.4	K7	K7-V9 PolarHBondContact O-N 3.44Å
10	S	45.4	Very low	47.2	Very low	89 Å²	89	139.8 Å²	139.8	62%	0.622	71%	0.708	S	S	*	*			trans	-48.5	144.5	-176	-45.1	0	0	0	0	113.2	T12 R17	S10-T12 PolarHBondContact O-N 3.38Å; S10-R17 PolarHBondContact O-NH2 3.11Å; S10-R17 VanDerWaalsContact O-NH2 3.08Å
11	R	42.3	Very low	48.3	Very low	259 Å²	259	139.9 Å²	139.9	98%	0.977	71%	0.711	S	S	*	*			trans	-69.3	68.5	170.2	-74.9	178.6	168.3	166.6	-4.7	111.3
12	T	45.9	Very low	49.9	Very low	68 Å²	68	131.7 Å²	131.7	42%	0.417	67%	0.672	S	S	.	*			trans	-71.9	143.1	164.2	55.5	0	0	0	0	109.2	S10 R17	S10-T12 PolarHBondContact O-N 3.38Å; T12-R17 PolarHBondContact OG1-NE 2.99Å; T12-R17 PolarHBondContact OG1-NH2 3.18Å
13	K	51.3	Low	51.7	Low	162 Å²	162	133.4 Å²	133.4	70%	0.704	67%	0.665	S	S	*	*			trans	-63.4	146.3	-178.7	-67.2	173.5	-179.2	173	0	109.5	I15 D16	K13-I15 PolarHBondContact O-N 3.36Å; K13-I15 VanDerWaalsContact O-N 3.08Å; K13-D16 PolarHBondContact N-OD2 3.33Å; K13-D16 PolarHBondContact O-N 2.95Å
14	F	57	Low	53.2	Low	182 Å²	182	131.5 Å²	131.5	80%	0.798	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-57.5	-29.7	-173.2	-158.9	-88.5	0	0	0	113.1	D16 R17 I18	F14-D16 VanDerWaalsContact C-N 3.3Å; F14-D16 PolarHBondContact O-N 3.39Å; F14-R17 PolarHBondContact O-N 3.18Å; F14-I18 HydrophobicContact CD1-CD1 4.47Å
15	I	60	Low	55	Low	137 Å²	137	129.4 Å²	129.4	70%	0.703	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-62.2	-34.6	177.9	-62.5	166.4	0	0	0	111.7	K13 R17 I18	K13-I15 PolarHBondContact O-N 3.36Å; K13-I15 VanDerWaalsContact O-N 3.08Å; I15-R17 PolarHBondContact O-N 3.4Å; I15-I18 PolarHBondContact O-N 3.49Å
16	D	60.3	Low	56.6	Low	117 Å²	117	126.7 Å²	126.7	63%	0.626	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-78.7	-0.2	-172.9	-50.4	-34.9	0	0	0	113.6	K13 F14	K13-D16 PolarHBondContact N-OD2 3.33Å; K13-D16 PolarHBondContact O-N 2.95Å; F14-D16 VanDerWaalsContact C-N 3.3Å; F14-D16 PolarHBondContact O-N 3.39Å
17	R	59.9	Low	58.2	Low	153 Å²	153	124.8 Å²	124.8	58%	0.577	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-113.1	0.4	179	-65.1	-167.1	-171.4	177.6	8.1	114.4	S10 T12 F14 I15 D19	S10-R17 PolarHBondContact O-NH2 3.11Å; S10-R17 VanDerWaalsContact O-NH2 3.08Å; T12-R17 PolarHBondContact OG1-NE 2.99Å; T12-R17 PolarHBondContact OG1-NH2 3.18Å; F14-R17 PolarHBondContact O-N 3.18Å; I15-R17 PolarHBondContact O-N 3.4Å; R17-D19 PolarHBondContact O-N 2.97Å
18	I	56.5	Low	59.8	Low	61 Å²	61	120.4 Å²	120.4	31%	0.313	59%	0.585	S	S	.	*			trans	-85.9	93.1	178.5	-57.3	177.4	0	0	0	107.8	F14 I15 V20 Y25	F14-I18 HydrophobicContact CD1-CD1 4.47Å; I15-I18 PolarHBondContact O-N 3.49Å; I18-V20 PolarHBondContact O-N 2.8Å; I18-V20 VanDerWaalsContact O-N 3.12Å; I18-Y25 HydrophobicContact CG2-CD1 4.01Å; I18-Y25 HydrophobicContact CG2-CD2 4.47Å; I18-Y25 HydrophobicContact CG2-CE1 3.47Å; I18-Y25 VanDerWaalsContact CG2-CE1 3.47Å; I18-Y25 HydrophobicContact CG2-CE2 3.98Å; I18-Y25 HydrophobicContact CG2-CG 4.48Å; I18-Y25 VanDerWaalsContact CG2-CZ 3.45Å
19	D	61.3	Low	61.7	Low	98 Å²	98	116.8 Å²	116.8	52%	0.524	57%	0.571	S	S	.	*			trans	-70	104.1	164.8	-174.5	-3.8	0	0	0	108.6	R17 N21 N22	R17-D19 PolarHBondContact O-N 2.97Å; D19-N21 PolarHBondContact O-N 3.44Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 PolarHBondContact OD1-N 3.13Å; D19-N22 HydrophobicContact CB-CB 4.3Å; D19-N22 WeakPolarHBondContact O-CB 3.07Å; D19-N22 PolarHBondContact O-N 2.99Å; D19-N22 VanDerWaalsContact O-N 3.15Å
20	V	65.3	Low	63.3	Low	104 Å²	104	118.8 Å²	118.8	63%	0.63	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-20.9	-177	-174.6	0	0	0	0	111.7	I18	I18-V20 PolarHBondContact O-N 2.8Å; I18-V20 VanDerWaalsContact O-N 3.12Å
21	N	70.7	Confident	64.9	Low	143 Å²	143	117.4 Å²	117.4	77%	0.765	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-1.7	-179.2	-60.1	-42	0	0	0	114	D19 E23	D19-N21 PolarHBondContact O-N 3.44Å; D19-N21 VanDerWaalsContact O-N 3.15Å; D19-N21 PolarHBondContact OD1-N 3.13Å; N21-E23 PolarHBondContact O-N 3.33Å
22	N	71.7	Confident	66.7	Low	80 Å²	80	108.2 Å²	108.2	43%	0.428	53%	0.532	S	S	.	.			trans	-70.4	120.6	-178.9	-171.4	-13.3	0	0	0	110.7	D19 D24 Y25 T26	D19-N22 HydrophobicContact CB-CB 4.3Å; D19-N22 WeakPolarHBondContact O-CB 3.07Å; D19-N22 PolarHBondContact O-N 2.99Å; D19-N22 VanDerWaalsContact O-N 3.15Å; N22-D24 PolarHBondContact O-N 2.88Å; N22-D24 PolarHBondContact OD1-N 2.8Å; N22-Y25 PolarHBondContact O-N 3.03Å; N22-Y25 VanDerWaalsContact O-N 3.08Å; N22-T26 PolarHBondContact O-N 3Å; N22-T26 PolarHBondContact O-OG1 3.29Å
23	E	71.8	Confident	68.2	Low	122 Å²	122	109.6 Å²	109.6	57%	0.57	54%	0.543	S	S	*	.	H	α-helix	trans	-54.3	-38	-179.5	-75.1	-158.5	149.8	0	0	112.4	N21 T26 R27	N21-E23 PolarHBondContact O-N 3.33Å; E23-T26 WeakPolarHBondContact CA-OG1 3.47Å; E23-T26 PolarHBondContact O-N 3.41Å; E23-T26 PolarHBondContact O-OG1 2.94Å; E23-T26 VanDerWaalsContact O-OG1 3.07Å; E23-R27 WeakPolarHBondContact O-CB 3.49Å; E23-R27 WeakPolarHBondContact O-CG 3.47Å; E23-R27 PolarHBondContact O-N 3.28Å; E23-R27 IonicContact OE2-CZ 3.63Å; E23-R27 IonicContact OE2-NH1 2.75Å; E23-R27 IonicContact OE2-NH2 2.78Å; E23-R27 PolarHBondContact OE2-NH2 3.16Å
24	D	71	Confident	69.4	Low	95 Å²	95	107.8 Å²	107.8	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-74.1	-33.4	-178.7	-73.9	-23.3	0	0	0	111.6	N22 R27 E28	N22-D24 PolarHBondContact O-N 2.88Å; N22-D24 PolarHBondContact OD1-N 2.8Å; D24-R27 PolarHBondContact O-N 3.42Å; D24-R27 IonicContact OD1-NH1 2.69Å; D24-R27 PolarHBondContact OD1-NH1 3.2Å; D24-E28 VanDerWaalsContact O-CB 3.3Å; D24-E28 WeakPolarHBondContact O-CB 3.48Å; D24-E28 PolarHBondContact O-N 3Å
25	Y	72.4	Confident	70.4	Confident	93 Å²	93	103.5 Å²	103.5	37%	0.365	53%	0.525	S	S	.	.	H	α-helix	trans	-68.1	-39.2	173.2	-178.2	-105.9	0	0	0	111.8	I18 N22 E28 L29	I18-Y25 HydrophobicContact CG2-CD1 4.01Å; I18-Y25 HydrophobicContact CG2-CD2 4.47Å; I18-Y25 HydrophobicContact CG2-CE1 3.47Å; I18-Y25 VanDerWaalsContact CG2-CE1 3.47Å; I18-Y25 HydrophobicContact CG2-CE2 3.98Å; I18-Y25 HydrophobicContact CG2-CG 4.48Å; I18-Y25 VanDerWaalsContact CG2-CZ 3.45Å; N22-Y25 PolarHBondContact O-N 3.03Å; N22-Y25 VanDerWaalsContact O-N 3.08Å; Y25-E28 PolarHBondContact O-N 3.06Å; Y25-L29 HydrophobicContact CE1-CD1 3.85Å; Y25-L29 HydrophobicContact CE2-CD1 4.07Å; Y25-L29 PolarHBondContact O-N 3.34Å
26	T	73.7	Confident	71.4	Confident	57 Å²	57	100.7 Å²	100.7	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-39.2	174.6	35.8	0	0	0	0	112.2	N22 E23 E28 L29 L30	N22-T26 PolarHBondContact O-N 3Å; N22-T26 PolarHBondContact O-OG1 3.29Å; E23-T26 WeakPolarHBondContact CA-OG1 3.47Å; E23-T26 PolarHBondContact O-N 3.41Å; E23-T26 PolarHBondContact O-OG1 2.94Å; E23-T26 VanDerWaalsContact O-OG1 3.07Å; T26-E28 VanDerWaalsContact C-N 3.35Å; T26-L29 PolarHBondContact O-N 2.94Å; T26-L30 WeakPolarHBondContact O-CB 3.23Å; T26-L30 VanDerWaalsContact O-CG 3.3Å; T26-L30 WeakPolarHBondContact O-CG 3.03Å; T26-L30 PolarHBondContact O-N 2.94Å
27	R	72.1	Confident	72.4	Confident	130 Å²	130	101.1 Å²	101.1	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-60.4	-41.7	169	-75.7	171.2	-176.3	143.5	10.7	112	E23 D24 R31	E23-R27 WeakPolarHBondContact O-CB 3.49Å; E23-R27 WeakPolarHBondContact O-CG 3.47Å; E23-R27 PolarHBondContact O-N 3.28Å; E23-R27 IonicContact OE2-CZ 3.63Å; E23-R27 IonicContact OE2-NH1 2.75Å; E23-R27 IonicContact OE2-NH2 2.78Å; E23-R27 PolarHBondContact OE2-NH2 3.16Å; D24-R27 PolarHBondContact O-N 3.42Å; D24-R27 IonicContact OD1-NH1 2.69Å; D24-R27 PolarHBondContact OD1-NH1 3.2Å; R27-R31 WeakPolarHBondContact O-CB 3.44Å; R27-R31 PolarHBondContact O-N 3.01Å
28	E	70.4	Confident	73.4	Confident	90 Å²	90	98.4 Å²	98.4	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-41.5	174.6	-152.1	85.7	-114.7	0	0	110.2	D24 Y25 T26 R31 K36	D24-E28 VanDerWaalsContact O-CB 3.3Å; D24-E28 WeakPolarHBondContact O-CB 3.48Å; D24-E28 PolarHBondContact O-N 3Å; Y25-E28 PolarHBondContact O-N 3.06Å; T26-E28 VanDerWaalsContact C-N 3.35Å; E28-R31 IonicContact OE1-CZ 2.89Å; E28-R31 IonicContact OE1-NH1 3.1Å; E28-R31 PolarHBondContact OE1-NH1 2.88Å; E28-R31 IonicContact OE1-NH2 3.6Å; E28-R31 PolarHBondContact OE1-NH2 2.91Å; E28-K36 WeakPolarHBondContact O-CE 3.49Å; E28-K36 PolarHBondContact O-NZ 3.43Å
29	L	73.4	Confident	74.6	Confident	108 Å²	108	97.3 Å²	97.3	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-62	-47.8	176.8	-125.4	78.4	0	0	0	112.1	Y25 T26 R31 K36	Y25-L29 HydrophobicContact CE1-CD1 3.85Å; Y25-L29 HydrophobicContact CE2-CD1 4.07Å; Y25-L29 PolarHBondContact O-N 3.34Å; T26-L29 PolarHBondContact O-N 2.94Å; L29-R31 VanDerWaalsContact C-N 3.35Å; L29-R31 PolarHBondContact O-N 3.42Å; L29-K36 PolarHBondContact O-NZ 3.3Å
30	L	76.1	Confident	75.6	Confident	147 Å²	147	98.9 Å²	98.9	77%	0.77	50%	0.501	S	S	*	.	H	α-helix	trans	-75.1	-17.3	-175.8	-69.3	168	0	0	0	114.1	T26 P32	T26-L30 WeakPolarHBondContact O-CB 3.23Å; T26-L30 VanDerWaalsContact O-CG 3.3Å; T26-L30 WeakPolarHBondContact O-CG 3.03Å; T26-L30 PolarHBondContact O-N 2.94Å; L30-P32 WeakPolarHBondContact O-CD 3.46Å
31	R	79.6	Confident	76.4	Confident	59 Å²	59	96.9 Å²	96.9	22%	0.223	49%	0.487	C	S	.	.	S	Bend	trans	-66	122.4	-179.7	-170.3	-176.8	-57.4	145.8	15.9	110.7	R27 E28 L29 I35 K36	R27-R31 WeakPolarHBondContact O-CB 3.44Å; R27-R31 PolarHBondContact O-N 3.01Å; E28-R31 IonicContact OE1-CZ 2.89Å; E28-R31 IonicContact OE1-NH1 3.1Å; E28-R31 PolarHBondContact OE1-NH1 2.88Å; E28-R31 IonicContact OE1-NH2 3.6Å; E28-R31 PolarHBondContact OE1-NH2 2.91Å; L29-R31 VanDerWaalsContact C-N 3.35Å; L29-R31 PolarHBondContact O-N 3.42Å; R31-I35 HydrophobicContact CG-CB 3.71Å; R31-I35 HydrophobicContact CG-CG2 3.81Å; R31-K36 HydrophobicContact CB-CG 4.06Å; R31-K36 HydrophobicContact CG-CG 3.97Å; R31-K36 VanDerWaalsContact O-CE 3.25Å; R31-K36 WeakPolarHBondContact O-CE 3.23Å; R31-K36 PolarHBondContact O-NZ 2.94Å; R31-K36 VanDerWaalsContact O-NZ 3.17Å
32	P	80.4	Confident	76.8	Confident	66 Å²	66	95.5 Å²	95.5	43%	0.429	48%	0.477	S	S	.	.			trans	-55.3	155.4	176.4	-26.8	34.7	0	0	0	113.1	L30 D34 I35 K36	L30-P32 WeakPolarHBondContact O-CD 3.46Å; P32-D34 VanDerWaalsContact C-N 3.33Å; P32-D34 PolarHBondContact O-N 3.33Å; P32-I35 HydrophobicContact CB-CG1 4.4Å; P32-I35 HydrophobicContact CG-CD1 4.2Å; P32-I35 PolarHBondContact O-N 2.87Å; P32-I35 VanDerWaalsContact O-N 3.15Å; P32-K36 PolarHBondContact O-N 2.78Å
33	P	78.1	Confident	77.2	Confident	98 Å²	98	97.5 Å²	97.5	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-52.1	-49.1	-177.8	-25.7	34.8	0	0	0	112.8	I35 K36 E37	P33-I35 VanDerWaalsContact C-N 3.28Å; P33-I35 PolarHBondContact O-N 3.5Å; P33-K36 WeakPolarHBondContact O-CB 3.39Å; P33-K36 PolarHBondContact O-N 2.83Å; P33-E37 PolarHBondContact O-N 3.41Å
34	D	76.4	Confident	77.6	Confident	124 Å²	124	95.9 Å²	95.9	66%	0.663	48%	0.476	S	S	*	.	H	α-helix	trans	-57.7	-39.8	-177.7	-45.5	0.5	0	0	0	112	P32 E37 D38	P32-D34 VanDerWaalsContact C-N 3.33Å; P32-D34 PolarHBondContact O-N 3.33Å; D34-E37 PolarHBondContact O-N 2.85Å; D34-D38 PolarHBondContact O-N 3.31Å
35	I	78.3	Confident	77.9	Confident	91 Å²	91	99.2 Å²	99.2	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-79.3	-29.9	-179.7	-47.8	-175.1	0	0	0	110.8	R31 P32 P33 V39	R31-I35 HydrophobicContact CG-CB 3.71Å; R31-I35 HydrophobicContact CG-CG2 3.81Å; P32-I35 HydrophobicContact CB-CG1 4.4Å; P32-I35 HydrophobicContact CG-CD1 4.2Å; P32-I35 PolarHBondContact O-N 2.87Å; P32-I35 VanDerWaalsContact O-N 3.15Å; P33-I35 VanDerWaalsContact C-N 3.28Å; P33-I35 PolarHBondContact O-N 3.5Å; I35-V39 WeakPolarHBondContact O-CB 3.37Å; I35-V39 VanDerWaalsContact O-CG2 3.27Å; I35-V39 WeakPolarHBondContact O-CG2 3.44Å; I35-V39 PolarHBondContact O-N 3Å
36	K	79.5	Confident	78.2	Confident	79 Å²	79	98.2 Å²	98.2	34%	0.343	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-43.8	169.6	-78.1	174.1	171.1	150.5	0	111.2	E28 L29 R31 P32 P33 K40	E28-K36 WeakPolarHBondContact O-CE 3.49Å; E28-K36 PolarHBondContact O-NZ 3.43Å; L29-K36 PolarHBondContact O-NZ 3.3Å; R31-K36 HydrophobicContact CB-CG 4.06Å; R31-K36 HydrophobicContact CG-CG 3.97Å; R31-K36 VanDerWaalsContact O-CE 3.25Å; R31-K36 WeakPolarHBondContact O-CE 3.23Å; R31-K36 PolarHBondContact O-NZ 2.94Å; R31-K36 VanDerWaalsContact O-NZ 3.17Å; P32-K36 PolarHBondContact O-N 2.78Å; P33-K36 WeakPolarHBondContact O-CB 3.39Å; P33-K36 PolarHBondContact O-N 2.83Å; K36-K40 WeakPolarHBondContact O-CB 3.4Å; K36-K40 PolarHBondContact O-N 3.25Å
37	E	81.5	Confident	78.5	Confident	126 Å²	126	104.6 Å²	104.6	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-64.5	-45.8	178	-170.1	167.2	-163.9	0	0	111.3	P33 D34 V39 K40 L41	P33-E37 PolarHBondContact O-N 3.41Å; D34-E37 PolarHBondContact O-N 2.85Å; E37-V39 PolarHBondContact O-N 2.97Å; E37-K40 WeakPolarHBondContact O-CB 3.46Å; E37-K40 PolarHBondContact O-N 3.3Å; E37-L41 HydrophobicContact CG-CD1 4.1Å; E37-L41 WeakPolarHBondContact O-CB 3.28Å; E37-L41 WeakPolarHBondContact O-CG 3.44Å; E37-L41 PolarHBondContact O-N 3.21Å
38	D	81.4	Confident	78.7	Confident	96 Å²	96	102.3 Å²	102.3	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-66.4	-36.2	178.2	-161.8	38.4	0	0	0	112.8	D34 L41 M42	D34-D38 PolarHBondContact O-N 3.31Å; D38-L41 PolarHBondContact O-N 3.19Å; D38-M42 VanDerWaalsContact O-CB 3.26Å; D38-M42 WeakPolarHBondContact O-CB 3.41Å; D38-M42 PolarHBondContact O-N 2.92Å
39	V	81.8	Confident	79.1	Confident	38 Å²	38	100.1 Å²	100.1	23%	0.23	50%	0.501	C	S	.	.	H	α-helix	trans	-64.8	-39.8	171.9	170.5	0	0	0	0	111.6	I35 E37 M42 Q43	I35-V39 WeakPolarHBondContact O-CB 3.37Å; I35-V39 VanDerWaalsContact O-CG2 3.27Å; I35-V39 WeakPolarHBondContact O-CG2 3.44Å; I35-V39 PolarHBondContact O-N 3Å; E37-V39 PolarHBondContact O-N 2.97Å; V39-M42 PolarHBondContact O-N 3.11Å; V39-Q43 WeakPolarHBondContact O-CG 3.32Å; V39-Q43 PolarHBondContact O-N 2.95Å
40	K	82.1	Confident	79.4	Confident	130 Å²	130	101.1 Å²	101.1	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-47.6	175.2	-174.2	-172.3	172.8	-159.9	0	111	K36 E37 M42 Q43 E44	K36-K40 WeakPolarHBondContact O-CB 3.4Å; K36-K40 PolarHBondContact O-N 3.25Å; E37-K40 WeakPolarHBondContact O-CB 3.46Å; E37-K40 PolarHBondContact O-N 3.3Å; K40-M42 VanDerWaalsContact C-N 3.3Å; K40-M42 PolarHBondContact O-N 2.98Å; K40-Q43 PolarHBondContact O-N 2.62Å; K40-Q43 VanDerWaalsContact O-N 3.16Å; K40-E44 VanDerWaalsContact CE-OE1 3.23Å; K40-E44 WeakPolarHBondContact CE-OE1 3.31Å; K40-E44 WeakPolarHBondContact O-CG 3.26Å; K40-E44 PolarHBondContact O-N 3.42Å
41	L	81.1	Confident	79.6	Confident	63 Å²	63	98.5 Å²	98.5	33%	0.33	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-36.1	175	-71.9	170.5	0	0	0	112.1	E37 D38 E44 R45	E37-L41 HydrophobicContact CG-CD1 4.1Å; E37-L41 WeakPolarHBondContact O-CB 3.28Å; E37-L41 WeakPolarHBondContact O-CG 3.44Å; E37-L41 PolarHBondContact O-N 3.21Å; D38-L41 PolarHBondContact O-N 3.19Å; L41-E44 PolarHBondContact O-N 3.19Å; L41-R45 VanDerWaalsContact O-CB 3.27Å; L41-R45 WeakPolarHBondContact O-CB 3.45Å; L41-R45 WeakPolarHBondContact O-CD 3.47Å; L41-R45 WeakPolarHBondContact O-CG 3.37Å; L41-R45 PolarHBondContact O-N 3.46Å
42	M	79.5	Confident	79.5	Confident	113 Å²	113	101.4 Å²	101.4	56%	0.557	51%	0.511	S	S	*	.	H	α-helix	trans	-64.5	-44.1	173.3	-176.6	-173.9	66.5	0	0	111.6	D38 V39 K40 S46	D38-M42 VanDerWaalsContact O-CB 3.26Å; D38-M42 WeakPolarHBondContact O-CB 3.41Å; D38-M42 PolarHBondContact O-N 2.92Å; V39-M42 PolarHBondContact O-N 3.11Å; K40-M42 VanDerWaalsContact C-N 3.3Å; K40-M42 PolarHBondContact O-N 2.98Å; M42-S46 WeakPolarHBondContact O-CB 3.2Å; M42-S46 PolarHBondContact O-N 3Å
43	Q	81.3	Confident	79.4	Confident	123 Å²	123	108.2 Å²	108.2	58%	0.575	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-41.1	175.5	-71.1	-177.4	8.2	0	0	111.9	V39 K40 S46 R47	V39-Q43 WeakPolarHBondContact O-CG 3.32Å; V39-Q43 PolarHBondContact O-N 2.95Å; K40-Q43 PolarHBondContact O-N 2.62Å; K40-Q43 VanDerWaalsContact O-N 3.16Å; Q43-S46 WeakPolarHBondContact O-CB 3.42Å; Q43-S46 PolarHBondContact O-N 3.2Å; Q43-R47 WeakPolarHBondContact O-CG 3.43Å; Q43-R47 PolarHBondContact O-N 3.5Å
44	E	79.3	Confident	79.8	Confident	88 Å²	88	105.6 Å²	105.6	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-47.1	175.3	-72.9	175.7	-174	0	0	111.7	K40 L41 S46 R47 V48	K40-E44 VanDerWaalsContact CE-OE1 3.23Å; K40-E44 WeakPolarHBondContact CE-OE1 3.31Å; K40-E44 WeakPolarHBondContact O-CG 3.26Å; K40-E44 PolarHBondContact O-N 3.42Å; L41-E44 PolarHBondContact O-N 3.19Å; E44-S46 VanDerWaalsContact C-N 3.27Å; E44-S46 PolarHBondContact O-N 3.34Å; E44-R47 PolarHBondContact O-N 3.21Å; E44-R47 VanDerWaalsContact O-N 3.15Å; E44-V48 WeakPolarHBondContact O-CG2 3.33Å; E44-V48 PolarHBondContact O-N 3.08Å
45	R	78	Confident	80.1	Confident	165 Å²	165	103.1 Å²	103.1	62%	0.623	51%	0.509	S	S	*	.	H	α-helix	trans	-57.6	-38.6	172.3	-74.7	168.3	178.6	165	3	111.9	L41 S49	L41-R45 VanDerWaalsContact O-CB 3.27Å; L41-R45 WeakPolarHBondContact O-CB 3.45Å; L41-R45 WeakPolarHBondContact O-CD 3.47Å; L41-R45 WeakPolarHBondContact O-CG 3.37Å; L41-R45 PolarHBondContact O-N 3.46Å; R45-S49 VanDerWaalsContact O-CB 3.28Å; R45-S49 WeakPolarHBondContact O-CB 3.24Å; R45-S49 PolarHBondContact O-N 2.91Å
46	S	78.8	Confident	80.3	Confident	72 Å²	72	107 Å²	107	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-45.3	175.1	-171.7	0	0	0	0	111.9	M42 Q43 E44 S49 L50	M42-S46 WeakPolarHBondContact O-CB 3.2Å; M42-S46 PolarHBondContact O-N 3Å; Q43-S46 WeakPolarHBondContact O-CB 3.42Å; Q43-S46 PolarHBondContact O-N 3.2Å; E44-S46 VanDerWaalsContact C-N 3.27Å; E44-S46 PolarHBondContact O-N 3.34Å; S46-S49 WeakPolarHBondContact O-CB 3.32Å; S46-S49 PolarHBondContact O-N 2.77Å; S46-L50 PolarHBondContact O-N 3.12Å
47	R	79.9	Confident	80.5	Confident	190 Å²	190	106.8 Å²	106.8	72%	0.717	52%	0.518	S	S	*	.	H	α-helix	trans	-62.5	-43.7	175.5	-67.6	175.4	82.8	102.2	0.4	112.1	Q43 E44 L50 I51	Q43-R47 WeakPolarHBondContact O-CG 3.43Å; Q43-R47 PolarHBondContact O-N 3.5Å; E44-R47 PolarHBondContact O-N 3.21Å; E44-R47 VanDerWaalsContact O-N 3.15Å; R47-L50 WeakPolarHBondContact O-CB 3.44Å; R47-L50 PolarHBondContact O-N 2.89Å; R47-I51 WeakPolarHBondContact O-CG1 3.36Å; R47-I51 PolarHBondContact O-N 2.83Å
48	V	76	Confident	80.4	Confident	82 Å²	82	108.8 Å²	108.8	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-43.4	175.9	173.6	0	0	0	0	111.1	E44 L50 I51 L52	E44-V48 WeakPolarHBondContact O-CG2 3.33Å; E44-V48 PolarHBondContact O-N 3.08Å; V48-L50 VanDerWaalsContact C-N 3.29Å; V48-L50 PolarHBondContact O-N 3.45Å; V48-I51 PolarHBondContact O-N 2.94Å; V48-L52 HydrophobicContact CG1-CD1 3.92Å; V48-L52 HydrophobicContact CG1-CG 4.32Å; V48-L52 WeakPolarHBondContact O-CG 3.48Å; V48-L52 PolarHBondContact O-N 3.05Å
49	S	78.8	Confident	80.5	Confident	44 Å²	44	111.5 Å²	111.5	31%	0.308	53%	0.528	S	S	.	.	H	α-helix	trans	-58.3	-40.4	173.8	-176.4	0	0	0	0	112.1	R45 S46 L52 R53	R45-S49 VanDerWaalsContact O-CB 3.28Å; R45-S49 WeakPolarHBondContact O-CB 3.24Å; R45-S49 PolarHBondContact O-N 2.91Å; S46-S49 WeakPolarHBondContact O-CB 3.32Å; S46-S49 PolarHBondContact O-N 2.77Å; S49-L52 PolarHBondContact O-N 3.46Å; S49-R53 WeakPolarHBondContact O-CB 3.35Å; S49-R53 VanDerWaalsContact O-CG 3.26Å; S49-R53 WeakPolarHBondContact O-CG 3.25Å; S49-R53 PolarHBondContact O-N 3.01Å
50	L	80.3	Confident	80.5	Confident	129 Å²	129	114.1 Å²	114.1	68%	0.675	54%	0.537	S	S	*	.	H	α-helix	trans	-67.2	-38.7	177.5	-146.4	113.5	0	0	0	112.4	S46 R47 V48 R53 S54	S46-L50 PolarHBondContact O-N 3.12Å; R47-L50 WeakPolarHBondContact O-CB 3.44Å; R47-L50 PolarHBondContact O-N 2.89Å; V48-L50 VanDerWaalsContact C-N 3.29Å; V48-L50 PolarHBondContact O-N 3.45Å; L50-R53 PolarHBondContact O-N 3.34Å; L50-S54 PolarHBondContact O-N 3.09Å
51	I	80	Confident	80.3	Confident	93 Å²	93	111.9 Å²	111.9	48%	0.477	53%	0.531	S	S	.	.	H	α-helix	trans	-67.4	-45.7	174.9	-67.1	166.3	0	0	0	110.9	R47 V48 R53 S54 F57	R47-I51 WeakPolarHBondContact O-CG1 3.36Å; R47-I51 PolarHBondContact O-N 2.83Å; V48-I51 PolarHBondContact O-N 2.94Å; I51-R53 PolarHBondContact O-N 2.89Å; I51-S54 WeakPolarHBondContact O-CB 3.48Å; I51-S54 PolarHBondContact O-N 2.73Å; I51-F57 HydrophobicContact CG2-CD1 4.14Å; I51-F57 HydrophobicContact CG2-CD2 4.24Å; I51-F57 HydrophobicContact CG2-CE1 4.39Å; I51-F57 HydrophobicContact CG2-CE2 4.48Å; I51-F57 HydrophobicContact CG2-CG 4.06Å
52	L	76.3	Confident	80.2	Confident	120 Å²	120	114 Å²	114	63%	0.628	54%	0.54	S	S	*	.	H	α-helix	trans	-65.1	-27.2	177.5	-68.9	174.2	0	0	0	112.9	V48 S49 F57	V48-L52 HydrophobicContact CG1-CD1 3.92Å; V48-L52 HydrophobicContact CG1-CG 4.32Å; V48-L52 WeakPolarHBondContact O-CG 3.48Å; V48-L52 PolarHBondContact O-N 3.05Å; S49-L52 PolarHBondContact O-N 3.46Å; L52-F57 HydrophobicContact CD2-CE1 4.19Å
53	R	79.6	Confident	80.3	Confident	208 Å²	208	116.2 Å²	116.2	79%	0.785	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-8.5	172.1	-70.5	174.7	179	-172.3	0.3	113.7	S49 L50 I51 A55	S49-R53 WeakPolarHBondContact O-CB 3.35Å; S49-R53 VanDerWaalsContact O-CG 3.26Å; S49-R53 WeakPolarHBondContact O-CG 3.25Å; S49-R53 PolarHBondContact O-N 3.01Å; L50-R53 PolarHBondContact O-N 3.34Å; I51-R53 PolarHBondContact O-N 2.89Å; R53-A55 PolarHBondContact O-N 2.9Å
54	S	84.9	Confident	80.2	Confident	44 Å²	44	115 Å²	115	31%	0.308	54%	0.543	S	S	.	.			trans	-67.4	117.8	-179.9	177.9	0	0	0	0	111.4	L50 I51 Y56 F57 R58	L50-S54 PolarHBondContact O-N 3.09Å; I51-S54 WeakPolarHBondContact O-CB 3.48Å; I51-S54 PolarHBondContact O-N 2.73Å; S54-Y56 PolarHBondContact O-N 3.06Å; S54-Y56 PolarHBondContact OG-N 2.86Å; S54-F57 PolarHBondContact O-N 3.4Å; S54-F57 PolarHBondContact OG-N 3.49Å; S54-R58 PolarHBondContact O-N 2.98Å
55	A	84.4	Confident	80	Confident	71 Å²	71	113.9 Å²	113.9	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-61.9	-24	174.1	0	0	0	0	0	112.8	R53 K59	R53-A55 PolarHBondContact O-N 2.9Å; A55-K59 WeakPolarHBondContact O-CG 3.29Å; A55-K59 PolarHBondContact O-N 3.13Å
56	Y	82.3	Confident	79.9	Confident	172 Å²	172	108.7 Å²	108.7	68%	0.675	53%	0.534	S	S	*	.	H	α-helix	trans	-71.3	-53.1	174.2	-172	-85.2	0	0	0	110.9	S54 R58 K59 E60	S54-Y56 PolarHBondContact O-N 3.06Å; S54-Y56 PolarHBondContact OG-N 2.86Å; Y56-R58 VanDerWaalsContact C-N 3.28Å; Y56-R58 PolarHBondContact O-N 2.85Å; Y56-K59 PolarHBondContact O-N 2.98Å; Y56-K59 VanDerWaalsContact O-N 3.12Å; Y56-E60 PolarHBondContact O-N 2.93Å
57	F	82.1	Confident	79.7	Confident	75 Å²	75	108.6 Å²	108.6	33%	0.329	53%	0.533	S	S	.	.	H	α-helix	trans	-56.3	-43.5	177.6	-179.7	-111.5	0	0	0	111.3	I51 L52 S54 K59 E60 L61	I51-F57 HydrophobicContact CG2-CD1 4.14Å; I51-F57 HydrophobicContact CG2-CD2 4.24Å; I51-F57 HydrophobicContact CG2-CE1 4.39Å; I51-F57 HydrophobicContact CG2-CE2 4.48Å; I51-F57 HydrophobicContact CG2-CG 4.06Å; L52-F57 HydrophobicContact CD2-CE1 4.19Å; S54-F57 PolarHBondContact O-N 3.4Å; S54-F57 PolarHBondContact OG-N 3.49Å; F57-K59 PolarHBondContact O-N 3.05Å; F57-E60 PolarHBondContact O-N 3.09Å; F57-L61 HydrophobicContact CE1-CD1 3.74Å; F57-L61 HydrophobicContact CE2-CD1 4.46Å; F57-L61 HydrophobicContact CZ-CD1 3.72Å; F57-L61 WeakPolarHBondContact O-CB 3.31Å; F57-L61 PolarHBondContact O-N 3.16Å
58	R	81.2	Confident	79.1	Confident	168 Å²	168	100.2 Å²	100.2	63%	0.634	50%	0.503	S	S	*	.	H	α-helix	trans	-59	-46.8	175.9	-171.6	175	-176.7	151.5	5.1	112.9	S54 Y56 E60 L61 E62	S54-R58 PolarHBondContact O-N 2.98Å; Y56-R58 VanDerWaalsContact C-N 3.28Å; Y56-R58 PolarHBondContact O-N 2.85Å; R58-E60 VanDerWaalsContact C-N 3.34Å; R58-E60 PolarHBondContact O-N 3.29Å; R58-L61 PolarHBondContact O-N 3.46Å; R58-E62 IonicContact NE-OE1 3.29Å; R58-E62 PolarHBondContact NE-OE1 3.22Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 VanDerWaalsContact O-CG 3.31Å; R58-E62 WeakPolarHBondContact O-CG 3.42Å; R58-E62 PolarHBondContact O-N 3.07Å
59	K	82.5	Confident	78.9	Confident	154 Å²	154	102.4 Å²	102.4	67%	0.67	51%	0.512	S	S	*	.	H	α-helix	trans	-64.5	-37.1	177	-79.3	178.6	176.5	179.9	0	112.6	A55 Y56 F57 K63	A55-K59 WeakPolarHBondContact O-CG 3.29Å; A55-K59 PolarHBondContact O-N 3.13Å; Y56-K59 PolarHBondContact O-N 2.98Å; Y56-K59 VanDerWaalsContact O-N 3.12Å; F57-K59 PolarHBondContact O-N 3.05Å; K59-K63 WeakPolarHBondContact O-CB 3.36Å; K59-K63 PolarHBondContact O-N 2.95Å
60	E	82.1	Confident	78.6	Confident	93 Å²	93	109.4 Å²	109.4	44%	0.435	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-42.8	179	-156.9	174.7	-162.5	0	0	111.4	Y56 F57 R58 K63 I64	Y56-E60 PolarHBondContact O-N 2.93Å; F57-E60 PolarHBondContact O-N 3.09Å; R58-E60 VanDerWaalsContact C-N 3.34Å; R58-E60 PolarHBondContact O-N 3.29Å; E60-K63 WeakPolarHBondContact O-CB 3.3Å; E60-K63 PolarHBondContact O-N 3.49Å; E60-K63 VanDerWaalsContact O-N 3.15Å; E60-I64 WeakPolarHBondContact O-CG1 3.48Å; E60-I64 PolarHBondContact O-N 2.83Å
61	L	77.5	Confident	77.5	Confident	83 Å²	83	106.8 Å²	106.8	44%	0.435	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-42.6	175.7	-152.7	160.3	0	0	0	111.3	F57 R58 K63 I64 V65	F57-L61 HydrophobicContact CE1-CD1 3.74Å; F57-L61 HydrophobicContact CE2-CD1 4.46Å; F57-L61 HydrophobicContact CZ-CD1 3.72Å; F57-L61 WeakPolarHBondContact O-CB 3.31Å; F57-L61 PolarHBondContact O-N 3.16Å; R58-L61 PolarHBondContact O-N 3.46Å; L61-K63 VanDerWaalsContact C-N 3.3Å; L61-K63 PolarHBondContact O-N 3.2Å; L61-I64 PolarHBondContact O-N 3.19Å; L61-V65 HydrophobicContact CD2-CG2 3.85Å; L61-V65 WeakPolarHBondContact O-CB 3.12Å; L61-V65 WeakPolarHBondContact O-CG2 3.2Å; L61-V65 PolarHBondContact O-N 3.43Å
62	E	80	Confident	76.1	Confident	108 Å²	108	105.6 Å²	105.6	51%	0.505	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-38.7	171.4	-77	171.7	-169.1	0	0	112	R58 A66	R58-E62 IonicContact NE-OE1 3.29Å; R58-E62 PolarHBondContact NE-OE1 3.22Å; R58-E62 WeakPolarHBondContact O-CB 3.4Å; R58-E62 VanDerWaalsContact O-CG 3.31Å; R58-E62 WeakPolarHBondContact O-CG 3.42Å; R58-E62 PolarHBondContact O-N 3.07Å; E62-A66 WeakPolarHBondContact O-CB 3.49Å; E62-A66 PolarHBondContact O-N 2.82Å
63	K	81.7	Confident	74.9	Confident	159 Å²	159	103.4 Å²	103.4	69%	0.691	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-42.9	176.6	-166.7	-177.1	-174	-171.8	0	112.3	K59 E60 L61 A66 S67	K59-K63 WeakPolarHBondContact O-CB 3.36Å; K59-K63 PolarHBondContact O-N 2.95Å; E60-K63 WeakPolarHBondContact O-CB 3.3Å; E60-K63 PolarHBondContact O-N 3.49Å; E60-K63 VanDerWaalsContact O-N 3.15Å; L61-K63 VanDerWaalsContact C-N 3.3Å; L61-K63 PolarHBondContact O-N 3.2Å; K63-A66 PolarHBondContact O-N 3.38Å; K63-S67 PolarHBondContact O-N 3.09Å; K63-S67 PolarHBondContact O-OG 2.9Å
64	I	79	Confident	73.9	Confident	98 Å²	98	97.9 Å²	97.9	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-68.3	-41.2	178.6	-67	164.8	0	0	0	111.5	E60 L61 S67 S68	E60-I64 WeakPolarHBondContact O-CG1 3.48Å; E60-I64 PolarHBondContact O-N 2.83Å; L61-I64 PolarHBondContact O-N 3.19Å; I64-S67 WeakPolarHBondContact CA-OG 3.42Å; I64-S67 PolarHBondContact O-N 3.24Å; I64-S67 PolarHBondContact O-OG 3.01Å; I64-S68 WeakPolarHBondContact O-CB 3.35Å; I64-S68 PolarHBondContact O-N 3.33Å; I64-S68 PolarHBondContact O-OG 2.82Å
65	V	73.9	Confident	72.9	Confident	63 Å²	63	100.6 Å²	100.6	38%	0.382	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-43.3	175.1	169.8	0	0	0	0	110	L61 S67 S68 L69	L61-V65 HydrophobicContact CD2-CG2 3.85Å; L61-V65 WeakPolarHBondContact O-CB 3.12Å; L61-V65 WeakPolarHBondContact O-CG2 3.2Å; L61-V65 PolarHBondContact O-N 3.43Å; V65-S67 PolarHBondContact O-N 2.89Å; V65-S68 PolarHBondContact O-N 3.27Å; V65-L69 HydrophobicContact CG1-CD1 3.75Å; V65-L69 WeakPolarHBondContact O-CB 3.2Å; V65-L69 PolarHBondContact O-N 3.26Å
66	A	75.9	Confident	72	Confident	57 Å²	57	100.7 Å²	100.7	47%	0.471	53%	0.532	S	S	.	.	H	α-helix	trans	-63.8	-39.4	176.9	0	0	0	0	0	113.3	E62 K63 K70	E62-A66 WeakPolarHBondContact O-CB 3.49Å; E62-A66 PolarHBondContact O-N 2.82Å; K63-A66 PolarHBondContact O-N 3.38Å; A66-K70 WeakPolarHBondContact O-CB 3.47Å; A66-K70 PolarHBondContact O-N 2.96Å
67	S	76.1	Confident	71.3	Confident	69 Å²	69	98.5 Å²	98.5	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-41.2	174.3	54.6	0	0	0	0	112.2	K63 I64 V65 K70 S71	K63-S67 PolarHBondContact O-N 3.09Å; K63-S67 PolarHBondContact O-OG 2.9Å; I64-S67 WeakPolarHBondContact CA-OG 3.42Å; I64-S67 PolarHBondContact O-N 3.24Å; I64-S67 PolarHBondContact O-OG 3.01Å; V65-S67 PolarHBondContact O-N 2.89Å; S67-K70 PolarHBondContact O-N 3.38Å; S67-K70 VanDerWaalsContact O-N 3.13Å; S67-S71 PolarHBondContact O-N 3.34Å; S67-S71 VanDerWaalsContact O-N 3.16Å
68	S	66	Low	70.5	Confident	14 Å²	14	97.1 Å²	97.1	10%	0.098	53%	0.529	C	S	.	.	H	α-helix	trans	-68.6	-36.2	-179.6	-52.6	0	0	0	0	112.7	I64 V65 K70 S71	I64-S68 WeakPolarHBondContact O-CB 3.35Å; I64-S68 PolarHBondContact O-N 3.33Å; I64-S68 PolarHBondContact O-OG 2.82Å; V65-S68 PolarHBondContact O-N 3.27Å; S68-K70 PolarHBondContact O-N 3.2Å; S68-S71 PolarHBondContact O-OG 2.83Å; S68-S71 VanDerWaalsContact O-OG 3.09Å
69	L	71.6	Confident	69.7	Low	129 Å²	129	92.6 Å²	92.6	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-68.2	-23.8	172	-95.8	143.8	0	0	0	113.1	V65	V65-L69 HydrophobicContact CG1-CD1 3.75Å; V65-L69 WeakPolarHBondContact O-CB 3.2Å; V65-L69 PolarHBondContact O-N 3.26Å
70	K	73.7	Confident	69.1	Low	191 Å²	191	87.1 Å²	87.1	83%	0.83	50%	0.5	S	S	*	.	H	α-helix	trans	-87.4	-24.6	-178.1	-151.8	176.4	-173.6	-175.5	0	113.1	A66 S67 S68	A66-K70 WeakPolarHBondContact O-CB 3.47Å; A66-K70 PolarHBondContact O-N 2.96Å; S67-K70 PolarHBondContact O-N 3.38Å; S67-K70 VanDerWaalsContact O-N 3.13Å; S68-K70 PolarHBondContact O-N 3.2Å
71	S	57.6	Low	68.3	Low	73 Å²	73	87.6 Å²	87.6	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-82.4	-18.3	176.3	59.7	0	0	0	0	114.1	S67 S68 C73	S67-S71 PolarHBondContact O-N 3.34Å; S67-S71 VanDerWaalsContact O-N 3.16Å; S68-S71 PolarHBondContact O-OG 2.83Å; S68-S71 VanDerWaalsContact O-OG 3.09Å; S71-C73 PolarHBondContact O-N 2.9Å; S71-C73 VanDerWaalsContact O-N 3.11Å; S71-C73 PolarHBondContact OG-SG 2.8Å; S71-C73 VanDerWaalsContact OG-SG 3.33Å
72	G	49.9	Very low	67.5	Low	69 Å²	69	89.1 Å²	89.1	71%	0.711	51%	0.508	S	S	*	.	S	Bend	trans	75.6	-13.4	179.6	0	0	0	0	0	115.1
73	C	51.2	Low	66.7	Low	73 Å²	73	89 Å²	89	49%	0.493	51%	0.508	S	S	.	.			trans	-92.6	108.5	170.3	60.5	0	0	0	0	110.4	S71 N75	S71-C73 PolarHBondContact O-N 2.9Å; S71-C73 VanDerWaalsContact O-N 3.11Å; S71-C73 PolarHBondContact OG-SG 2.8Å; S71-C73 VanDerWaalsContact OG-SG 3.33Å; C73-N75 PolarHBondContact O-N 2.88Å
74	L	57.9	Low	66	Low	93 Å²	93	85.8 Å²	85.8	49%	0.487	50%	0.497	S	S	.	.			trans	-76.1	107.5	170.8	-65.5	176.8	0	0	0	109	V78 I79	L74-V78 HydrophobicContact CD2-CG1 4.38Å; L74-I79 HydrophobicContact CB-CD1 4.05Å; L74-I79 HydrophobicContact CB-CG1 3.82Å; L74-I79 HydrophobicContact CD1-CG1 4.46Å
75	N	63.6	Low	65.2	Low	100 Å²	100	86.1 Å²	86.1	54%	0.535	50%	0.499	S	S	.	.			trans	-58	143.7	171.4	-73.5	-9.7	0	0	0	110.2	C73 N77 V78 I79	C73-N75 PolarHBondContact O-N 2.88Å; N75-N77 PolarHBondContact O-N 3.49Å; N75-V78 WeakPolarHBondContact O-CB 3.41Å; N75-V78 PolarHBondContact O-N 3.39Å; N75-I79 PolarHBondContact O-N 3.04Å
76	A	67.1	Low	64.2	Low	74 Å²	74	86.9 Å²	86.9	61%	0.612	50%	0.498	S	S	*	.	H	α-helix	trans	-50.3	-38.5	-175.9	0	0	0	0	0	113.2	V78 I79 A80	A76-V78 VanDerWaalsContact C-N 3.3Å; A76-V78 PolarHBondContact O-N 3.16Å; A76-I79 WeakPolarHBondContact O-CB 3.47Å; A76-I79 PolarHBondContact O-N 3.17Å; A76-I79 VanDerWaalsContact O-N 3.15Å; A76-A80 PolarHBondContact O-N 3.39Å
77	N	66.7	Low	63.2	Low	126 Å²	126	93.1 Å²	93.1	67%	0.674	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-33.1	177.6	-58.9	2.4	0	0	0	113.3	N75 L81	N75-N77 PolarHBondContact O-N 3.49Å; N77-L81 WeakPolarHBondContact O-CB 3.28Å; N77-L81 WeakPolarHBondContact O-CG 3.37Å; N77-L81 PolarHBondContact O-N 3.38Å
78	V	64.7	Low	62	Low	45 Å²	45	95.9 Å²	95.9	27%	0.273	52%	0.519	S	S	.	.	H	α-helix	trans	-77.2	-33.3	177.1	-177.2	0	0	0	0	110.7	L74 N75 A76 K82	L74-V78 HydrophobicContact CD2-CG1 4.38Å; N75-V78 WeakPolarHBondContact O-CB 3.41Å; N75-V78 PolarHBondContact O-N 3.39Å; A76-V78 VanDerWaalsContact C-N 3.3Å; A76-V78 PolarHBondContact O-N 3.16Å; V78-K82 WeakPolarHBondContact O-CB 3.39Å; V78-K82 PolarHBondContact O-N 3.03Å
79	I	66	Low	61.2	Low	73 Å²	73	99.9 Å²	99.9	37%	0.374	54%	0.544	S	S	.	.	H	α-helix	trans	-66	-45.5	171.5	-58.1	177.4	0	0	0	109.9	L74 N75 A76 K82 Q83	L74-I79 HydrophobicContact CB-CD1 4.05Å; L74-I79 HydrophobicContact CB-CG1 3.82Å; L74-I79 HydrophobicContact CD1-CG1 4.46Å; N75-I79 PolarHBondContact O-N 3.04Å; A76-I79 WeakPolarHBondContact O-CB 3.47Å; A76-I79 PolarHBondContact O-N 3.17Å; A76-I79 VanDerWaalsContact O-N 3.15Å; I79-K82 WeakPolarHBondContact O-CB 3.18Å; I79-K82 PolarHBondContact O-N 2.86Å; I79-Q83 WeakPolarHBondContact O-CG 3.27Å; I79-Q83 PolarHBondContact O-N 3.04Å
80	A	68.9	Low	59.5	Low	39 Å²	39	98.8 Å²	98.8	32%	0.322	54%	0.544	S	S	.	.	H	α-helix	trans	-60.5	-45	174.9	0	0	0	0	0	111.8	A76 K82 Q83 I84	A76-A80 PolarHBondContact O-N 3.39Å; A80-K82 VanDerWaalsContact C-N 3.34Å; A80-K82 PolarHBondContact O-N 3.22Å; A80-Q83 PolarHBondContact O-N 2.93Å; A80-I84 WeakPolarHBondContact O-CB 3.43Å; A80-I84 WeakPolarHBondContact O-CD1 3.31Å; A80-I84 VanDerWaalsContact O-CG1 3.24Å; A80-I84 WeakPolarHBondContact O-CG1 3.34Å; A80-I84 PolarHBondContact O-N 3.44Å
81	L	64.4	Low	57.8	Low	103 Å²	103	97.6 Å²	97.6	54%	0.539	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-38.1	173.8	-78.3	167.2	0	0	0	112.6	N77 I84 I85	N77-L81 WeakPolarHBondContact O-CB 3.28Å; N77-L81 WeakPolarHBondContact O-CG 3.37Å; N77-L81 PolarHBondContact O-N 3.38Å; L81-I84 PolarHBondContact O-N 3.29Å; L81-I85 WeakPolarHBondContact O-CB 3.38Å; L81-I85 WeakPolarHBondContact O-CD1 3.42Å; L81-I85 VanDerWaalsContact O-CG1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.4Å; L81-I85 PolarHBondContact O-N 3.37Å
82	K	61.6	Low	56.6	Low	115 Å²	115	100.3 Å²	100.3	50%	0.5	56%	0.555	S	S	.	*	H	α-helix	trans	-64.1	-42.9	174.1	-175.8	176.1	-179	-72.6	0	111.6	V78 I79 A80 I85 E86	V78-K82 WeakPolarHBondContact O-CB 3.39Å; V78-K82 PolarHBondContact O-N 3.03Å; I79-K82 WeakPolarHBondContact O-CB 3.18Å; I79-K82 PolarHBondContact O-N 2.86Å; A80-K82 VanDerWaalsContact C-N 3.34Å; A80-K82 PolarHBondContact O-N 3.22Å; K82-I85 PolarHBondContact O-N 3.07Å; K82-E86 IonicContact NZ-OE1 2.91Å; K82-E86 PolarHBondContact NZ-OE1 3.09Å; K82-E86 WeakPolarHBondContact O-CG 3.45Å; K82-E86 PolarHBondContact O-N 3.04Å
83	Q	64.3	Low	55.9	Low	106 Å²	106	103 Å²	103	50%	0.495	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-44.8	174.1	-71.9	169.3	-28.4	0	0	111.4	I79 A80 I85 E86 Y87	I79-Q83 WeakPolarHBondContact O-CG 3.27Å; I79-Q83 PolarHBondContact O-N 3.04Å; A80-Q83 PolarHBondContact O-N 2.93Å; Q83-I85 PolarHBondContact O-N 2.81Å; Q83-E86 PolarHBondContact O-N 3.09Å; Q83-Y87 WeakPolarHBondContact O-CD2 3.32Å; Q83-Y87 PolarHBondContact O-N 3.16Å
84	I	66.5	Low	54.9	Low	91 Å²	91	107.2 Å²	107.2	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-41.9	176.9	-68.5	161.9	0	0	0	111.1	A80 L81 Y87 L88	A80-I84 WeakPolarHBondContact O-CB 3.43Å; A80-I84 WeakPolarHBondContact O-CD1 3.31Å; A80-I84 VanDerWaalsContact O-CG1 3.24Å; A80-I84 WeakPolarHBondContact O-CG1 3.34Å; A80-I84 PolarHBondContact O-N 3.44Å; L81-I84 PolarHBondContact O-N 3.29Å; I84-Y87 PolarHBondContact O-N 3.13Å; I84-L88 HydrophobicContact CG2-CD1 3.78Å; I84-L88 HydrophobicContact CG2-CG 4.42Å; I84-L88 WeakPolarHBondContact O-CB 3.32Å; I84-L88 VanDerWaalsContact O-CG 3.25Å; I84-L88 WeakPolarHBondContact O-CG 3.4Å; I84-L88 PolarHBondContact O-N 3.11Å
85	I	62.2	Low	53.5	Low	105 Å²	105	106.4 Å²	106.4	54%	0.538	58%	0.575	S	S	.	*	H	α-helix	trans	-64	-41.6	175.1	-70.2	164.4	0	0	0	111	L81 K82 Q83 Y87 L88 T89	L81-I85 WeakPolarHBondContact O-CB 3.38Å; L81-I85 WeakPolarHBondContact O-CD1 3.42Å; L81-I85 VanDerWaalsContact O-CG1 3.24Å; L81-I85 WeakPolarHBondContact O-CG1 3.4Å; L81-I85 PolarHBondContact O-N 3.37Å; K82-I85 PolarHBondContact O-N 3.07Å; Q83-I85 PolarHBondContact O-N 2.81Å; I85-Y87 VanDerWaalsContact C-N 3.31Å; I85-Y87 PolarHBondContact O-N 3.26Å; I85-L88 PolarHBondContact O-N 3.42Å; I85-L88 VanDerWaalsContact O-N 3.09Å; I85-T89 PolarHBondContact O-N 2.84Å; I85-T89 PolarHBondContact O-OG1 2.7Å
86	E	53	Low	52	Low	80 Å²	80	108 Å²	108	37%	0.374	59%	0.594	S	S	.	*	H	α-helix	trans	-62.3	-35.6	174.5	-77.3	171.7	-159.5	0	0	112.5	K82 Q83 T104	K82-E86 IonicContact NZ-OE1 2.91Å; K82-E86 PolarHBondContact NZ-OE1 3.09Å; K82-E86 WeakPolarHBondContact O-CG 3.45Å; K82-E86 PolarHBondContact O-N 3.04Å; Q83-E86 PolarHBondContact O-N 3.09Å; E86-T104 VanDerWaalsContact CD-OG1 3.26Å; E86-T104 PolarHBondContact OE2-OG1 3.46Å
87	Y	54	Low	50.4	Low	187 Å²	187	109.4 Å²	109.4	73%	0.733	60%	0.599	S	S	*	*	H	α-helix	trans	-69.1	-29.1	171.2	-91	-74.6	0	0	0	113.8	Q83 I84 I85	Q83-Y87 WeakPolarHBondContact O-CD2 3.32Å; Q83-Y87 PolarHBondContact O-N 3.16Å; I84-Y87 PolarHBondContact O-N 3.13Å; I85-Y87 VanDerWaalsContact C-N 3.31Å; I85-Y87 PolarHBondContact O-N 3.26Å
88	L	52	Low	48.8	Very low	127 Å²	127	108 Å²	108	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-87.4	-7	-174.7	-73.8	170.3	0	0	0	114.8	I84 I85 P90	I84-L88 HydrophobicContact CG2-CD1 3.78Å; I84-L88 HydrophobicContact CG2-CG 4.42Å; I84-L88 WeakPolarHBondContact O-CB 3.32Å; I84-L88 VanDerWaalsContact O-CG 3.25Å; I84-L88 WeakPolarHBondContact O-CG 3.4Å; I84-L88 PolarHBondContact O-N 3.11Å; I85-L88 PolarHBondContact O-N 3.42Å; I85-L88 VanDerWaalsContact O-N 3.09Å; L88-P90 VanDerWaalsContact C-CD 3.44Å; L88-P90 VanDerWaalsContact O-CD 3.23Å; L88-P90 WeakPolarHBondContact O-CD 3.41Å
89	T	48.3	Very low	47.2	Very low	99 Å²	99	114.9 Å²	114.9	61%	0.607	63%	0.631	S	S	*	*			trans	-115.8	78	177.3	52.2	0	0	0	0	113.3	I85 Q91	I85-T89 PolarHBondContact O-N 2.84Å; I85-T89 PolarHBondContact O-OG1 2.7Å; T89-Q91 PolarHBondContact O-N 3Å
90	P	36.7	Very low	45.5	Very low	105 Å²	105	116 Å²	116	68%	0.682	64%	0.642	S	S	*	*			trans	-88.3	77.1	-178.6	36	-35.9	0	0	0	112	L88	L88-P90 VanDerWaalsContact C-CD 3.44Å; L88-P90 VanDerWaalsContact O-CD 3.23Å; L88-P90 WeakPolarHBondContact O-CD 3.41Å
91	Q	36.9	Very low	43.6	Very low	167 Å²	167	126.2 Å²	126.2	78%	0.78	67%	0.672	S	S	*	*			trans	-142.3	140.7	167	-70.5	-57.6	-26.4	0	0	112.5	T89	T89-Q91 PolarHBondContact O-N 3Å
92	T	31.6	Very low	42	Very low	130 Å²	130	125.2 Å²	125.2	80%	0.798	69%	0.687	S	S	*	*			trans	66.8	100	177.6	70.5	0	0	0	0	116.3
93	R	35.4	Very low	40.7	Very low	126 Å²	126	122.4 Å²	122.4	48%	0.475	69%	0.685	S	S	.	*				-156	132.4	123.8	-63.7	-155.8	-156.3	-169.3	19.2	110.6	A103 T104	R93-A103 PolarHBondContact NH1-O 3.43Å; R93-A103 VanDerWaalsContact NH1-O 3.15Å; R93-A103 PolarHBondContact NH2-O 3.07Å; R93-T104 VanDerWaalsContact NH2-C 3.34Å; R93-T104 PolarHBondContact NH2-O 3.31Å
94	L	31.6	Very low	39.7	Very low	160 Å²	160	121.5 Å²	121.5	84%	0.838	69%	0.687	S	S	*	*			trans	-145.4	138.5	161.8	-149.7	87.8	0	0	0	106.4
95	G	28.9	Very low	38.9	Very low	77 Å²	77	121.2 Å²	121.2	79%	0.794	69%	0.689	S	S	*	*	S	Bend	trans	97.9	128.6	169.1	0	0	0	0	0	116.5
96	S	30.8	Very low	38.6	Very low	133 Å²	133	121.1 Å²	121.1	93%	0.93	70%	0.695	S	S	*	*			trans	-69.7	121	175.2	-52.2	0	0	0	0	112.2
97	S	33.5	Very low	39.5	Very low	103 Å²	103	119.7 Å²	119.7	72%	0.72	69%	0.692	S	S	*	*			trans	-167.9	146.4	156.8	-178	0	0	0	0	110.4	F99	S97-F99 PolarHBondContact O-N 3.15Å
98	A	33.2	Very low	41	Very low	96 Å²	96	113.9 Å²	113.9	79%	0.793	68%	0.676	S	S	*	*	S	Bend	trans	-75.4	31.8	-167.5	0	0	0	0	0	115.8
99	F	32	Very low	42.7	Very low	190 Å²	190	110.4 Å²	110.4	83%	0.833	66%	0.661	S	S	*	*			trans	-123.4	33	-163	-112.7	-81.8	0	0	0	116.7	S97	S97-F99 PolarHBondContact O-N 3.15Å
100	T	30.7	Very low	44.7	Very low	96 Å²	96	105.7 Å²	105.7	59%	0.589	63%	0.632	S	S	*	*			trans	-135.4	60.4	167.7	49.3	0	0	0	0	114.1	G102	T100-G102 VanDerWaalsContact C-N 3.34Å; T100-G102 PolarHBondContact O-N 3.19Å
101	R	28.3	Very low	47.2	Very low	254 Å²	254	104 Å²	104	96%	0.958	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	88.3	167.1	-66.1	-174.5	-168.7	169.8	5.2	110.5
102	G	29.5	Very low	49.6	Very low	82 Å²	82	98 Å²	98	85%	0.845	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.9	-17.6	175.9	0	0	0	0	0	116.1	T100	T100-G102 VanDerWaalsContact C-N 3.34Å; T100-G102 PolarHBondContact O-N 3.19Å
103	A	35	Very low	51.9	Low	56 Å²	56	92.7 Å²	92.7	46%	0.463	56%	0.557	S	S	.	*	S	Bend	trans	-117.8	118.2	177.6	0	0	0	0	0	110.2	R93 V105	R93-A103 PolarHBondContact NH1-O 3.43Å; R93-A103 VanDerWaalsContact NH1-O 3.15Å; R93-A103 PolarHBondContact NH2-O 3.07Å; A103-V105 PolarHBondContact O-N 3.43Å
104	T	44	Very low	53.3	Low	87 Å²	87	96.4 Å²	96.4	53%	0.534	57%	0.571	S	S	.	*			trans	-56	125.4	170.5	23.6	0	0	0	0	110.3	E86 R93	E86-T104 VanDerWaalsContact CD-OG1 3.26Å; E86-T104 PolarHBondContact OE2-OG1 3.46Å; R93-T104 VanDerWaalsContact NH2-C 3.34Å; R93-T104 PolarHBondContact NH2-O 3.31Å
105	V	49.3	Very low	54.3	Low	86 Å²	86	94.7 Å²	94.7	52%	0.521	57%	0.567	S	S	.	*			trans	-79.9	138.9	163.9	179.6	0	0	0	0	106.1	A103 V107	A103-V105 PolarHBondContact O-N 3.43Å; V105-V107 PolarHBondContact O-N 3.01Å
106	P	55.3	Low	55.2	Low	102 Å²	102	95.7 Å²	95.7	66%	0.662	57%	0.568	S	S	*	*			trans	-60.5	108.1	169.8	25.3	-33.4	0	0	0	108.8	V108	P106-V108 PolarHBondContact O-N 3.33Å
107	V	73.2	Confident	56.5	Low	51 Å²	51	92 Å²	92	31%	0.309	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-75.4	122.3	-178.7	-178.1	0	0	0	0	108.4	V105 Y395	V105-V107 PolarHBondContact O-N 3.01Å; V107-Y395 HydrophobicContact CG1-CD1 3.36Å; V107-Y395 HydrophobicContact CG1-CD2 3.86Å; V107-Y395 HydrophobicContact CG1-CE1 3.61Å; V107-Y395 HydrophobicContact CG1-CE2 4.07Å; V107-Y395 HydrophobicContact CG1-CG 3.5Å
108	V	83.9	Confident	57.3	Low	65 Å²	65	90.8 Å²	90.8	39%	0.394	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-68.4	124.2	174.3	179.3	0	0	0	0	108.4	P106 I110 T176	P106-V108 PolarHBondContact O-N 3.33Å; V108-I110 PolarHBondContact O-N 3.38Å; V108-T176 HydrophobicContact CG1-CG2 3.6Å
109	P	88.3	Confident	58.3	Low	54 Å²	54	89.5 Å²	89.5	35%	0.351	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-65.8	132.4	178.9	27.1	-34.2	0	0	0	110.5	Y395 H396	P109-Y395 CarbonylContact C-O 3.6Å; P109-Y395 WeakPolarHBondContact CA-O 3.3Å; P109-H396 HydrophobicContact CB-CB 4.11Å
110	I	90.4	Very high	60	Low	0 Å²	0	84.1 Å²	84.1	0%	0	50%	0.504	C	S	.	.	S	Bend	trans	-64	-47.7	176.1	-71.2	168.5	0	0	0	110	V108 D112 A133 R137 A177 L390 Y395 T397	V108-I110 PolarHBondContact O-N 3.38Å; I110-D112 PolarHBondContact O-N 3.02Å; I110-A133 HydrophobicContact CG2-CB 3.75Å; I110-R137 HydrophobicContact CD1-CB 4.28Å; I110-R137 HydrophobicContact CD1-CG 3.68Å; I110-R137 HydrophobicContact CG1-CG 3.72Å; I110-A177 VanDerWaalsContact O-CB 3.3Å; I110-A177 WeakPolarHBondContact O-CB 3.42Å; I110-A177 PolarHBondContact O-N 3.4Å; I110-L390 HydrophobicContact CD1-CD1 4.12Å; I110-Y395 HydrophobicContact CD1-CD1 4.25Å; I110-Y395 HydrophobicContact CD1-CG 4.35Å; I110-Y395 HydrophobicContact CG1-CD1 4.43Å; I110-Y395 PolarHBondContact N-O 2.93Å; I110-T397 HydrophobicContact CD1-CG2 3.88Å
111	N	89.4	Confident	62.3	Low	70 Å²	70	80.2 Å²	80.2	37%	0.374	48%	0.478	S	S	.	.			trans	-86.9	78	176.1	-176.7	26.4	0	0	0	110.6	H396	N111-H396 VanDerWaalsContact CB-O 3.28Å; N111-H396 WeakPolarHBondContact CB-O 3.33Å; N111-H396 PolarHBondContact N-O 3.33Å
112	D	87.1	Confident	65	Low	40 Å²	40	73.4 Å²	73.4	21%	0.214	46%	0.464	C	S	.	.			trans	-93	6.9	177.5	70.4	-27.1	0	0	0	113.7	I110 R114 T176 A177 S178	I110-D112 PolarHBondContact O-N 3.02Å; D112-R114 PolarHBondContact O-N 3Å; D112-T176 HydrophobicContact CB-CG2 4.45Å; D112-T176 WeakPolarHBondContact OD1-CB 3.21Å; D112-T176 PolarHBondContact OD1-OG1 3.12Å; D112-T176 WeakPolarHBondContact OD2-CB 3.44Å; D112-T176 PolarHBondContact OD2-OG1 2.85Å; D112-A177 PolarHBondContact OD1-N 3.24Å; D112-S178 VanDerWaalsContact CG-OG 3.26Å; D112-S178 WeakPolarHBondContact OD1-CB 3.32Å; D112-S178 PolarHBondContact OD1-N 3.1Å; D112-S178 PolarHBondContact OD1-OG 3.41Å; D112-S178 WeakPolarHBondContact OD2-CB 3.37Å; D112-S178 PolarHBondContact OD2-OG 3.16Å
113	L	80.9	Confident	67.6	Low	18 Å²	18	77.7 Å²	77.7	9%	0.094	46%	0.46	C	S	.	.			trans	-63.7	93.1	-180	-60	175.8	0	0	0	110.1	L118 Y121 R126 A177	L113-L118 HydrophobicContact CB-CD1 4.26Å; L113-L118 WeakPolarHBondContact O-CD1 3.4Å; L113-Y121 HydrophobicContact CD2-CD2 4.13Å; L113-Y121 HydrophobicContact CD2-CE2 3.99Å; L113-R126 HydrophobicContact CD1-CB 3.97Å; L113-R126 HydrophobicContact CD1-CG 3.99Å; L113-A177 HydrophobicContact CD1-CB 4.09Å; L113-A177 HydrophobicContact CD2-CB 4.16Å; L113-A177 HydrophobicContact CG-CB 3.89Å
114	R	64	Low	70.1	Confident	204 Å²	204	76.9 Å²	76.9	77%	0.77	46%	0.457	S	S	*	.			trans	-74.1	157.1	178.4	-67.4	178.2	-178.1	155.4	1.7	111.5	D112 A116 Q117 L118	D112-R114 PolarHBondContact O-N 3Å; R114-A116 PolarHBondContact O-N 3.03Å; R114-Q117 WeakPolarHBondContact O-CA 3.48Å; R114-Q117 PolarHBondContact O-N 3.17Å; R114-L118 VanDerWaalsContact C-CD1 3.44Å; R114-L118 VanDerWaalsContact O-CD1 3.23Å; R114-L118 WeakPolarHBondContact O-CD1 3.28Å; R114-L118 PolarHBondContact O-N 3.39Å; R114-L118 VanDerWaalsContact O-N 3.15Å
115	T	52.8	Low	72.4	Confident	125 Å²	125	73.5 Å²	73.5	77%	0.767	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-30.1	-176.6	-42.7	0	0	0	0	114.7	L118	T115-L118 WeakPolarHBondContact O-CB 3.27Å; T115-L118 PolarHBondContact O-N 2.97Å
116	A	47.5	Very low	74.3	Confident	98 Å²	98	72.2 Å²	72.2	81%	0.81	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-36.8	173.7	0	0	0	0	0	113.8	R114	R114-A116 PolarHBondContact O-N 3.03Å
117	Q	57.8	Low	76	Confident	55 Å²	55	70.7 Å²	70.7	26%	0.257	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-86.4	-10	174.1	-69.8	176.8	-18.1	0	0	112.7	R114 G119 S120 Y121	R114-Q117 WeakPolarHBondContact O-CA 3.48Å; R114-Q117 PolarHBondContact O-N 3.17Å; Q117-G119 PolarHBondContact O-N 3.04Å; Q117-S120 PolarHBondContact O-N 3.17Å; Q117-S120 VanDerWaalsContact O-N 3.17Å; Q117-S120 PolarHBondContact O-OG 2.76Å; Q117-S120 VanDerWaalsContact O-OG 3.06Å; Q117-Y121 HydrophobicContact CB-CE2 4.4Å
118	L	51.6	Low	77	Confident	77 Å²	77	69.3 Å²	69.3	40%	0.403	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-67.1	2	170.3	-90.3	78.2	0	0	0	113.5	L113 R114 T115 R126	L113-L118 HydrophobicContact CB-CD1 4.26Å; L113-L118 WeakPolarHBondContact O-CD1 3.4Å; R114-L118 VanDerWaalsContact C-CD1 3.44Å; R114-L118 VanDerWaalsContact O-CD1 3.23Å; R114-L118 WeakPolarHBondContact O-CD1 3.28Å; R114-L118 PolarHBondContact O-N 3.39Å; R114-L118 VanDerWaalsContact O-N 3.15Å; T115-L118 WeakPolarHBondContact O-CB 3.27Å; T115-L118 PolarHBondContact O-N 2.97Å; L118-R126 VanDerWaalsContact CG-NH1 3.29Å; L118-R126 PolarHBondContact O-NH1 3.24Å; L118-R126 PolarHBondContact O-NH2 3.45Å
119	G	52.9	Low	77.5	Confident	70 Å²	70	66.2 Å²	66.2	72%	0.722	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-88.3	-34.2	166.6	0	0	0	0	0	114.8	Q117	Q117-G119 PolarHBondContact O-N 3.04Å
120	S	69.3	Low	77.8	Confident	77 Å²	77	64 Å²	64	54%	0.538	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-42.1	-164.4	53.9	0	0	0	0	114.6	Q117	Q117-S120 PolarHBondContact O-N 3.17Å; Q117-S120 VanDerWaalsContact O-N 3.17Å; Q117-S120 PolarHBondContact O-OG 2.76Å; Q117-S120 VanDerWaalsContact O-OG 3.06Å
121	Y	78.8	Confident	78	Confident	14 Å²	14	66.3 Å²	66.3	6%	0.055	38%	0.375	C	S	.	.	S	Bend	trans	-93.9	138.2	-172.3	-52.6	-59.3	0	0	0	112.6	L113 Q117 E125 R126 V191	L113-Y121 HydrophobicContact CD2-CD2 4.13Å; L113-Y121 HydrophobicContact CD2-CE2 3.99Å; Q117-Y121 HydrophobicContact CB-CE2 4.4Å; Y121-E125 VanDerWaalsContact CD1-OE1 3.25Å; Y121-E125 WeakPolarHBondContact CD1-OE1 3.4Å; Y121-R126 PolarHBondContact O-NE 2.84Å; Y121-R126 PolarHBondContact O-NH2 2.85Å; Y121-V191 HydrophobicContact CE1-CG1 4.28Å
122	V	84.7	Confident	78.4	Confident	110 Å²	110	63 Å²	63	67%	0.667	36%	0.357	S	S	*	.			trans	-66.2	150	172.7	-177.9	0	0	0	0	110.2	G124 E125 R126	V122-G124 PolarHBondContact O-N 3.16Å; V122-G124 VanDerWaalsContact O-N 3.09Å; V122-E125 PolarHBondContact O-N 3.03Å; V122-R126 PolarHBondContact O-N 2.96Å; V122-R126 VanDerWaalsContact O-N 3.11Å
123	K	84.6	Confident	78.8	Confident	172 Å²	172	61 Å²	61	75%	0.748	35%	0.347	S	S	*	.	H	α-helix	trans	-48.8	-40	-179.9	-68.8	-172.8	179.3	-176.4	0	113.4	L127	K123-L127 PolarHBondContact O-N 2.88Å
124	G	87.1	Confident	79.5	Confident	40 Å²	40	60.2 Å²	60.2	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-44.4	176.4	0	0	0	0	0	113.6	V122 R126 L127 I128	V122-G124 PolarHBondContact O-N 3.16Å; V122-G124 VanDerWaalsContact O-N 3.09Å; G124-R126 VanDerWaalsContact C-N 3.34Å; G124-R126 PolarHBondContact O-N 3Å; G124-L127 PolarHBondContact O-N 3.42Å; G124-I128 WeakPolarHBondContact O-CG1 3.2Å; G124-I128 PolarHBondContact O-N 3.04Å
125	E	91.1	Very high	81	Confident	15 Å²	15	50.5 Å²	50.5	7%	0.07	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-40.8	177.6	-175.9	-177.4	168.2	0	0	111.5	Y121 V122 L127 I128 R129 V156	Y121-E125 VanDerWaalsContact CD1-OE1 3.25Å; Y121-E125 WeakPolarHBondContact CD1-OE1 3.4Å; V122-E125 PolarHBondContact O-N 3.03Å; E125-L127 PolarHBondContact O-N 3.45Å; E125-I128 PolarHBondContact O-N 2.91Å; E125-I128 VanDerWaalsContact O-N 3.14Å; E125-R129 HydrophobicContact CG-CG 4.34Å; E125-R129 WeakPolarHBondContact O-CG 3.21Å; E125-R129 PolarHBondContact O-N 2.79Å; E125-R129 IonicContact OE1-CZ 2.64Å; E125-R129 VanDerWaalsContact OE1-CZ 3.3Å; E125-R129 IonicContact OE1-NE 3.22Å; E125-R129 PolarHBondContact OE1-NE 3.47Å; E125-R129 IonicContact OE1-NH2 3.15Å; E125-R129 PolarHBondContact OE1-NH2 3.44Å; E125-V156 HydrophobicContact CB-CG1 3.82Å; E125-V156 HydrophobicContact CG-CG1 3.75Å; E125-V156 HydrophobicContact CG-CG2 4.47Å
126	R	89.7	Confident	83	Confident	59 Å²	59	44.6 Å²	44.6	22%	0.223	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-46.8	177.7	-62.3	-179.7	-155.6	-177.3	1.7	112.1	L113 L118 Y121 V122 G124 I128 R129 C130	L113-R126 HydrophobicContact CD1-CB 3.97Å; L113-R126 HydrophobicContact CD1-CG 3.99Å; L118-R126 VanDerWaalsContact CG-NH1 3.29Å; L118-R126 PolarHBondContact O-NH1 3.24Å; L118-R126 PolarHBondContact O-NH2 3.45Å; Y121-R126 PolarHBondContact O-NE 2.84Å; Y121-R126 PolarHBondContact O-NH2 2.85Å; V122-R126 PolarHBondContact O-N 2.96Å; V122-R126 VanDerWaalsContact O-N 3.11Å; G124-R126 VanDerWaalsContact C-N 3.34Å; G124-R126 PolarHBondContact O-N 3Å; R126-I128 VanDerWaalsContact C-N 3.27Å; R126-I128 PolarHBondContact O-N 3.28Å; R126-R129 PolarHBondContact O-N 3.02Å; R126-C130 PolarHBondContact O-N 3.32Å; R126-C130 PolarHBondContact O-SG 3.37Å; R126-C130 VanDerWaalsContact O-SG 3.33Å
127	L	91.5	Very high	85.2	Confident	71 Å²	71	40.2 Å²	40.2	37%	0.372	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-37.2	178.1	-67.4	172.7	0	0	0	111.6	K123 G124 E125 K131 V400	K123-L127 PolarHBondContact O-N 2.88Å; G124-L127 PolarHBondContact O-N 3.42Å; E125-L127 PolarHBondContact O-N 3.45Å; L127-K131 WeakPolarHBondContact O-CB 3.42Å; L127-K131 VanDerWaalsContact O-CG 3.24Å; L127-K131 WeakPolarHBondContact O-CG 3.37Å; L127-K131 PolarHBondContact O-N 3.33Å; L127-V400 HydrophobicContact CD2-CG2 3.77Å
128	I	93.7	Very high	86.9	Confident	22 Å²	22	37.8 Å²	37.8	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-69	-44.6	176.9	-66	168.5	0	0	0	110.6	G124 E125 R126 C130 K131 L132 A154 V156 L164 I314	G124-I128 WeakPolarHBondContact O-CG1 3.2Å; G124-I128 PolarHBondContact O-N 3.04Å; E125-I128 PolarHBondContact O-N 2.91Å; E125-I128 VanDerWaalsContact O-N 3.14Å; R126-I128 VanDerWaalsContact C-N 3.27Å; R126-I128 PolarHBondContact O-N 3.28Å; I128-C130 PolarHBondContact O-N 2.91Å; I128-K131 PolarHBondContact O-N 2.84Å; I128-L132 VanDerWaalsContact O-CB 3.22Å; I128-L132 WeakPolarHBondContact O-CB 3.41Å; I128-L132 PolarHBondContact O-N 3.24Å; I128-A154 HydrophobicContact CG2-CB 4.05Å; I128-V156 WeakPolarHBondContact CD1-O 3.44Å; I128-L164 HydrophobicContact CG2-CD1 3.86Å; I128-I314 HydrophobicContact CG2-CD1 3.96Å
129	R	94.5	Very high	88.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-47.6	173.8	-75.1	173.8	173.3	-85.9	-5.7	111.9	E125 R126 L132 A133 L164 A177 F180	E125-R129 HydrophobicContact CG-CG 4.34Å; E125-R129 WeakPolarHBondContact O-CG 3.21Å; E125-R129 PolarHBondContact O-N 2.79Å; E125-R129 IonicContact OE1-CZ 2.64Å; E125-R129 VanDerWaalsContact OE1-CZ 3.3Å; E125-R129 IonicContact OE1-NE 3.22Å; E125-R129 PolarHBondContact OE1-NE 3.47Å; E125-R129 IonicContact OE1-NH2 3.15Å; E125-R129 PolarHBondContact OE1-NH2 3.44Å; R126-R129 PolarHBondContact O-N 3.02Å; R129-L132 PolarHBondContact O-N 3.44Å; R129-A133 PolarHBondContact O-N 2.88Å; R129-L164 HydrophobicContact CG-CD1 3.6Å; R129-L164 HydrophobicContact CG-CD2 4.36Å; R129-A177 HydrophobicContact CB-CB 4Å; R129-A177 WeakPolarHBondContact CD-O 3.45Å; R129-A177 PolarHBondContact NH1-O 3.32Å; R129-F180 HydrophobicContact CB-CD2 4.43Å; R129-F180 HydrophobicContact CG-CD2 4.46Å; R129-F180 PolarHBondContact NH1-O 2.68Å; R129-F180 WeakPolarHBondContact O-CE2 3.34Å
130	C	94.2	Very high	90.7	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.054	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-45.1	177.5	-68.3	0	0	0	0	112.8	R126 I128 S134 T397	R126-C130 PolarHBondContact O-N 3.32Å; R126-C130 PolarHBondContact O-SG 3.37Å; R126-C130 VanDerWaalsContact O-SG 3.33Å; I128-C130 PolarHBondContact O-N 2.91Å; C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.3Å; C130-S134 PolarHBondContact O-OG 3.11Å; C130-T397 WeakPolarHBondContact CB-O 3.42Å
131	K	95.6	Very high	91.7	Very high	47 Å²	47	33 Å²	33	20%	0.204	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-42.2	176.1	-73.5	177.4	-172.1	-167.2	0	112.1	L127 I128 S134 V135 I314 E315 F383 Y399	L127-K131 WeakPolarHBondContact O-CB 3.42Å; L127-K131 VanDerWaalsContact O-CG 3.24Å; L127-K131 WeakPolarHBondContact O-CG 3.37Å; L127-K131 PolarHBondContact O-N 3.33Å; I128-K131 PolarHBondContact O-N 2.84Å; K131-S134 WeakPolarHBondContact O-CB 3.43Å; K131-S134 PolarHBondContact O-N 3.13Å; K131-V135 PolarHBondContact O-N 2.77Å; K131-I314 HydrophobicContact CB-CD1 3.77Å; K131-I314 HydrophobicContact CB-CG2 4.25Å; K131-E315 WeakPolarHBondContact CD-OE1 3.39Å; K131-E315 WeakPolarHBondContact CE-OE1 3.41Å; K131-E315 IonicContact NZ-OE1 2.91Å; K131-E315 PolarHBondContact NZ-OE1 2.9Å; K131-F383 HydrophobicContact CB-CZ 4.4Å; K131-F383 HydrophobicContact CG-CE1 4.22Å; K131-Y399 HydrophobicContact CD-CE2 4.24Å; K131-Y399 HydrophobicContact CG-CD2 4.09Å; K131-Y399 HydrophobicContact CG-CE2 4.14Å
132	L	96.3	Very high	92.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-50.6	178.2	-176.9	62.2	0	0	0	110.9	I128 R129 S134 V135 Y136 I152 A154 L164 F180 I314	I128-L132 VanDerWaalsContact O-CB 3.22Å; I128-L132 WeakPolarHBondContact O-CB 3.41Å; I128-L132 PolarHBondContact O-N 3.24Å; R129-L132 PolarHBondContact O-N 3.44Å; L132-S134 PolarHBondContact O-N 3.01Å; L132-V135 WeakPolarHBondContact O-CA 3.38Å; L132-V135 WeakPolarHBondContact O-CB 3.3Å; L132-V135 PolarHBondContact O-N 3.25Å; L132-Y136 HydrophobicContact CD1-CD2 4.27Å; L132-Y136 HydrophobicContact CD1-CE2 3.82Å; L132-Y136 HydrophobicContact CD2-CE2 4.37Å; L132-Y136 HydrophobicContact CG-CD2 4.15Å; L132-Y136 HydrophobicContact CG-CE2 3.81Å; L132-Y136 VanDerWaalsContact O-CD2 3.31Å; L132-Y136 WeakPolarHBondContact O-CD2 3.44Å; L132-Y136 PolarHBondContact O-N 3.49Å; L132-I152 HydrophobicContact CD1-CB 4.2Å; L132-I152 HydrophobicContact CD1-CG2 3.62Å; L132-A154 HydrophobicContact CD1-CB 4.19Å; L132-A154 HydrophobicContact CD2-CB 4.12Å; L132-L164 HydrophobicContact CD2-CB 3.7Å; L132-L164 HydrophobicContact CD2-CD1 4.39Å; L132-F180 HydrophobicContact CB-CE2 3.91Å; L132-F180 HydrophobicContact CB-CZ 4.11Å; L132-F180 HydrophobicContact CD2-CD1 3.98Å; L132-F180 HydrophobicContact CD2-CD2 4.07Å; L132-F180 HydrophobicContact CD2-CE1 3.84Å; L132-F180 HydrophobicContact CD2-CE2 3.9Å; L132-F180 HydrophobicContact CD2-CG 4.11Å; L132-F180 HydrophobicContact CD2-CZ 3.8Å; L132-F180 HydrophobicContact CG-CE1 4.02Å; L132-F180 HydrophobicContact CG-CE2 3.85Å; L132-F180 HydrophobicContact CG-CZ 3.59Å; L132-I314 HydrophobicContact CB-CD1 4.33Å
133	A	95.4	Very high	92.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-35.6	175.6	0	0	0	0	0	112.1	I110 R129 V135 Y136 R137 F180	I110-A133 HydrophobicContact CG2-CB 3.75Å; R129-A133 PolarHBondContact O-N 2.88Å; A133-V135 PolarHBondContact O-N 3.27Å; A133-Y136 PolarHBondContact O-N 3.47Å; A133-R137 WeakPolarHBondContact O-CG 3.4Å; A133-R137 PolarHBondContact O-N 3.37Å; A133-F180 HydrophobicContact CB-CE2 3.6Å; A133-F180 HydrophobicContact CB-CZ 3.9Å
134	S	95.9	Very high	92.7	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-40.6	172.5	-53.9	0	0	0	0	112.4	C130 K131 L132 R137 L138 M387	C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.3Å; C130-S134 PolarHBondContact O-OG 3.11Å; K131-S134 WeakPolarHBondContact O-CB 3.43Å; K131-S134 PolarHBondContact O-N 3.13Å; L132-S134 PolarHBondContact O-N 3.01Å; S134-R137 PolarHBondContact O-N 3.15Å; S134-L138 WeakPolarHBondContact O-CG 3.37Å; S134-L138 PolarHBondContact O-N 2.99Å; S134-M387 VanDerWaalsContact CB-SD 3.58Å
135	V	96.5	Very high	92.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-46	173	168.7	0	0	0	0	111.7	K131 L132 A133 R137 L138 V139 I152 I221 I314 W318 F383	K131-V135 PolarHBondContact O-N 2.77Å; L132-V135 WeakPolarHBondContact O-CA 3.38Å; L132-V135 WeakPolarHBondContact O-CB 3.3Å; L132-V135 PolarHBondContact O-N 3.25Å; A133-V135 PolarHBondContact O-N 3.27Å; V135-R137 VanDerWaalsContact C-N 3.29Å; V135-R137 PolarHBondContact O-N 2.93Å; V135-L138 PolarHBondContact O-N 2.94Å; V135-V139 HydrophobicContact CG1-CG2 4.26Å; V135-V139 WeakPolarHBondContact O-CG2 3.18Å; V135-V139 PolarHBondContact O-N 3.26Å; V135-I152 HydrophobicContact CG1-CD1 3.73Å; V135-I152 HydrophobicContact CG1-CG2 4.34Å; V135-I221 HydrophobicContact CG1-CD1 3.88Å; V135-I221 HydrophobicContact CG1-CG1 4.31Å; V135-I314 HydrophobicContact CG2-CG2 3.48Å; V135-I314 VanDerWaalsContact CG2-CG2 3.48Å; V135-W318 HydrophobicContact CG1-CE3 3.99Å; V135-W318 HydrophobicContact CG1-CZ3 4.43Å; V135-W318 HydrophobicContact CG2-CB 4.47Å; V135-W318 HydrophobicContact CG2-CE3 4.36Å; V135-F383 HydrophobicContact CG2-CE2 3.67Å; V135-F383 HydrophobicContact CG2-CZ 4.12Å
136	Y	95.4	Very high	92.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-42.6	175	-79	-88.8	0	0	0	111.8	L132 A133 L138 V139 D140 I152 N166 Y172 L175 F180	L132-Y136 HydrophobicContact CD1-CD2 4.27Å; L132-Y136 HydrophobicContact CD1-CE2 3.82Å; L132-Y136 HydrophobicContact CD2-CE2 4.37Å; L132-Y136 HydrophobicContact CG-CD2 4.15Å; L132-Y136 HydrophobicContact CG-CE2 3.81Å; L132-Y136 VanDerWaalsContact O-CD2 3.31Å; L132-Y136 WeakPolarHBondContact O-CD2 3.44Å; L132-Y136 PolarHBondContact O-N 3.49Å; A133-Y136 PolarHBondContact O-N 3.47Å; Y136-L138 VanDerWaalsContact C-N 3.34Å; Y136-L138 PolarHBondContact O-N 3.31Å; Y136-V139 PolarHBondContact O-N 3.4Å; Y136-D140 PolarHBondContact O-N 3.48Å; Y136-D140 VanDerWaalsContact O-N 3.11Å; Y136-I152 HydrophobicContact CD1-CD1 4.03Å; Y136-I152 HydrophobicContact CD1-CG1 4.4Å; Y136-I152 HydrophobicContact CD2-CB 4.43Å; Y136-I152 HydrophobicContact CD2-CD1 4.33Å; Y136-I152 HydrophobicContact CE1-CB 4.12Å; Y136-I152 HydrophobicContact CE1-CD1 4.08Å; Y136-I152 HydrophobicContact CE1-CG1 3.94Å; Y136-I152 HydrophobicContact CE2-CB 3.68Å; Y136-I152 HydrophobicContact CE2-CD1 4.35Å; Y136-I152 HydrophobicContact CE2-CG1 4.29Å; Y136-I152 HydrophobicContact CE2-CG2 4.48Å; Y136-I152 HydrophobicContact CG-CD1 4.18Å; Y136-I152 WeakPolarHBondContact OH-CA 3.45Å; Y136-I152 PolarHBondContact OH-N 2.96Å; Y136-I152 PolarHBondContact OH-O 3.49Å; Y136-N166 HydrophobicContact CE1-CB 3.94Å; Y136-N166 WeakPolarHBondContact OH-CB 3.37Å; Y136-N166 VanDerWaalsContact OH-CG 3.3Å; Y136-N166 PolarHBondContact OH-N 3.5Å; Y136-N166 PolarHBondContact OH-OD1 3.44Å; Y136-Y172 AromaticContact CD1-CD1 3.69Å; Y136-Y172 HydrophobicContact CD1-CD1 3.69Å; Y136-Y172 AromaticContact CD1-CD2 3.6Å; Y136-Y172 HydrophobicContact CD1-CD2 3.6Å; Y136-Y172 AromaticContact CD1-CE1 3.61Å; Y136-Y172 HydrophobicContact CD1-CE1 3.61Å; Y136-Y172 AromaticContact CD1-CE2 3.51Å; Y136-Y172 HydrophobicContact CD1-CE2 3.51Å; Y136-Y172 AromaticContact CD1-CG 3.68Å; Y136-Y172 HydrophobicContact CD1-CG 3.68Å; Y136-Y172 AromaticContact CD1-CZ 3.51Å; Y136-Y172 HydrophobicContact CE1-CD1 4.12Å; Y136-Y172 HydrophobicContact CE1-CD2 4.45Å; Y136-Y172 AromaticContact CE1-CE1 3.61Å; Y136-Y172 HydrophobicContact CE1-CE1 3.61Å; Y136-Y172 AromaticContact CE1-CE2 3.98Å; Y136-Y172 HydrophobicContact CE1-CE2 3.98Å; Y136-Y172 AromaticContact CE1-CZ 3.52Å; Y136-Y172 HydrophobicContact CG-CD2 4.41Å; Y136-L175 HydrophobicContact CD1-CD1 3.19Å; Y136-L175 HydrophobicContact CD2-CD1 4.08Å; Y136-L175 HydrophobicContact CE1-CD1 3.49Å; Y136-L175 VanDerWaalsContact CE1-CD1 3.49Å; Y136-L175 HydrophobicContact CE2-CD1 4.33Å; Y136-L175 HydrophobicContact CG-CD1 3.51Å; Y136-F180 AromaticContact CD2-CE1 3.75Å; Y136-F180 HydrophobicContact CD2-CE1 3.75Å; Y136-F180 AromaticContact CD2-CZ 3.59Å; Y136-F180 HydrophobicContact CD2-CZ 3.59Å; Y136-F180 AromaticContact CE2-CE1 3.36Å; Y136-F180 HydrophobicContact CE2-CE1 3.36Å; Y136-F180 AromaticContact CE2-CZ 3.66Å; Y136-F180 HydrophobicContact CE2-CZ 3.66Å
137	R	92.6	Very high	91.7	Very high	6 Å²	6	27.8 Å²	27.8	2%	0.023	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-38	174.3	-60.4	-34.9	-175	116.6	-14.6	112.7	I110 A133 S134 V135 I141 Y172 N173 E174 L175 L390 Y395	I110-R137 HydrophobicContact CD1-CB 4.28Å; I110-R137 HydrophobicContact CD1-CG 3.68Å; I110-R137 HydrophobicContact CG1-CG 3.72Å; A133-R137 WeakPolarHBondContact O-CG 3.4Å; A133-R137 PolarHBondContact O-N 3.37Å; S134-R137 PolarHBondContact O-N 3.15Å; V135-R137 VanDerWaalsContact C-N 3.29Å; V135-R137 PolarHBondContact O-N 2.93Å; R137-I141 WeakPolarHBondContact O-CB 3.38Å; R137-I141 WeakPolarHBondContact O-CD1 3.4Å; R137-I141 WeakPolarHBondContact O-CG1 3.35Å; R137-I141 PolarHBondContact O-N 3.42Å; R137-Y172 VanDerWaalsContact CD-O 3.22Å; R137-Y172 WeakPolarHBondContact CD-O 3.31Å; R137-N173 VanDerWaalsContact CZ-C 3.41Å; R137-N173 VanDerWaalsContact NH1-C 3.29Å; R137-N173 PolarHBondContact NH1-O 2.93Å; R137-N173 PolarHBondContact NH2-O 3.05Å; R137-E174 PolarHBondContact NH2-O 3.18Å; R137-L175 VanDerWaalsContact CZ-O 3.26Å; R137-L175 PolarHBondContact NE-O 2.92Å; R137-L175 PolarHBondContact NH2-O 3.29Å; R137-L390 HydrophobicContact CB-CD2 4.4Å; R137-Y395 HydrophobicContact CB-CD1 4.38Å; R137-Y395 HydrophobicContact CB-CE1 4.32Å; R137-Y395 HydrophobicContact CG-CD1 4Å; R137-Y395 HydrophobicContact CG-CE1 4.18Å
138	L	93.7	Very high	91.5	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-65.6	-49.4	175.9	-68.1	169.8	0	0	0	111.1	S134 V135 Y136 D140 I141 F142 W318 L386 M387 L390	S134-L138 WeakPolarHBondContact O-CG 3.37Å; S134-L138 PolarHBondContact O-N 2.99Å; V135-L138 PolarHBondContact O-N 2.94Å; Y136-L138 VanDerWaalsContact C-N 3.34Å; Y136-L138 PolarHBondContact O-N 3.31Å; L138-D140 PolarHBondContact O-N 2.92Å; L138-I141 PolarHBondContact O-N 3.36Å; L138-I141 VanDerWaalsContact O-N 3.08Å; L138-F142 HydrophobicContact CB-CD2 4.36Å; L138-F142 HydrophobicContact CD2-CE2 4.31Å; L138-F142 VanDerWaalsContact O-CD2 3.24Å; L138-F142 WeakPolarHBondContact O-CD2 3.34Å; L138-F142 PolarHBondContact O-N 3.15Å; L138-W318 HydrophobicContact CB-CE3 4.37Å; L138-W318 HydrophobicContact CB-CH2 3.47Å; L138-W318 VanDerWaalsContact CB-CH2 3.47Å; L138-W318 HydrophobicContact CB-CZ2 3.96Å; L138-W318 HydrophobicContact CB-CZ3 3.69Å; L138-W318 HydrophobicContact CD1-CD2 4.16Å; L138-W318 HydrophobicContact CD1-CE3 4.38Å; L138-W318 HydrophobicContact CD1-CH2 4.34Å; L138-W318 HydrophobicContact CD1-CZ2 4.1Å; L138-W318 HydrophobicContact CD1-CZ3 4.46Å; L138-W318 HydrophobicContact CG-CH2 4.46Å; L138-L386 HydrophobicContact CD1-CB 4.19Å; L138-L386 HydrophobicContact CD1-CD1 4.22Å; L138-L386 HydrophobicContact CD2-CB 4.17Å; L138-L386 HydrophobicContact CD2-CD2 4.37Å; L138-M387 HydrophobicContact CD1-CE 3.79Å; L138-L390 HydrophobicContact CD2-CD1 4.09Å; L138-L390 HydrophobicContact CD2-CD2 4.12Å; L138-L390 HydrophobicContact CD2-CG 4.09Å; L138-L390 HydrophobicContact CG-CD1 4.12Å
139	V	93.3	Very high	90.9	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-37.2	178.6	179.5	0	0	0	0	111.6	V135 Y136 G143 W144 N145 I152 Y172 L223 W318	V135-V139 HydrophobicContact CG1-CG2 4.26Å; V135-V139 WeakPolarHBondContact O-CG2 3.18Å; V135-V139 PolarHBondContact O-N 3.26Å; Y136-V139 PolarHBondContact O-N 3.4Å; V139-G143 PolarHBondContact O-N 3.29Å; V139-W144 HydrophobicContact CG1-CB 3.79Å; V139-W144 HydrophobicContact CG2-CE3 4.49Å; V139-W144 PolarHBondContact O-N 2.97Å; V139-N145 HydrophobicContact CG1-CB 4.06Å; V139-I152 HydrophobicContact CG2-CD1 3.97Å; V139-Y172 HydrophobicContact CB-CD2 3.92Å; V139-Y172 HydrophobicContact CB-CE2 4.01Å; V139-Y172 HydrophobicContact CG1-CD2 3.9Å; V139-Y172 HydrophobicContact CG1-CE2 3.7Å; V139-L223 HydrophobicContact CG1-CD2 3.83Å; V139-L223 HydrophobicContact CG2-CD2 4.29Å; V139-W318 HydrophobicContact CG2-CZ3 3.79Å
140	D	91.1	Very high	90.5	Very high	55 Å²	55	32 Å²	32	29%	0.294	19%	0.192	S	C	.	.	H	α-helix	trans	-65.5	-50.3	172.3	-173.9	82.5	0	0	0	112.7	Y136 L138 F142 G143 N173	Y136-D140 PolarHBondContact O-N 3.48Å; Y136-D140 VanDerWaalsContact O-N 3.11Å; L138-D140 PolarHBondContact O-N 2.92Å; D140-F142 VanDerWaalsContact C-N 3.28Å; D140-F142 PolarHBondContact O-N 3.03Å; D140-G143 PolarHBondContact O-N 2.98Å; D140-N173 WeakPolarHBondContact OD2-CB 3.44Å
141	I	90.3	Very high	90.4	Very high	67 Å²	67	31.7 Å²	31.7	34%	0.344	19%	0.189	S	C	.	.	H	α-helix	trans	-62.1	-33.7	179.2	-70.4	163.5	0	0	0	112.4	R137 L138 G143 L390 Y395	R137-I141 WeakPolarHBondContact O-CB 3.38Å; R137-I141 WeakPolarHBondContact O-CD1 3.4Å; R137-I141 WeakPolarHBondContact O-CG1 3.35Å; R137-I141 PolarHBondContact O-N 3.42Å; L138-I141 PolarHBondContact O-N 3.36Å; L138-I141 VanDerWaalsContact O-N 3.08Å; I141-G143 VanDerWaalsContact C-N 3.3Å; I141-L390 HydrophobicContact CD1-CD2 3.49Å; I141-L390 VanDerWaalsContact CD1-CD2 3.49Å; I141-Y395 HydrophobicContact CD1-CE2 4.04Å
142	F	90.2	Very high	90.4	Very high	63 Å²	63	29.5 Å²	29.5	28%	0.276	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.4	174.6	-78.5	-78.2	0	0	0	113.3	L138 D140 W144 W318 F322 L386	L138-F142 HydrophobicContact CB-CD2 4.36Å; L138-F142 HydrophobicContact CD2-CE2 4.31Å; L138-F142 VanDerWaalsContact O-CD2 3.24Å; L138-F142 WeakPolarHBondContact O-CD2 3.34Å; L138-F142 PolarHBondContact O-N 3.15Å; D140-F142 VanDerWaalsContact C-N 3.28Å; D140-F142 PolarHBondContact O-N 3.03Å; F142-W144 VanDerWaalsContact C-N 3.32Å; F142-W144 HydrophobicContact CB-CD2 3.87Å; F142-W144 HydrophobicContact CB-CE3 4.34Å; F142-W144 HydrophobicContact CB-CG 4.17Å; F142-W144 HydrophobicContact CB-CZ2 4.14Å; F142-W144 HydrophobicContact CD1-CZ2 4.25Å; F142-W144 HydrophobicContact CG-CH2 4.43Å; F142-W144 HydrophobicContact CG-CZ2 4.21Å; F142-W144 PolarHBondContact O-N 3.39Å; F142-W318 AromaticContact CD2-CH2 3.68Å; F142-W318 HydrophobicContact CD2-CH2 3.68Å; F142-W318 AromaticContact CD2-CZ2 3.89Å; F142-W318 HydrophobicContact CD2-CZ2 3.89Å; F142-W318 AromaticContact CE2-CH2 3.93Å; F142-W318 HydrophobicContact CE2-CH2 3.93Å; F142-W318 AromaticContact CE2-CZ2 3.63Å; F142-W318 HydrophobicContact CE2-CZ2 3.63Å; F142-W318 HydrophobicContact CZ-CZ2 4.47Å; F142-F322 AromaticContact CE1-CE2 3.9Å; F142-F322 HydrophobicContact CE1-CE2 3.9Å; F142-F322 HydrophobicContact CZ-CD2 4.39Å; F142-F322 AromaticContact CZ-CE2 3.95Å; F142-F322 HydrophobicContact CZ-CE2 3.95Å; F142-L386 HydrophobicContact CZ-CD2 4.47Å
143	G	89.4	Confident	90.4	Very high	59 Å²	59	29.5 Å²	29.5	61%	0.608	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	22.5	177.6	0	0	0	0	0	114.3	V139 D140 I141	V139-G143 PolarHBondContact O-N 3.29Å; D140-G143 PolarHBondContact O-N 2.98Å; I141-G143 VanDerWaalsContact C-N 3.3Å
144	W	90.1	Very high	90.5	Very high	19 Å²	19	29.5 Å²	29.5	7%	0.072	18%	0.18	C	C	.	.			trans	-89.4	-8.5	-177.2	-64	-16.7	0	0	0	113.9	V139 F142 L223 T225 W318 F322 M325	V139-W144 HydrophobicContact CG1-CB 3.79Å; V139-W144 HydrophobicContact CG2-CE3 4.49Å; V139-W144 PolarHBondContact O-N 2.97Å; F142-W144 VanDerWaalsContact C-N 3.32Å; F142-W144 HydrophobicContact CB-CD2 3.87Å; F142-W144 HydrophobicContact CB-CE3 4.34Å; F142-W144 HydrophobicContact CB-CG 4.17Å; F142-W144 HydrophobicContact CB-CZ2 4.14Å; F142-W144 HydrophobicContact CD1-CZ2 4.25Å; F142-W144 HydrophobicContact CG-CH2 4.43Å; F142-W144 HydrophobicContact CG-CZ2 4.21Å; F142-W144 PolarHBondContact O-N 3.39Å; W144-L223 HydrophobicContact CB-CD2 4.25Å; W144-L223 HydrophobicContact CD2-CD1 4.43Å; W144-L223 HydrophobicContact CE3-CD1 3.82Å; W144-L223 HydrophobicContact CE3-CD2 4.34Å; W144-L223 HydrophobicContact CZ3-CD1 4.28Å; W144-T225 HydrophobicContact CB-CG2 3.71Å; W144-T225 HydrophobicContact CG-CG2 4.07Å; W144-T225 WeakPolarHBondContact O-CG2 3.34Å; W144-W318 HydrophobicContact CE3-CH2 4.23Å; W144-W318 HydrophobicContact CE3-CZ3 4.42Å; W144-W318 AromaticContact CH2-CH2 3.99Å; W144-W318 HydrophobicContact CH2-CH2 3.99Å; W144-W318 HydrophobicContact CH2-CZ2 4.32Å; W144-W318 AromaticContact CZ3-CH2 3.46Å; W144-W318 HydrophobicContact CZ3-CH2 3.46Å; W144-W318 VanDerWaalsContact CZ3-CH2 3.46Å; W144-W318 HydrophobicContact CZ3-CZ2 4.18Å; W144-W318 AromaticContact CZ3-CZ3 3.8Å; W144-W318 HydrophobicContact CZ3-CZ3 3.8Å; W144-F322 HydrophobicContact CH2-CB 4.03Å; W144-F322 AromaticContact CH2-CD2 3.69Å; W144-F322 HydrophobicContact CH2-CD2 3.69Å; W144-F322 HydrophobicContact CH2-CG 4.2Å; W144-F322 HydrophobicContact CZ2-CD2 4.24Å; W144-M325 HydrophobicContact CD2-CG 3.91Å; W144-M325 HydrophobicContact CE3-CG 4.14Å; W144-M325 HydrophobicContact CG-CG 4.5Å; W144-M325 HydrophobicContact CH2-CB 4.17Å; W144-M325 HydrophobicContact CH2-CG 4.17Å; W144-M325 HydrophobicContact CZ2-CB 3.74Å; W144-M325 HydrophobicContact CZ2-CG 3.92Å; W144-M325 HydrophobicContact CZ3-CG 4.26Å
145	N	86.6	Confident	90.4	Very high	26 Å²	26	30 Å²	30	14%	0.139	18%	0.182	C	C	.	.			trans	-93	138.5	174.6	-178.2	47.1	0	0	0	111.9	V139 G147 Y172	V139-N145 HydrophobicContact CG1-CB 4.06Å; N145-G147 PolarHBondContact ND2-O 3.49Å; N145-Y172 HydrophobicContact CB-CD2 3.67Å; N145-Y172 HydrophobicContact CB-CE2 3.93Å; N145-Y172 HydrophobicContact CB-CG 4.02Å; N145-Y172 WeakPolarHBondContact ND2-CD1 3.33Å
146	T	77.9	Confident	90.3	Very high	89 Å²	89	30.8 Å²	30.8	55%	0.546	19%	0.186	S	C	.	.			trans	-126.9	101.8	174.7	53.8	0	0	0	0	109.7
147	G	81.5	Confident	90	Very high	45 Å²	45	32.8 Å²	32.8	46%	0.464	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-142.1	-179.9	0	0	0	0	0	113.7	N145	N145-G147 PolarHBondContact ND2-O 3.49Å
148	I	86.8	Confident	89.6	Confident	60 Å²	60	40.3 Å²	40.3	31%	0.308	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	3.1	-171.8	59.8	170.9	0	0	0	113.7	L171	I148-L171 HydrophobicContact CG2-CD2 3.95Å
149	N	82.2	Confident	89.1	Confident	114 Å²	114	47.3 Å²	47.3	61%	0.61	27%	0.266	S	S	*	.			trans	-92.7	-9.6	-166.6	-59.3	1.4	0	0	0	114	H151	N149-H151 PolarHBondContact O-CD2 3.48Å; N149-H151 PolarHBondContact O-NE2 3Å
150	N	86.8	Confident	88.9	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.048	28%	0.281	C	S	.	.			trans	-88.7	150.4	179	-65.9	-18.5	0	0	0	109.9	N166 Y172 S224	N150-N166 PolarHBondContact O-ND2 2.83Å; N150-Y172 VanDerWaalsContact CB-OH 3.24Å; N150-Y172 WeakPolarHBondContact CB-OH 3.35Å; N150-Y172 PolarHBondContact O-OH 3.28Å; N150-S224 WeakPolarHBondContact OD1-CB 3.41Å; N150-S224 PolarHBondContact OD1-OG 3.43Å
151	H	91.7	Very high	88.8	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	29%	0.288	C	S	.	.			trans	-134.5	146.6	-175.2	-62	-78.9	0	0	0	111.5	N149 I165 N166 Y172 D200 S203 H207 H222	N149-H151 PolarHBondContact O-CD2 3.48Å; N149-H151 PolarHBondContact O-NE2 3Å; H151-I165 HydrophobicContact CB-CD1 4.4Å; H151-I165 HydrophobicContact CB-CG1 4.48Å; H151-N166 PolarHBondContact ND1-ND2 3.39Å; H151-N166 PolarHBondContact ND1-OD1 2.85Å; H151-Y172 PolarHBondContact N-OH 3Å; H151-D200 IonicContact NE2-OD2 3.25Å; H151-S203 WeakPolarHBondContact CD2-CB 3.47Å; H151-H207 PolarHBondContact O-CE1 2.94Å; H151-H222 VanDerWaalsContact O-CB 3.23Å; H151-H222 WeakPolarHBondContact O-CB 3.48Å; H151-H222 PolarHBondContact O-N 3.2Å
152	I	95.7	Very high	89	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	120.5	174.5	-49.9	178.4	0	0	0	107.7	L132 V135 Y136 V139 Y172 I220 I221	L132-I152 HydrophobicContact CD1-CB 4.2Å; L132-I152 HydrophobicContact CD1-CG2 3.62Å; V135-I152 HydrophobicContact CG1-CD1 3.73Å; V135-I152 HydrophobicContact CG1-CG2 4.34Å; Y136-I152 HydrophobicContact CD1-CD1 4.03Å; Y136-I152 HydrophobicContact CD1-CG1 4.4Å; Y136-I152 HydrophobicContact CD2-CB 4.43Å; Y136-I152 HydrophobicContact CD2-CD1 4.33Å; Y136-I152 HydrophobicContact CE1-CB 4.12Å; Y136-I152 HydrophobicContact CE1-CD1 4.08Å; Y136-I152 HydrophobicContact CE1-CG1 3.94Å; Y136-I152 HydrophobicContact CE2-CB 3.68Å; Y136-I152 HydrophobicContact CE2-CD1 4.35Å; Y136-I152 HydrophobicContact CE2-CG1 4.29Å; Y136-I152 HydrophobicContact CE2-CG2 4.48Å; Y136-I152 HydrophobicContact CG-CD1 4.18Å; Y136-I152 WeakPolarHBondContact OH-CA 3.45Å; Y136-I152 PolarHBondContact OH-N 2.96Å; Y136-I152 PolarHBondContact OH-O 3.49Å; V139-I152 HydrophobicContact CG2-CD1 3.97Å; I152-Y172 HydrophobicContact CD1-CE2 4.07Å; I152-I220 WeakPolarHBondContact CA-O 3.47Å; I152-I220 WeakPolarHBondContact CG2-O 3.38Å; I152-I221 HydrophobicContact CD1-CG2 4.03Å; I152-I221 HydrophobicContact CG1-CG2 4.19Å; I152-I221 HydrophobicContact CG2-CB 4.33Å; I152-I221 HydrophobicContact CG2-CG1 3.72Å
153	T	96	Very high	89.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.5	-172.7	60.5	0	0	0	0	111.1	L164 I165 W204 H207 H211 C219 I220	T153-L164 VanDerWaalsContact CA-O 3.29Å; T153-L164 WeakPolarHBondContact CA-O 3.5Å; T153-I165 HydrophobicContact CG2-CB 4.38Å; T153-I165 HydrophobicContact CG2-CD1 4.21Å; T153-I165 HydrophobicContact CG2-CG1 4.12Å; T153-W204 HydrophobicContact CG2-CE3 3.82Å; T153-W204 HydrophobicContact CG2-CZ3 3.59Å; T153-H207 HydrophobicContact CG2-CB 3.97Å; T153-H207 VanDerWaalsContact CG2-ND1 3.27Å; T153-H207 WeakPolarHBondContact CG2-ND1 3.45Å; T153-H207 PolarHBondContact OG1-ND1 3.4Å; T153-H211 PolarHBondContact OG1-NE2 2.91Å; T153-C219 VanDerWaalsContact O-CA 3.27Å; T153-C219 WeakPolarHBondContact O-CA 3.24Å; T153-C219 PolarHBondContact O-SG 3.32Å; T153-I220 PolarHBondContact N-O 3.2Å; T153-I220 PolarHBondContact O-N 2.86Å
154	A	96.5	Very high	89.5	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	129.4	175.9	0	0	0	0	0	112.9	I128 L132 Y163 L164 R218 I314	I128-A154 HydrophobicContact CG2-CB 4.05Å; L132-A154 HydrophobicContact CD1-CB 4.19Å; L132-A154 HydrophobicContact CD2-CB 4.12Å; A154-Y163 CarbonylContact O-C 3.43Å; A154-Y163 WeakPolarHBondContact O-CA 3.17Å; A154-L164 PolarHBondContact N-O 3.39Å; A154-L164 VanDerWaalsContact N-O 3.15Å; A154-L164 PolarHBondContact O-N 2.86Å; A154-R218 CarbonylContact C-O 3.58Å; A154-R218 VanDerWaalsContact CA-O 3.28Å; A154-R218 WeakPolarHBondContact CA-O 3.47Å; A154-I314 HydrophobicContact CB-CD1 4.18Å; A154-I314 HydrophobicContact CB-CG1 4.42Å
155	R	95.4	Very high	89.8	Confident	11 Å²	11	43.6 Å²	43.6	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.9	177.5	-166.4	-160.8	-85.6	-88.6	3.4	111	S157 T160 D161 E162 Y163 R218	R155-S157 WeakPolarHBondContact CD-O 3.25Å; R155-S157 WeakPolarHBondContact CG-O 3.47Å; R155-T160 PolarHBondContact NH1-O 3.02Å; R155-D161 IonicContact CZ-OD1 3.15Å; R155-D161 IonicContact NH1-OD1 2.98Å; R155-D161 PolarHBondContact NH1-OD1 3.21Å; R155-D161 IonicContact NH2-OD1 3.92Å; R155-D161 PolarHBondContact NH2-OD1 3.37Å; R155-E162 CarbonylContact C-O 3.53Å; R155-E162 WeakPolarHBondContact CA-O 3.48Å; R155-Y163 HydrophobicContact CB-CD1 3.89Å; R155-Y163 HydrophobicContact CB-CE1 3.88Å; R155-Y163 HydrophobicContact CG-CD1 4.11Å; R155-Y163 HydrophobicContact CG-CE1 3.78Å; R155-Y163 PolarHBondContact NH1-OH 2.92Å; R155-Y163 PolarHBondContact NH2-OH 3.39Å; R155-R218 HydrophobicContact CB-CB 4.49Å; R155-R218 PolarHBondContact N-O 3.23Å; R155-R218 PolarHBondContact O-NH2 3.33Å
156	V	93	Very high	90.1	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.097	23%	0.231	C	C	.	.	S	Bend	trans	-64.6	-55.6	-171.3	176.9	0	0	0	0	112	E125 I128 E162 L164 K182 R218	E125-V156 HydrophobicContact CB-CG1 3.82Å; E125-V156 HydrophobicContact CG-CG1 3.75Å; E125-V156 HydrophobicContact CG-CG2 4.47Å; I128-V156 WeakPolarHBondContact CD1-O 3.44Å; V156-E162 HydrophobicContact CB-CB 4.21Å; V156-E162 HydrophobicContact CG2-CB 4.3Å; V156-E162 PolarHBondContact N-O 3.24Å; V156-L164 HydrophobicContact CG2-CD1 4.14Å; V156-L164 HydrophobicContact CG2-CD2 4.08Å; V156-L164 HydrophobicContact CG2-CG 3.71Å; V156-K182 HydrophobicContact CG2-CD 4.09Å; V156-K182 HydrophobicContact CG2-CG 4.3Å; V156-R218 PolarHBondContact O-NH2 3.1Å
157	S	89.6	Confident	90.9	Very high	42 Å²	42	38.2 Å²	38.2	29%	0.294	21%	0.205	S	C	.	.			trans	-104.3	176.1	171.5	-160	0	0	0	0	111	R155 T160	R155-S157 WeakPolarHBondContact CD-O 3.25Å; R155-S157 WeakPolarHBondContact CG-O 3.47Å; S157-T160 WeakPolarHBondContact CB-OG1 3.4Å
158	R	84	Confident	91.3	Very high	164 Å²	164	39.5 Å²	39.5	62%	0.619	20%	0.201	S	C	*	.	S	Bend	trans	-84.5	-31.2	163.7	-68.4	-176.3	175.6	-149.3	-6	111.4
159	D	84.2	Confident	91.4	Very high	151 Å²	151	38.6 Å²	38.6	81%	0.807	21%	0.207	S	C	*	.	S	Bend	trans	-97.8	2.7	-171.3	-37.8	-57.4	0	0	0	113.3
160	T	87.2	Confident	91.8	Very high	53 Å²	53	34.5 Å²	34.5	33%	0.325	19%	0.185	S	C	.	.	S	Bend	trans	-127.8	144.7	-179.8	67.3	0	0	0	0	111.9	R155 S157 E162	R155-T160 PolarHBondContact NH1-O 3.02Å; S157-T160 WeakPolarHBondContact CB-OG1 3.4Å; T160-E162 PolarHBondContact O-N 3.24Å; T160-E162 VanDerWaalsContact O-N 3.15Å
161	D	90.2	Very high	92	Very high	83 Å²	83	37.5 Å²	37.5	44%	0.444	20%	0.2	S	C	.	.			trans	-85.6	48	172.4	-74	-50.2	0	0	0	111.6	R155 Y163 N184 L185	R155-D161 IonicContact CZ-OD1 3.15Å; R155-D161 IonicContact NH1-OD1 2.98Å; R155-D161 PolarHBondContact NH1-OD1 3.21Å; R155-D161 IonicContact NH2-OD1 3.92Å; R155-D161 PolarHBondContact NH2-OD1 3.37Å; D161-Y163 VanDerWaalsContact C-CE2 3.45Å; D161-Y163 HydrophobicContact CB-CE2 4.18Å; D161-Y163 WeakPolarHBondContact O-CE2 3.34Å; D161-Y163 PolarHBondContact OD1-OH 3.08Å; D161-Y163 VanDerWaalsContact OD1-OH 3.05Å; D161-N184 WeakPolarHBondContact O-CA 3.45Å; D161-L185 HydrophobicContact CB-CD1 4.02Å; D161-L185 HydrophobicContact CB-CG 4.07Å
162	E	94.1	Very high	92	Very high	51 Å²	51	37.5 Å²	37.5	24%	0.238	20%	0.2	C	C	.	.			trans	-108.6	130.2	174.2	-60.6	-168.9	142.4	0	0	110.5	R155 V156 T160 K182 I183 L190	R155-E162 CarbonylContact C-O 3.53Å; R155-E162 WeakPolarHBondContact CA-O 3.48Å; V156-E162 HydrophobicContact CB-CB 4.21Å; V156-E162 HydrophobicContact CG2-CB 4.3Å; V156-E162 PolarHBondContact N-O 3.24Å; T160-E162 PolarHBondContact O-N 3.24Å; T160-E162 VanDerWaalsContact O-N 3.15Å; E162-K182 HydrophobicContact CB-CD 4.18Å; E162-K182 HydrophobicContact CB-CG 4.34Å; E162-K182 WeakPolarHBondContact OE1-CE 3.48Å; E162-K182 IonicContact OE1-NZ 2.66Å; E162-K182 PolarHBondContact OE1-NZ 3.17Å; E162-K182 WeakPolarHBondContact OE2-CE 2.92Å; E162-K182 IonicContact OE2-NZ 2.89Å; E162-K182 PolarHBondContact OE2-NZ 3.33Å; E162-I183 WeakPolarHBondContact CA-O 3.39Å; E162-L190 HydrophobicContact CB-CD1 4.46Å; E162-L190 HydrophobicContact CG-CD1 3.82Å
163	Y	95.6	Very high	91.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151	-175.6	-52.2	-95.5	0	0	0	111.2	A154 R155 D161 K182 I183 L185 W204 H211	A154-Y163 CarbonylContact O-C 3.43Å; A154-Y163 WeakPolarHBondContact O-CA 3.17Å; R155-Y163 HydrophobicContact CB-CD1 3.89Å; R155-Y163 HydrophobicContact CB-CE1 3.88Å; R155-Y163 HydrophobicContact CG-CD1 4.11Å; R155-Y163 HydrophobicContact CG-CE1 3.78Å; R155-Y163 PolarHBondContact NH1-OH 2.92Å; R155-Y163 PolarHBondContact NH2-OH 3.39Å; D161-Y163 VanDerWaalsContact C-CE2 3.45Å; D161-Y163 HydrophobicContact CB-CE2 4.18Å; D161-Y163 WeakPolarHBondContact O-CE2 3.34Å; D161-Y163 PolarHBondContact OD1-OH 3.08Å; D161-Y163 VanDerWaalsContact OD1-OH 3.05Å; Y163-K182 CarbonylContact O-C 3.54Å; Y163-K182 VanDerWaalsContact O-CA 3.29Å; Y163-K182 WeakPolarHBondContact O-CA 3.22Å; Y163-I183 PolarHBondContact N-O 2.93Å; Y163-I183 PolarHBondContact O-N 3Å; Y163-L185 HydrophobicContact CE2-CD2 3.67Å; Y163-L185 HydrophobicContact CE2-CG 3.87Å; Y163-L185 WeakPolarHBondContact OH-CD2 3.39Å; Y163-W204 HydrophobicContact CD1-CH2 4.05Å; Y163-W204 AromaticContact CD2-CH2 3.68Å; Y163-W204 HydrophobicContact CD2-CH2 3.68Å; Y163-W204 AromaticContact CD2-CZ2 3.99Å; Y163-W204 HydrophobicContact CD2-CZ2 3.99Å; Y163-W204 HydrophobicContact CE2-CH2 4.38Å; Y163-W204 AromaticContact CG-CH2 3.5Å; Y163-W204 HydrophobicContact CG-CH2 3.5Å; Y163-W204 VanDerWaalsContact CG-CH2 3.5Å; Y163-W204 HydrophobicContact CG-CZ2 4.26Å; Y163-W204 HydrophobicContact CG-CZ3 4.38Å; Y163-H211 AromaticContact CD1-CD2 3.61Å; Y163-H211 AromaticContact CD1-NE2 3.68Å; Y163-H211 HydrophobicContact CE1-CB 3.71Å; Y163-H211 AromaticContact CE1-CD2 3.51Å; Y163-H211 AromaticContact CE1-CE1 3.99Å; Y163-H211 AromaticContact CE1-CG 3.42Å; Y163-H211 VanDerWaalsContact CE1-CG 3.42Å; Y163-H211 AromaticContact CE1-ND1 3.73Å; Y163-H211 AromaticContact CE1-NE2 3.89Å
164	L	95.2	Very high	91.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.4	171.2	-61.5	170.5	0	0	0	109.4	I128 R129 L132 T153 A154 V156 F180 V181 K182	I128-L164 HydrophobicContact CG2-CD1 3.86Å; R129-L164 HydrophobicContact CG-CD1 3.6Å; R129-L164 HydrophobicContact CG-CD2 4.36Å; L132-L164 HydrophobicContact CD2-CB 3.7Å; L132-L164 HydrophobicContact CD2-CD1 4.39Å; T153-L164 VanDerWaalsContact CA-O 3.29Å; T153-L164 WeakPolarHBondContact CA-O 3.5Å; A154-L164 PolarHBondContact N-O 3.39Å; A154-L164 VanDerWaalsContact N-O 3.15Å; A154-L164 PolarHBondContact O-N 2.86Å; V156-L164 HydrophobicContact CG2-CD1 4.14Å; V156-L164 HydrophobicContact CG2-CD2 4.08Å; V156-L164 HydrophobicContact CG2-CG 3.71Å; L164-F180 HydrophobicContact CB-CB 4.35Å; L164-F180 HydrophobicContact CD2-CB 4.25Å; L164-V181 WeakPolarHBondContact CA-O 3.24Å; L164-K182 HydrophobicContact CD2-CB 4.11Å; L164-K182 HydrophobicContact CD2-CG 4.2Å
165	I	95.2	Very high	91.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	153.5	174.1	-166.2	168.9	0	0	0	109.9	H151 T153 F180 V181 I183 I199 W204	H151-I165 HydrophobicContact CB-CD1 4.4Å; H151-I165 HydrophobicContact CB-CG1 4.48Å; T153-I165 HydrophobicContact CG2-CB 4.38Å; T153-I165 HydrophobicContact CG2-CD1 4.21Å; T153-I165 HydrophobicContact CG2-CG1 4.12Å; I165-F180 WeakPolarHBondContact O-CD1 3.45Å; I165-V181 HydrophobicContact CG2-CB 4.36Å; I165-V181 PolarHBondContact N-O 3.38Å; I165-V181 VanDerWaalsContact N-O 3.11Å; I165-V181 PolarHBondContact O-N 2.89Å; I165-V181 VanDerWaalsContact O-N 3.12Å; I165-I183 HydrophobicContact CB-CD1 4.24Å; I165-I183 HydrophobicContact CG2-CD1 3.8Å; I165-I183 HydrophobicContact CG2-CG1 4.46Å; I165-I183 HydrophobicContact CG2-CG2 4.28Å; I165-I199 HydrophobicContact CG2-CB 4.27Å; I165-I199 HydrophobicContact CG2-CG2 3.61Å; I165-W204 HydrophobicContact CD1-CB 4.17Å; I165-W204 HydrophobicContact CD1-CE3 4.08Å
166	N	94	Very high	91.2	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-64.4	139.6	168.2	58.2	-51.8	0	0	0	111.1	Y136 N150 H151 L175 F180	Y136-N166 HydrophobicContact CE1-CB 3.94Å; Y136-N166 WeakPolarHBondContact OH-CB 3.37Å; Y136-N166 VanDerWaalsContact OH-CG 3.3Å; Y136-N166 PolarHBondContact OH-N 3.5Å; Y136-N166 PolarHBondContact OH-OD1 3.44Å; N150-N166 PolarHBondContact O-ND2 2.83Å; H151-N166 PolarHBondContact ND1-ND2 3.39Å; H151-N166 PolarHBondContact ND1-OD1 2.85Å; N166-L175 HydrophobicContact CB-CD1 3.75Å; N166-L175 HydrophobicContact CB-CD2 3.86Å; N166-L175 HydrophobicContact CB-CG 4.49Å; N166-F180 HydrophobicContact CB-CE1 4.47Å
167	P	93	Very high	91.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-63.1	148.9	163.3	28.6	-34.9	0	0	0	110.5	L170 L175 S179 V181 L197 G198	P167-L170 HydrophobicContact CG-CD1 3.68Å; P167-L170 HydrophobicContact CG-CG 4.15Å; P167-L175 HydrophobicContact CG-CD2 4.33Å; P167-S179 WeakPolarHBondContact CD-O 3.5Å; P167-V181 HydrophobicContact CB-CG2 4.15Å; P167-L197 HydrophobicContact CB-CB 3.83Å; P167-G198 CarbonylContact C-O 3.55Å; P167-G198 VanDerWaalsContact CA-O 3.3Å; P167-G198 WeakPolarHBondContact CA-O 3.42Å
168	I	90.8	Very high	91.3	Very high	72 Å²	72	42.5 Å²	42.5	37%	0.369	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	139.4	175.9	-164.1	174.1	0	0	0	110.6	L197 G198 D200	I168-L197 WeakPolarHBondContact O-CD1 3.45Å; I168-G198 WeakPolarHBondContact CG2-O 3.42Å; I168-G198 PolarHBondContact N-O 2.86Å; I168-D200 HydrophobicContact CD1-CB 4.23Å
169	G	88.2	Confident	91.7	Very high	42 Å²	42	34.7 Å²	34.7	43%	0.433	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	-6.7	174.1	0	0	0	0	0	116.4
170	L	90.8	Very high	92.1	Very high	27 Å²	27	27.5 Å²	27.5	14%	0.141	15%	0.154	C	C	.	.			trans	-91.2	142.3	169.9	-62.8	-172.9	0	0	0	111.5	P167 E174 L175 V195 L197	P167-L170 HydrophobicContact CG-CD1 3.68Å; P167-L170 HydrophobicContact CG-CG 4.15Å; L170-E174 HydrophobicContact CB-CB 4.44Å; L170-L175 HydrophobicContact CB-CD2 4.18Å; L170-L175 HydrophobicContact CB-CG 4.42Å; L170-L175 HydrophobicContact CD1-CD2 3.93Å; L170-V195 HydrophobicContact CD1-CG2 4.28Å; L170-L197 HydrophobicContact CD2-CD1 4.19Å; L170-L197 HydrophobicContact CG-CD1 4.28Å
171	L	91.5	Very high	92.4	Very high	73 Å²	73	25 Å²	25	38%	0.382	14%	0.138	S	C	.	.			trans	-75.2	157.5	167.6	-66.5	172.1	0	0	0	111	I148 N173 E174 L175	I148-L171 HydrophobicContact CG2-CD2 3.95Å; L171-N173 WeakPolarHBondContact CB-OD1 3.24Å; L171-N173 PolarHBondContact O-N 3.15Å; L171-E174 HydrophobicContact CB-CG 4.22Å; L171-E174 WeakPolarHBondContact CB-OE2 3.48Å; L171-E174 PolarHBondContact N-OE2 3.42Å; L171-E174 WeakPolarHBondContact O-CB 3.45Å; L171-E174 PolarHBondContact O-N 3Å; L171-L175 PolarHBondContact O-N 2.85Å
172	Y	91.9	Very high	92.6	Very high	1 Å²	1	22.1 Å²	22.1	0%	0.004	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.1	-179	-81.5	30.6	0	0	0	112.7	Y136 R137 V139 N145 N150 H151 I152 E174 L175	Y136-Y172 AromaticContact CD1-CD1 3.69Å; Y136-Y172 HydrophobicContact CD1-CD1 3.69Å; Y136-Y172 AromaticContact CD1-CD2 3.6Å; Y136-Y172 HydrophobicContact CD1-CD2 3.6Å; Y136-Y172 AromaticContact CD1-CE1 3.61Å; Y136-Y172 HydrophobicContact CD1-CE1 3.61Å; Y136-Y172 AromaticContact CD1-CE2 3.51Å; Y136-Y172 HydrophobicContact CD1-CE2 3.51Å; Y136-Y172 AromaticContact CD1-CG 3.68Å; Y136-Y172 HydrophobicContact CD1-CG 3.68Å; Y136-Y172 AromaticContact CD1-CZ 3.51Å; Y136-Y172 HydrophobicContact CE1-CD1 4.12Å; Y136-Y172 HydrophobicContact CE1-CD2 4.45Å; Y136-Y172 AromaticContact CE1-CE1 3.61Å; Y136-Y172 HydrophobicContact CE1-CE1 3.61Å; Y136-Y172 AromaticContact CE1-CE2 3.98Å; Y136-Y172 HydrophobicContact CE1-CE2 3.98Å; Y136-Y172 AromaticContact CE1-CZ 3.52Å; Y136-Y172 HydrophobicContact CG-CD2 4.41Å; R137-Y172 VanDerWaalsContact CD-O 3.22Å; R137-Y172 WeakPolarHBondContact CD-O 3.31Å; V139-Y172 HydrophobicContact CB-CD2 3.92Å; V139-Y172 HydrophobicContact CB-CE2 4.01Å; V139-Y172 HydrophobicContact CG1-CD2 3.9Å; V139-Y172 HydrophobicContact CG1-CE2 3.7Å; N145-Y172 HydrophobicContact CB-CD2 3.67Å; N145-Y172 HydrophobicContact CB-CE2 3.93Å; N145-Y172 HydrophobicContact CB-CG 4.02Å; N145-Y172 WeakPolarHBondContact ND2-CD1 3.33Å; N150-Y172 VanDerWaalsContact CB-OH 3.24Å; N150-Y172 WeakPolarHBondContact CB-OH 3.35Å; N150-Y172 PolarHBondContact O-OH 3.28Å; H151-Y172 PolarHBondContact N-OH 3Å; I152-Y172 HydrophobicContact CD1-CE2 4.07Å; Y172-E174 VanDerWaalsContact C-N 3.32Å; Y172-L175 HydrophobicContact CD1-CD1 4.38Å
173	N	89.9	Confident	92.6	Very high	67 Å²	67	19.7 Å²	19.7	36%	0.358	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	3.4	172.3	66.1	-0	0	0	0	115.1	R137 D140 L171	R137-N173 VanDerWaalsContact CZ-C 3.41Å; R137-N173 VanDerWaalsContact NH1-C 3.29Å; R137-N173 PolarHBondContact NH1-O 2.93Å; R137-N173 PolarHBondContact NH2-O 3.05Å; D140-N173 WeakPolarHBondContact OD2-CB 3.44Å; L171-N173 WeakPolarHBondContact CB-OD1 3.24Å; L171-N173 PolarHBondContact O-N 3.15Å
174	E	90.6	Very high	92.5	Very high	93 Å²	93	21.2 Å²	21.2	44%	0.435	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-26	173	-66.3	172.6	141.7	0	0	111.4	R137 L170 L171 Y172	R137-E174 PolarHBondContact NH2-O 3.18Å; L170-E174 HydrophobicContact CB-CB 4.44Å; L171-E174 HydrophobicContact CB-CG 4.22Å; L171-E174 WeakPolarHBondContact CB-OE2 3.48Å; L171-E174 PolarHBondContact N-OE2 3.42Å; L171-E174 WeakPolarHBondContact O-CB 3.45Å; L171-E174 PolarHBondContact O-N 3Å; Y172-E174 VanDerWaalsContact C-N 3.32Å
175	L	92.6	Very high	92.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.			trans	-61.1	136.3	-177.7	-71.2	168.4	0	0	0	113.8	Y136 R137 N166 P167 L170 L171 Y172 S179 F180	Y136-L175 HydrophobicContact CD1-CD1 3.19Å; Y136-L175 HydrophobicContact CD2-CD1 4.08Å; Y136-L175 HydrophobicContact CE1-CD1 3.49Å; Y136-L175 VanDerWaalsContact CE1-CD1 3.49Å; Y136-L175 HydrophobicContact CE2-CD1 4.33Å; Y136-L175 HydrophobicContact CG-CD1 3.51Å; R137-L175 VanDerWaalsContact CZ-O 3.26Å; R137-L175 PolarHBondContact NE-O 2.92Å; R137-L175 PolarHBondContact NH2-O 3.29Å; N166-L175 HydrophobicContact CB-CD1 3.75Å; N166-L175 HydrophobicContact CB-CD2 3.86Å; N166-L175 HydrophobicContact CB-CG 4.49Å; P167-L175 HydrophobicContact CG-CD2 4.33Å; L170-L175 HydrophobicContact CB-CD2 4.18Å; L170-L175 HydrophobicContact CB-CG 4.42Å; L170-L175 HydrophobicContact CD1-CD2 3.93Å; L171-L175 PolarHBondContact O-N 2.85Å; Y172-L175 HydrophobicContact CD1-CD1 4.38Å; L175-S179 WeakPolarHBondContact CD2-OG 3.19Å; L175-F180 HydrophobicContact CD2-CE1 4.35Å
176	T	93.1	Very high	91.8	Very high	11 Å²	11	29.8 Å²	29.8	7%	0.067	16%	0.16	C	C	.	.			trans	-131.7	168.5	178.9	67.8	0	0	0	0	111.2	V108 D112 S178 S179	V108-T176 HydrophobicContact CG1-CG2 3.6Å; D112-T176 HydrophobicContact CB-CG2 4.45Å; D112-T176 WeakPolarHBondContact OD1-CB 3.21Å; D112-T176 PolarHBondContact OD1-OG1 3.12Å; D112-T176 WeakPolarHBondContact OD2-CB 3.44Å; D112-T176 PolarHBondContact OD2-OG1 2.85Å; T176-S178 VanDerWaalsContact C-N 3.27Å; T176-S178 PolarHBondContact O-N 3.44Å; T176-S178 PolarHBondContact OG1-OG 3.05Å; T176-S179 PolarHBondContact N-OG 3.46Å; T176-S179 PolarHBondContact O-N 3.04Å; T176-S179 VanDerWaalsContact O-N 3.11Å; T176-S179 PolarHBondContact O-OG 3.09Å; T176-S179 PolarHBondContact OG1-N 3.47Å
177	A	92.9	Very high	91.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-36	178.5	0	0	0	0	0	113.2	I110 D112 L113 R129	I110-A177 VanDerWaalsContact O-CB 3.3Å; I110-A177 WeakPolarHBondContact O-CB 3.42Å; I110-A177 PolarHBondContact O-N 3.4Å; D112-A177 PolarHBondContact OD1-N 3.24Å; L113-A177 HydrophobicContact CD1-CB 4.09Å; L113-A177 HydrophobicContact CD2-CB 4.16Å; L113-A177 HydrophobicContact CG-CB 3.89Å; R129-A177 HydrophobicContact CB-CB 4Å; R129-A177 WeakPolarHBondContact CD-O 3.45Å; R129-A177 PolarHBondContact NH1-O 3.32Å
178	S	91.6	Very high	91.4	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.021	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-26.5	176.1	79.6	0	0	0	0	113.5	D112 T176 F180 G193 S194	D112-S178 VanDerWaalsContact CG-OG 3.26Å; D112-S178 WeakPolarHBondContact OD1-CB 3.32Å; D112-S178 PolarHBondContact OD1-N 3.1Å; D112-S178 PolarHBondContact OD1-OG 3.41Å; D112-S178 WeakPolarHBondContact OD2-CB 3.37Å; D112-S178 PolarHBondContact OD2-OG 3.16Å; T176-S178 VanDerWaalsContact C-N 3.27Å; T176-S178 PolarHBondContact O-N 3.44Å; T176-S178 PolarHBondContact OG1-OG 3.05Å; S178-F180 VanDerWaalsContact C-N 3.32Å; S178-F180 PolarHBondContact O-N 3.12Å; S178-G193 CarbonylContact O-C 3.49Å; S178-G193 WeakPolarHBondContact O-CA 3.49Å; S178-S194 PolarHBondContact O-N 3Å; S178-S194 PolarHBondContact O-OG 2.71Å; S178-S194 WeakPolarHBondContact OG-CB 3.45Å; S178-S194 PolarHBondContact OG-OG 3.28Å
179	S	92.4	Very high	91.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.007	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.8	-173.8	71	0	0	0	0	115	P167 L175 T176 S194	P167-S179 WeakPolarHBondContact CD-O 3.5Å; L175-S179 WeakPolarHBondContact CD2-OG 3.19Å; T176-S179 PolarHBondContact N-OG 3.46Å; T176-S179 PolarHBondContact O-N 3.04Å; T176-S179 VanDerWaalsContact O-N 3.11Å; T176-S179 PolarHBondContact O-OG 3.09Å; T176-S179 PolarHBondContact OG1-N 3.47Å; S179-S194 PolarHBondContact N-OG 2.84Å
180	F	94.1	Very high	91.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-67.9	135	-175.3	-65.2	-59.7	0	0	0	114	R129 L132 A133 Y136 L164 I165 N166 L175 S178	R129-F180 HydrophobicContact CB-CD2 4.43Å; R129-F180 HydrophobicContact CG-CD2 4.46Å; R129-F180 PolarHBondContact NH1-O 2.68Å; R129-F180 WeakPolarHBondContact O-CE2 3.34Å; L132-F180 HydrophobicContact CB-CE2 3.91Å; L132-F180 HydrophobicContact CB-CZ 4.11Å; L132-F180 HydrophobicContact CD2-CD1 3.98Å; L132-F180 HydrophobicContact CD2-CD2 4.07Å; L132-F180 HydrophobicContact CD2-CE1 3.84Å; L132-F180 HydrophobicContact CD2-CE2 3.9Å; L132-F180 HydrophobicContact CD2-CG 4.11Å; L132-F180 HydrophobicContact CD2-CZ 3.8Å; L132-F180 HydrophobicContact CG-CE1 4.02Å; L132-F180 HydrophobicContact CG-CE2 3.85Å; L132-F180 HydrophobicContact CG-CZ 3.59Å; A133-F180 HydrophobicContact CB-CE2 3.6Å; A133-F180 HydrophobicContact CB-CZ 3.9Å; Y136-F180 AromaticContact CD2-CE1 3.75Å; Y136-F180 HydrophobicContact CD2-CE1 3.75Å; Y136-F180 AromaticContact CD2-CZ 3.59Å; Y136-F180 HydrophobicContact CD2-CZ 3.59Å; Y136-F180 AromaticContact CE2-CE1 3.36Å; Y136-F180 HydrophobicContact CE2-CE1 3.36Å; Y136-F180 AromaticContact CE2-CZ 3.66Å; Y136-F180 HydrophobicContact CE2-CZ 3.66Å; L164-F180 HydrophobicContact CB-CB 4.35Å; L164-F180 HydrophobicContact CD2-CB 4.25Å; I165-F180 WeakPolarHBondContact O-CD1 3.45Å; N166-F180 HydrophobicContact CB-CE1 4.47Å; L175-F180 HydrophobicContact CD2-CE1 4.35Å; S178-F180 VanDerWaalsContact C-N 3.32Å; S178-F180 PolarHBondContact O-N 3.12Å
181	V	93.7	Very high	91.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	135.4	173.1	-174.1	0	0	0	0	108.9	L164 I165 P167 I183 I189 I199	L164-V181 WeakPolarHBondContact CA-O 3.24Å; I165-V181 HydrophobicContact CG2-CB 4.36Å; I165-V181 PolarHBondContact N-O 3.38Å; I165-V181 VanDerWaalsContact N-O 3.11Å; I165-V181 PolarHBondContact O-N 2.89Å; I165-V181 VanDerWaalsContact O-N 3.12Å; P167-V181 HydrophobicContact CB-CG2 4.15Å; V181-I183 HydrophobicContact CG1-CG2 3.9Å; V181-I189 HydrophobicContact CG1-CB 4.25Å; V181-I189 HydrophobicContact CG1-CD1 4.1Å; V181-I189 HydrophobicContact CG1-CG1 3.85Å; V181-I189 HydrophobicContact CG1-CG2 3.53Å; V181-I199 HydrophobicContact CB-CG2 4.09Å; V181-I199 HydrophobicContact CG1-CG2 4.01Å; V181-I199 HydrophobicContact CG2-CG2 4.32Å
182	K	93.8	Very high	91.3	Very high	22 Å²	22	35 Å²	35	10%	0.096	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.1	173.6	-162.7	176.8	72.9	163.3	0	110.2	V156 E162 Y163 L164 L190 V191	V156-K182 HydrophobicContact CG2-CD 4.09Å; V156-K182 HydrophobicContact CG2-CG 4.3Å; E162-K182 HydrophobicContact CB-CD 4.18Å; E162-K182 HydrophobicContact CB-CG 4.34Å; E162-K182 WeakPolarHBondContact OE1-CE 3.48Å; E162-K182 IonicContact OE1-NZ 2.66Å; E162-K182 PolarHBondContact OE1-NZ 3.17Å; E162-K182 WeakPolarHBondContact OE2-CE 2.92Å; E162-K182 IonicContact OE2-NZ 2.89Å; E162-K182 PolarHBondContact OE2-NZ 3.33Å; Y163-K182 CarbonylContact O-C 3.54Å; Y163-K182 VanDerWaalsContact O-CA 3.29Å; Y163-K182 WeakPolarHBondContact O-CA 3.22Å; L164-K182 HydrophobicContact CD2-CB 4.11Å; L164-K182 HydrophobicContact CD2-CG 4.2Å; K182-L190 PolarHBondContact O-N 3.26Å; K182-V191 HydrophobicContact CB-CB 3.97Å; K182-V191 PolarHBondContact N-O 3.2Å; K182-V191 PolarHBondContact O-N 2.96Å
183	I	94.4	Very high	91	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	160.2	-172.6	66.1	177.7	0	0	0	111.8	E162 Y163 I165 V181 S188 I189 I199 W204	E162-I183 WeakPolarHBondContact CA-O 3.39Å; Y163-I183 PolarHBondContact N-O 2.93Å; Y163-I183 PolarHBondContact O-N 3Å; I165-I183 HydrophobicContact CB-CD1 4.24Å; I165-I183 HydrophobicContact CG2-CD1 3.8Å; I165-I183 HydrophobicContact CG2-CG1 4.46Å; I165-I183 HydrophobicContact CG2-CG2 4.28Å; V181-I183 HydrophobicContact CG1-CG2 3.9Å; I183-S188 VanDerWaalsContact CA-O 3.27Å; I183-S188 WeakPolarHBondContact CA-O 3.46Å; I183-I189 HydrophobicContact CG2-CG1 4.17Å; I183-I199 HydrophobicContact CD1-CD1 4.19Å; I183-I199 HydrophobicContact CG2-CD1 4Å; I183-I199 HydrophobicContact CG2-CG2 4.34Å; I183-W204 HydrophobicContact CD1-CD2 3.32Å; I183-W204 HydrophobicContact CD1-CE3 3.6Å; I183-W204 HydrophobicContact CD1-CG 3.9Å; I183-W204 HydrophobicContact CD1-CH2 3.89Å; I183-W204 HydrophobicContact CD1-CZ2 3.62Å; I183-W204 HydrophobicContact CD1-CZ3 3.87Å; I183-W204 HydrophobicContact CG1-CH2 4.27Å; I183-W204 HydrophobicContact CG1-CZ2 4.03Å
184	N	92.8	Very high	90.7	Very high	33 Å²	33	34.9 Å²	34.9	18%	0.176	19%	0.189	C	C	.	.			trans	-93.9	177.7	169.2	66.1	-3.5	0	0	0	111.9	D161 E186 G187 S188 L190 W204	D161-N184 WeakPolarHBondContact O-CA 3.45Å; N184-E186 PolarHBondContact ND2-OE2 2.89Å; N184-E186 PolarHBondContact O-N 3.24Å; N184-E186 PolarHBondContact OD1-N 2.95Å; N184-G187 PolarHBondContact O-N 3.45Å; N184-G187 PolarHBondContact OD1-N 3.15Å; N184-G187 VanDerWaalsContact OD1-N 3.16Å; N184-S188 PolarHBondContact N-O 3.23Å; N184-S188 VanDerWaalsContact N-O 3.15Å; N184-S188 WeakPolarHBondContact OD1-CA 3.5Å; N184-S188 VanDerWaalsContact OD1-CB 3.3Å; N184-S188 WeakPolarHBondContact OD1-CB 3.49Å; N184-S188 PolarHBondContact OD1-N 2.92Å; N184-S188 PolarHBondContact OD1-O 3.35Å; N184-L190 HydrophobicContact CB-CD1 4.22Å; N184-L190 HydrophobicContact CB-CD2 4.49Å; N184-L190 HydrophobicContact CB-CG 4.42Å; N184-W204 WeakPolarHBondContact O-CZ2 3.13Å
185	L	90.3	Very high	90.5	Very high	33 Å²	33	32.5 Å²	32.5	17%	0.173	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-38.4	176	-79.7	173.2	0	0	0	112.4	D161 Y163 G187 W204	D161-L185 HydrophobicContact CB-CD1 4.02Å; D161-L185 HydrophobicContact CB-CG 4.07Å; Y163-L185 HydrophobicContact CE2-CD2 3.67Å; Y163-L185 HydrophobicContact CE2-CG 3.87Å; Y163-L185 WeakPolarHBondContact OH-CD2 3.39Å; L185-G187 PolarHBondContact O-N 3.46Å; L185-W204 PolarHBondContact O-NE1 2.94Å
186	E	86.5	Confident	90.1	Very high	146 Å²	146	39.6 Å²	39.6	68%	0.682	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-5.1	-179.5	-59.4	72.4	-159.6	0	0	113.8	N184 S188	N184-E186 PolarHBondContact ND2-OE2 2.89Å; N184-E186 PolarHBondContact O-N 3.24Å; N184-E186 PolarHBondContact OD1-N 2.95Å; E186-S188 VanDerWaalsContact C-N 3.32Å; E186-S188 PolarHBondContact O-N 3.27Å
187	G	87.7	Confident	89.8	Confident	2 Å²	2	42.3 Å²	42.3	2%	0.021	23%	0.232	C	C	.	.			trans	74.7	19.4	-178.3	0	0	0	0	0	114.4	N184 L185	N184-G187 PolarHBondContact O-N 3.45Å; N184-G187 PolarHBondContact OD1-N 3.15Å; N184-G187 VanDerWaalsContact OD1-N 3.16Å; L185-G187 PolarHBondContact O-N 3.46Å
188	S	90.9	Very high	89.6	Confident	58 Å²	58	44 Å²	44	41%	0.406	25%	0.249	S	C	.	.			trans	-80.5	137.7	167.1	-59.8	0	0	0	0	110.3	I183 N184 E186 L190	I183-S188 VanDerWaalsContact CA-O 3.27Å; I183-S188 WeakPolarHBondContact CA-O 3.46Å; N184-S188 PolarHBondContact N-O 3.23Å; N184-S188 VanDerWaalsContact N-O 3.15Å; N184-S188 WeakPolarHBondContact OD1-CA 3.5Å; N184-S188 VanDerWaalsContact OD1-CB 3.3Å; N184-S188 WeakPolarHBondContact OD1-CB 3.49Å; N184-S188 PolarHBondContact OD1-N 2.92Å; N184-S188 PolarHBondContact OD1-O 3.35Å; E186-S188 VanDerWaalsContact C-N 3.32Å; E186-S188 PolarHBondContact O-N 3.27Å; S188-L190 PolarHBondContact O-N 3.41Å
189	I	92.2	Very high	89.5	Confident	72 Å²	72	44.8 Å²	44.8	37%	0.369	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	118.7	-179.4	-61.5	172.4	0	0	0	109.3	V181 I183	V181-I189 HydrophobicContact CG1-CB 4.25Å; V181-I189 HydrophobicContact CG1-CD1 4.1Å; V181-I189 HydrophobicContact CG1-CG1 3.85Å; V181-I189 HydrophobicContact CG1-CG2 3.53Å; I183-I189 HydrophobicContact CG2-CG1 4.17Å
190	L	90.8	Very high	89.4	Confident	79 Å²	79	46.6 Å²	46.6	41%	0.414	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-41.2	177.1	-61.2	176.1	0	0	0	111.7	E162 K182 N184 S188	E162-L190 HydrophobicContact CB-CD1 4.46Å; E162-L190 HydrophobicContact CG-CD1 3.82Å; K182-L190 PolarHBondContact O-N 3.26Å; N184-L190 HydrophobicContact CB-CD1 4.22Å; N184-L190 HydrophobicContact CB-CD2 4.49Å; N184-L190 HydrophobicContact CB-CG 4.42Å; S188-L190 PolarHBondContact O-N 3.41Å
191	V	88.7	Confident	89.1	Confident	53 Å²	53	54.8 Å²	54.8	32%	0.321	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	119.4	178.4	-179.9	0	0	0	0	108.6	Y121 K182	Y121-V191 HydrophobicContact CE1-CG1 4.28Å; K182-V191 HydrophobicContact CB-CB 3.97Å; K182-V191 PolarHBondContact N-O 3.2Å; K182-V191 PolarHBondContact O-N 2.96Å
192	Q	86.8	Confident	88.6	Confident	62 Å²	62	62.4 Å²	62.4	29%	0.29	33%	0.329	S	S	.	.			trans	-65.5	145.8	172.3	-165.4	59.3	30.5	0	0	110.4	V195 L197	Q192-V195 PolarHBondContact NE2-O 3.47Å; Q192-L197 PolarHBondContact NE2-O 3.12Å
193	G	84.6	Confident	88.1	Confident	10 Å²	10	62.8 Å²	62.8	10%	0.103	34%	0.335	C	S	.	.			trans	-70.9	-172.3	170.2	0	0	0	0	0	112.1	S178 V195	S178-G193 CarbonylContact O-C 3.49Å; S178-G193 WeakPolarHBondContact O-CA 3.49Å; G193-V195 PolarHBondContact O-N 3.31Å
194	S	85.2	Confident	88	Confident	55 Å²	55	63 Å²	63	39%	0.385	34%	0.335	S	S	.	.	S	Bend	trans	-68.1	-5.5	169	57.7	0	0	0	0	114.5	S178 S179	S178-S194 PolarHBondContact O-N 3Å; S178-S194 PolarHBondContact O-OG 2.71Å; S178-S194 WeakPolarHBondContact OG-CB 3.45Å; S178-S194 PolarHBondContact OG-OG 3.28Å; S179-S194 PolarHBondContact N-OG 2.84Å
195	V	84.8	Confident	87.8	Confident	43 Å²	43	63.3 Å²	63.3	26%	0.261	34%	0.337	S	S	.	.	S	Bend	trans	-122	121.6	-177.2	-174.7	0	0	0	0	107.9	L170 Q192 G193 L197	L170-V195 HydrophobicContact CD1-CG2 4.28Å; Q192-V195 PolarHBondContact NE2-O 3.47Å; G193-V195 PolarHBondContact O-N 3.31Å; V195-L197 HydrophobicContact CG1-CB 4.17Å; V195-L197 HydrophobicContact CG1-CD1 3.54Å; V195-L197 HydrophobicContact CG1-CG 3.72Å; V195-L197 PolarHBondContact O-N 2.92Å
196	D	84	Confident	87.9	Confident	149 Å²	149	62.8 Å²	62.8	80%	0.797	33%	0.334	S	S	*	.			trans	-79.3	52.5	-177.2	-65.1	-34.5	0	0	0	112.4
197	L	88.1	Confident	88.3	Confident	68 Å²	68	55.8 Å²	55.8	36%	0.356	30%	0.301	S	S	.	.			trans	-111.6	151.2	176.7	-71.4	172.8	0	0	0	110.9	P167 I168 L170 Q192 V195	P167-L197 HydrophobicContact CB-CB 3.83Å; I168-L197 WeakPolarHBondContact O-CD1 3.45Å; L170-L197 HydrophobicContact CD2-CD1 4.19Å; L170-L197 HydrophobicContact CG-CD1 4.28Å; Q192-L197 PolarHBondContact NE2-O 3.12Å; V195-L197 HydrophobicContact CG1-CB 4.17Å; V195-L197 HydrophobicContact CG1-CD1 3.54Å; V195-L197 HydrophobicContact CG1-CG 3.72Å; V195-L197 PolarHBondContact O-N 2.92Å
198	G	87.8	Confident	88.6	Confident	35 Å²	35	55.8 Å²	55.8	36%	0.361	30%	0.301	S	S	.	.			trans	-74.9	-172.1	179.6	0	0	0	0	0	113.9	P167 I168	P167-G198 CarbonylContact C-O 3.55Å; P167-G198 VanDerWaalsContact CA-O 3.3Å; P167-G198 WeakPolarHBondContact CA-O 3.42Å; I168-G198 WeakPolarHBondContact CG2-O 3.42Å; I168-G198 PolarHBondContact N-O 2.86Å
199	I	91	Very high	88.7	Confident	20 Å²	20	53 Å²	53	10%	0.103	28%	0.281	C	S	.	.			trans	-114.2	151.9	172.2	70.1	-179.3	0	0	0	109.3	I165 V181 I183 R201	I165-I199 HydrophobicContact CG2-CB 4.27Å; I165-I199 HydrophobicContact CG2-CG2 3.61Å; V181-I199 HydrophobicContact CB-CG2 4.09Å; V181-I199 HydrophobicContact CG1-CG2 4.01Å; V181-I199 HydrophobicContact CG2-CG2 4.32Å; I183-I199 HydrophobicContact CD1-CD1 4.19Å; I183-I199 HydrophobicContact CG2-CD1 4Å; I183-I199 HydrophobicContact CG2-CG2 4.34Å; I199-R201 HydrophobicContact CD1-CG 4.29Å; I199-R201 HydrophobicContact CG1-CG 4.02Å; I199-R201 PolarHBondContact O-N 3.49Å
200	D	89.7	Confident	88.8	Confident	39 Å²	39	49.6 Å²	49.6	21%	0.209	26%	0.264	C	S	.	.			trans	-73.9	106.3	161.5	-179.5	7	0	0	0	109.1	H151 I168 Q202 S203 W204	H151-D200 IonicContact NE2-OD2 3.25Å; I168-D200 HydrophobicContact CD1-CB 4.23Å; D200-Q202 VanDerWaalsContact C-N 3.33Å; D200-Q202 WeakPolarHBondContact OD1-CB 3.47Å; D200-Q202 PolarHBondContact OD1-N 3.27Å; D200-S203 PolarHBondContact OD1-N 3.48Å; D200-S203 WeakPolarHBondContact OD2-CB 3.17Å; D200-S203 PolarHBondContact OD2-N 3.23Å; D200-S203 PolarHBondContact OD2-OG 2.93Å; D200-W204 VanDerWaalsContact O-CB 3.27Å; D200-W204 WeakPolarHBondContact O-CB 3.34Å; D200-W204 PolarHBondContact O-N 3.03Å; D200-W204 VanDerWaalsContact O-N 3.12Å
201	R	87	Confident	89	Confident	171 Å²	171	45.9 Å²	45.9	65%	0.645	24%	0.244	S	C	*	.	H	α-helix	trans	-68.2	-31.4	177.3	-72.6	-176	170.8	175.1	-1.5	112.6	I199 W204 M205	I199-R201 HydrophobicContact CD1-CG 4.29Å; I199-R201 HydrophobicContact CG1-CG 4.02Å; I199-R201 PolarHBondContact O-N 3.49Å; R201-W204 PolarHBondContact O-N 2.6Å; R201-M205 VanDerWaalsContact O-CG 3.3Å; R201-M205 WeakPolarHBondContact O-CG 3.36Å; R201-M205 PolarHBondContact O-N 3.48Å
202	Q	82.8	Confident	89.2	Confident	160 Å²	160	44.7 Å²	44.7	75%	0.748	24%	0.238	S	C	*	.	H	α-helix	trans	-74.6	-45.1	-174	-169.4	171.1	-9.3	0	0	110.7	D200 M205	D200-Q202 VanDerWaalsContact C-N 3.33Å; D200-Q202 WeakPolarHBondContact OD1-CB 3.47Å; D200-Q202 PolarHBondContact OD1-N 3.27Å; Q202-M205 PolarHBondContact O-N 3.09Å
203	S	83.4	Confident	89.4	Confident	30 Å²	30	42.9 Å²	42.9	21%	0.21	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-33.7	171	-60.9	0	0	0	0	112.6	H151 D200 M205 L206 H207	H151-S203 WeakPolarHBondContact CD2-CB 3.47Å; D200-S203 PolarHBondContact OD1-N 3.48Å; D200-S203 WeakPolarHBondContact OD2-CB 3.17Å; D200-S203 PolarHBondContact OD2-N 3.23Å; D200-S203 PolarHBondContact OD2-OG 2.93Å; S203-M205 VanDerWaalsContact C-N 3.35Å; S203-M205 PolarHBondContact O-N 3.25Å; S203-L206 PolarHBondContact O-N 3.35Å; S203-H207 PolarHBondContact O-CD2 3.16Å
204	W	92	Very high	89.7	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.015	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-39.8	173.5	171	-113.6	0	0	0	112.9	T153 Y163 I165 I183 N184 L185 D200 R201 L206 H207 A208	T153-W204 HydrophobicContact CG2-CE3 3.82Å; T153-W204 HydrophobicContact CG2-CZ3 3.59Å; Y163-W204 HydrophobicContact CD1-CH2 4.05Å; Y163-W204 AromaticContact CD2-CH2 3.68Å; Y163-W204 HydrophobicContact CD2-CH2 3.68Å; Y163-W204 AromaticContact CD2-CZ2 3.99Å; Y163-W204 HydrophobicContact CD2-CZ2 3.99Å; Y163-W204 HydrophobicContact CE2-CH2 4.38Å; Y163-W204 AromaticContact CG-CH2 3.5Å; Y163-W204 HydrophobicContact CG-CH2 3.5Å; Y163-W204 VanDerWaalsContact CG-CH2 3.5Å; Y163-W204 HydrophobicContact CG-CZ2 4.26Å; Y163-W204 HydrophobicContact CG-CZ3 4.38Å; I165-W204 HydrophobicContact CD1-CB 4.17Å; I165-W204 HydrophobicContact CD1-CE3 4.08Å; I183-W204 HydrophobicContact CD1-CD2 3.32Å; I183-W204 HydrophobicContact CD1-CE3 3.6Å; I183-W204 HydrophobicContact CD1-CG 3.9Å; I183-W204 HydrophobicContact CD1-CH2 3.89Å; I183-W204 HydrophobicContact CD1-CZ2 3.62Å; I183-W204 HydrophobicContact CD1-CZ3 3.87Å; I183-W204 HydrophobicContact CG1-CH2 4.27Å; I183-W204 HydrophobicContact CG1-CZ2 4.03Å; N184-W204 WeakPolarHBondContact O-CZ2 3.13Å; L185-W204 PolarHBondContact O-NE1 2.94Å; D200-W204 VanDerWaalsContact O-CB 3.27Å; D200-W204 WeakPolarHBondContact O-CB 3.34Å; D200-W204 PolarHBondContact O-N 3.03Å; D200-W204 VanDerWaalsContact O-N 3.12Å; R201-W204 PolarHBondContact O-N 2.6Å; W204-L206 PolarHBondContact O-N 3.32Å; W204-H207 HydrophobicContact CE3-CB 3.84Å; W204-H207 HydrophobicContact CZ3-CB 3.93Å; W204-H207 PolarHBondContact O-N 2.86Å; W204-A208 HydrophobicContact CD2-CB 4.26Å; W204-A208 HydrophobicContact CH2-CB 4.41Å; W204-A208 HydrophobicContact CZ2-CB 3.8Å; W204-A208 WeakPolarHBondContact O-CB 3.22Å; W204-A208 PolarHBondContact O-N 3.23Å
205	M	90.2	Very high	90	Very high	41 Å²	41	45.3 Å²	45.3	20%	0.202	24%	0.244	C	C	.	.	H	α-helix	trans	-54.3	-38.6	-179.1	-76	165.4	76.7	0	0	112.7	R201 Q202 S203 A208 A209 K275 F279	R201-M205 VanDerWaalsContact O-CG 3.3Å; R201-M205 WeakPolarHBondContact O-CG 3.36Å; R201-M205 PolarHBondContact O-N 3.48Å; Q202-M205 PolarHBondContact O-N 3.09Å; S203-M205 VanDerWaalsContact C-N 3.35Å; S203-M205 PolarHBondContact O-N 3.25Å; M205-A208 PolarHBondContact O-N 3.33Å; M205-A209 WeakPolarHBondContact O-CB 3.48Å; M205-A209 PolarHBondContact O-N 3.22Å; M205-K275 WeakPolarHBondContact CE-O 3.33Å; M205-F279 HydrophobicContact CB-CD2 4.31Å; M205-F279 HydrophobicContact CE-CB 3.89Å; M205-F279 HydrophobicContact CG-CD2 4.47Å
206	L	91.8	Very high	90.3	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-45.4	176.3	179.8	60	0	0	0	112	S203 W204 A209 V210 Y254 I286 V302 L308	S203-L206 PolarHBondContact O-N 3.35Å; W204-L206 PolarHBondContact O-N 3.32Å; L206-A209 PolarHBondContact O-N 3.42Å; L206-V210 WeakPolarHBondContact O-CG2 3.19Å; L206-V210 PolarHBondContact O-N 2.78Å; L206-V210 VanDerWaalsContact O-N 3.1Å; L206-Y254 HydrophobicContact CD1-CD1 4.26Å; L206-Y254 HydrophobicContact CD1-CE1 3.94Å; L206-I286 HydrophobicContact CD1-CD1 3.76Å; L206-V302 HydrophobicContact CD2-CG2 4.43Å; L206-L308 HydrophobicContact CD1-CD1 4.42Å; L206-L308 HydrophobicContact CD2-CD1 4.03Å; L206-L308 HydrophobicContact CG-CD1 4.02Å
207	H	94.6	Very high	90.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-39.8	176.2	-75	-118.6	0	0	0	111.8	H151 T153 S203 W204 V210 H211 I220	H151-H207 PolarHBondContact O-CE1 2.94Å; T153-H207 HydrophobicContact CG2-CB 3.97Å; T153-H207 VanDerWaalsContact CG2-ND1 3.27Å; T153-H207 WeakPolarHBondContact CG2-ND1 3.45Å; T153-H207 PolarHBondContact OG1-ND1 3.4Å; S203-H207 PolarHBondContact O-CD2 3.16Å; W204-H207 HydrophobicContact CE3-CB 3.84Å; W204-H207 HydrophobicContact CZ3-CB 3.93Å; W204-H207 PolarHBondContact O-N 2.86Å; H207-V210 PolarHBondContact O-N 3.15Å; H207-H211 WeakPolarHBondContact O-CB 3.32Å; H207-H211 PolarHBondContact O-CD2 3.07Å; H207-H211 VanDerWaalsContact O-CD2 3.27Å; H207-H211 PolarHBondContact O-N 3.2Å; H207-I220 HydrophobicContact CB-CD1 4.39Å
208	A	94.3	Very high	91.1	Very high	1 Å²	1	38 Å²	38	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-37.8	176	0	0	0	0	0	112.2	W204 M205 S212 F279	W204-A208 HydrophobicContact CD2-CB 4.26Å; W204-A208 HydrophobicContact CH2-CB 4.41Å; W204-A208 HydrophobicContact CZ2-CB 3.8Å; W204-A208 WeakPolarHBondContact O-CB 3.22Å; W204-A208 PolarHBondContact O-N 3.23Å; M205-A208 PolarHBondContact O-N 3.33Å; A208-S212 WeakPolarHBondContact O-CB 3.29Å; A208-S212 PolarHBondContact O-N 3.19Å; A208-S212 PolarHBondContact O-OG 3.35Å; A208-F279 HydrophobicContact CB-CE2 3.78Å; A208-F279 HydrophobicContact CB-CZ 4.22Å
209	A	93.7	Very high	91.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-44.7	174.7	0	0	0	0	0	111.2	M205 L206 S212 A213 F279 Q282 K283 I286	M205-A209 WeakPolarHBondContact O-CB 3.48Å; M205-A209 PolarHBondContact O-N 3.22Å; L206-A209 PolarHBondContact O-N 3.42Å; A209-S212 PolarHBondContact O-N 2.96Å; A209-A213 WeakPolarHBondContact O-CB 3.22Å; A209-A213 PolarHBondContact O-N 3.16Å; A209-F279 HydrophobicContact CB-CE2 4.1Å; A209-Q282 HydrophobicContact CB-CG 4Å; A209-K283 HydrophobicContact CB-CB 4.28Å; A209-I286 HydrophobicContact CB-CD1 4.02Å
210	V	94.2	Very high	91.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-47.9	175.9	176.6	0	0	0	0	111.9	L206 H207 S212 A213 R214 I220 I286 F290 L300 L308 L310	L206-V210 WeakPolarHBondContact O-CG2 3.19Å; L206-V210 PolarHBondContact O-N 2.78Å; L206-V210 VanDerWaalsContact O-N 3.1Å; H207-V210 PolarHBondContact O-N 3.15Å; V210-S212 PolarHBondContact O-N 2.87Å; V210-A213 PolarHBondContact O-N 2.95Å; V210-A213 VanDerWaalsContact O-N 3.14Å; V210-R214 PolarHBondContact O-N 3.38Å; V210-I220 HydrophobicContact CB-CD1 3.78Å; V210-I220 HydrophobicContact CG1-CD1 3.62Å; V210-I286 HydrophobicContact CG2-CD1 4.15Å; V210-I286 HydrophobicContact CG2-CG2 4.02Å; V210-F290 HydrophobicContact CG1-CE2 4.41Å; V210-L300 HydrophobicContact CG2-CD2 4.02Å; V210-L308 HydrophobicContact CG2-CD1 4.2Å; V210-L310 HydrophobicContact CG1-CD1 4.06Å; V210-L310 HydrophobicContact CG1-CD2 3.74Å
211	H	94.5	Very high	92.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-28.9	176.2	-78.5	-57.1	0	0	0	113	T153 Y163 H207 R214 V217	T153-H211 PolarHBondContact OG1-NE2 2.91Å; Y163-H211 AromaticContact CD1-CD2 3.61Å; Y163-H211 AromaticContact CD1-NE2 3.68Å; Y163-H211 HydrophobicContact CE1-CB 3.71Å; Y163-H211 AromaticContact CE1-CD2 3.51Å; Y163-H211 AromaticContact CE1-CE1 3.99Å; Y163-H211 AromaticContact CE1-CG 3.42Å; Y163-H211 VanDerWaalsContact CE1-CG 3.42Å; Y163-H211 AromaticContact CE1-ND1 3.73Å; Y163-H211 AromaticContact CE1-NE2 3.89Å; H207-H211 WeakPolarHBondContact O-CB 3.32Å; H207-H211 PolarHBondContact O-CD2 3.07Å; H207-H211 VanDerWaalsContact O-CD2 3.27Å; H207-H211 PolarHBondContact O-N 3.2Å; H211-R214 CarbonylContact O-C 3.56Å; H211-V217 PolarHBondContact CE1-O 3.01Å; H211-V217 PolarHBondContact ND1-O 2.77Å
212	S	92.4	Very high	92.5	Very high	29 Å²	29	26.1 Å²	26.1	20%	0.203	14%	0.14	C	C	.	.	H	α-helix	trans	-75.9	-33.5	173.7	-63.5	0	0	0	0	113.4	A208 A209 V210	A208-S212 WeakPolarHBondContact O-CB 3.29Å; A208-S212 PolarHBondContact O-N 3.19Å; A208-S212 PolarHBondContact O-OG 3.35Å; A209-S212 PolarHBondContact O-N 2.96Å; V210-S212 PolarHBondContact O-N 2.87Å
213	A	91.6	Very high	93.1	Very high	24 Å²	24	18.6 Å²	18.6	20%	0.198	11%	0.105	C	C	.	.	H	α-helix	trans	-77.8	-33.4	176.6	0	0	0	0	0	112.1	A209 V210 I286 S287	A209-A213 WeakPolarHBondContact O-CB 3.22Å; A209-A213 PolarHBondContact O-N 3.16Å; V210-A213 PolarHBondContact O-N 2.95Å; V210-A213 VanDerWaalsContact O-N 3.14Å; A213-I286 HydrophobicContact CB-CG2 4.12Å; A213-S287 WeakPolarHBondContact CB-OG 3.48Å
214	R	91	Very high	93.5	Very high	23 Å²	23	18.4 Å²	18.4	9%	0.087	10%	0.104	C	C	.	.			trans	-128	83.8	-176.1	-70	-64.9	-60.9	-106.6	-1.5	110.8	V210 H211 D216 V217 F290 P295	V210-R214 PolarHBondContact O-N 3.38Å; H211-R214 CarbonylContact O-C 3.56Å; R214-D216 WeakPolarHBondContact CB-OD1 3.34Å; R214-D216 IonicContact CZ-OD1 3.54Å; R214-D216 IonicContact CZ-OD2 2.83Å; R214-D216 IonicContact NE-OD1 2.76Å; R214-D216 PolarHBondContact NE-OD1 2.75Å; R214-D216 IonicContact NE-OD2 2.87Å; R214-D216 IonicContact NH2-OD1 2.7Å; R214-D216 IonicContact NH2-OD2 3.3Å; R214-D216 PolarHBondContact NH2-OD2 3.31Å; R214-D216 PolarHBondContact O-N 3.07Å; R214-V217 HydrophobicContact CB-CB 4.21Å; R214-V217 HydrophobicContact CB-CG2 3.7Å; R214-V217 WeakPolarHBondContact O-CB 3.43Å; R214-V217 PolarHBondContact O-N 3.1Å; R214-V217 VanDerWaalsContact O-N 3.07Å; R214-F290 HydrophobicContact CG-CD2 3.93Å; R214-F290 HydrophobicContact CG-CE2 4.27Å; R214-F290 HydrophobicContact CG-CG 4.15Å; R214-P295 PolarHBondContact NH1-O 3.5Å; R214-P295 VanDerWaalsContact NH1-O 3.09Å; R214-P295 PolarHBondContact NH2-O 3.14Å
215	P	91.1	Very high	93.5	Very high	93 Å²	93	18.7 Å²	18.7	60%	0.604	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.6	-179.3	27	-34.9	0	0	0	113.6	V217	P215-V217 VanDerWaalsContact C-N 3.31Å
216	D	91.5	Very high	93.6	Very high	55 Å²	55	21.6 Å²	21.6	29%	0.294	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-24.8	172.5	65.3	-57	0	0	0	113.3	R214 R218	R214-D216 WeakPolarHBondContact CB-OD1 3.34Å; R214-D216 IonicContact CZ-OD1 3.54Å; R214-D216 IonicContact CZ-OD2 2.83Å; R214-D216 IonicContact NE-OD1 2.76Å; R214-D216 PolarHBondContact NE-OD1 2.75Å; R214-D216 IonicContact NE-OD2 2.87Å; R214-D216 IonicContact NH2-OD1 2.7Å; R214-D216 IonicContact NH2-OD2 3.3Å; R214-D216 PolarHBondContact NH2-OD2 3.31Å; R214-D216 PolarHBondContact O-N 3.07Å; D216-R218 PolarHBondContact O-N 3.47Å
217	V	94.2	Very high	93.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.127	C	C	.	.			trans	-75.7	116.2	179.4	174.3	0	0	0	0	109.9	H211 R214 P215 C219 I220 L310	H211-V217 PolarHBondContact CE1-O 3.01Å; H211-V217 PolarHBondContact ND1-O 2.77Å; R214-V217 HydrophobicContact CB-CB 4.21Å; R214-V217 HydrophobicContact CB-CG2 3.7Å; R214-V217 WeakPolarHBondContact O-CB 3.43Å; R214-V217 PolarHBondContact O-N 3.1Å; R214-V217 VanDerWaalsContact O-N 3.07Å; P215-V217 VanDerWaalsContact C-N 3.31Å; V217-C219 WeakPolarHBondContact CG1-O 3.49Å; V217-I220 HydrophobicContact CG1-CD1 4.38Å; V217-I220 HydrophobicContact CG1-CG1 3.75Å; V217-L310 HydrophobicContact CG1-CB 3.96Å; V217-L310 HydrophobicContact CG1-CD2 4.31Å; V217-L310 HydrophobicContact CG2-CB 3.95Å; V217-L310 HydrophobicContact CG2-CD1 4.29Å
218	R	94.3	Very high	93.7	Very high	51 Å²	51	20.8 Å²	20.8	19%	0.192	13%	0.127	C	C	.	.			trans	-99	-24.7	179.4	-65.2	-164.3	68.4	-150.3	-0.8	113.6	A154 R155 V156 D216 G311 Q312	A154-R218 CarbonylContact C-O 3.58Å; A154-R218 VanDerWaalsContact CA-O 3.28Å; A154-R218 WeakPolarHBondContact CA-O 3.47Å; R155-R218 HydrophobicContact CB-CB 4.49Å; R155-R218 PolarHBondContact N-O 3.23Å; R155-R218 PolarHBondContact O-NH2 3.33Å; V156-R218 PolarHBondContact O-NH2 3.1Å; D216-R218 PolarHBondContact O-N 3.47Å; R218-G311 PolarHBondContact N-O 2.83Å; R218-Q312 VanDerWaalsContact CD-O 3.26Å; R218-Q312 WeakPolarHBondContact CD-O 3.34Å; R218-Q312 WeakPolarHBondContact CG-O 3.45Å
219	C	96.6	Very high	93.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.6	176.9	-171.3	0	0	0	0	111	T153 V217 G311 I314 A317	T153-C219 VanDerWaalsContact O-CA 3.27Å; T153-C219 WeakPolarHBondContact O-CA 3.24Å; T153-C219 PolarHBondContact O-SG 3.32Å; V217-C219 WeakPolarHBondContact CG1-O 3.49Å; C219-G311 PolarHBondContact N-O 2.73Å; C219-G311 PolarHBondContact O-N 3.44Å; C219-I314 HydrophobicContact CB-CG1 4Å; C219-A317 HydrophobicContact CB-CB 3.79Å
220	I	97	Very high	93.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122	175.6	-55.4	178.4	0	0	0	107.7	I152 T153 H207 V210 V217 L308 A309 L310	I152-I220 WeakPolarHBondContact CA-O 3.47Å; I152-I220 WeakPolarHBondContact CG2-O 3.38Å; T153-I220 PolarHBondContact N-O 3.2Å; T153-I220 PolarHBondContact O-N 2.86Å; H207-I220 HydrophobicContact CB-CD1 4.39Å; V210-I220 HydrophobicContact CB-CD1 3.78Å; V210-I220 HydrophobicContact CG1-CD1 3.62Å; V217-I220 HydrophobicContact CG1-CD1 4.38Å; V217-I220 HydrophobicContact CG1-CG1 3.75Å; I220-L308 HydrophobicContact CG2-CB 4.18Å; I220-L308 HydrophobicContact CG2-CD2 4.02Å; I220-A309 WeakPolarHBondContact CA-O 3.48Å; I220-L310 HydrophobicContact CB-CD2 4.3Å; I220-L310 HydrophobicContact CD1-CD2 4.21Å; I220-L310 HydrophobicContact CG1-CD2 3.79Å; I220-L310 HydrophobicContact CG2-CD2 3.9Å
221	I	96.6	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115.2	173.6	-57.5	174.4	0	0	0	108.1	V135 I152 L223 A309 A317 W318 A321	V135-I221 HydrophobicContact CG1-CD1 3.88Å; V135-I221 HydrophobicContact CG1-CG1 4.31Å; I152-I221 HydrophobicContact CD1-CG2 4.03Å; I152-I221 HydrophobicContact CG1-CG2 4.19Å; I152-I221 HydrophobicContact CG2-CB 4.33Å; I152-I221 HydrophobicContact CG2-CG1 3.72Å; I221-L223 HydrophobicContact CG2-CD1 4.49Å; I221-L223 HydrophobicContact CG2-CD2 3.85Å; I221-L223 HydrophobicContact CG2-CG 3.94Å; I221-A309 HydrophobicContact CB-CB 4.42Å; I221-A309 PolarHBondContact N-O 3.09Å; I221-A309 PolarHBondContact O-N 2.83Å; I221-A317 HydrophobicContact CD1-CB 4.09Å; I221-A317 HydrophobicContact CG1-CB 4.27Å; I221-W318 HydrophobicContact CD1-CB 4.34Å; I221-W318 HydrophobicContact CD1-CE3 4.34Å; I221-A321 HydrophobicContact CB-CB 4.29Å; I221-A321 HydrophobicContact CD1-CB 3.89Å; I221-A321 HydrophobicContact CG2-CB 4.19Å
222	H	95.3	Very high	93.6	Very high	16 Å²	16	24.9 Å²	24.9	7%	0.074	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.9	173.5	-168.8	-178.6	0	0	0	110.3	H151 L307 L308	H151-H222 VanDerWaalsContact O-CB 3.23Å; H151-H222 WeakPolarHBondContact O-CB 3.48Å; H151-H222 PolarHBondContact O-N 3.2Å; H222-L307 PolarHBondContact CD2-O 3.08Å; H222-L308 HydrophobicContact CB-CD2 3.51Å; H222-L308 VanDerWaalsContact CG-CD2 3.42Å
223	L	94.2	Very high	93.6	Very high	1 Å²	1	27 Å²	27	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119	176.9	-60.3	-177.5	0	0	0	110.9	V139 W144 I221 L307 A321 M325	V139-L223 HydrophobicContact CG1-CD2 3.83Å; V139-L223 HydrophobicContact CG2-CD2 4.29Å; W144-L223 HydrophobicContact CB-CD2 4.25Å; W144-L223 HydrophobicContact CD2-CD1 4.43Å; W144-L223 HydrophobicContact CE3-CD1 3.82Å; W144-L223 HydrophobicContact CE3-CD2 4.34Å; W144-L223 HydrophobicContact CZ3-CD1 4.28Å; I221-L223 HydrophobicContact CG2-CD1 4.49Å; I221-L223 HydrophobicContact CG2-CD2 3.85Å; I221-L223 HydrophobicContact CG2-CG 3.94Å; L223-L307 HydrophobicContact CB-CD1 4.14Å; L223-L307 HydrophobicContact CB-CG 4.22Å; L223-L307 HydrophobicContact CD1-CD1 4.4Å; L223-L307 HydrophobicContact CG-CD1 4.46Å; L223-L307 PolarHBondContact N-O 2.81Å; L223-L307 PolarHBondContact O-N 3.47Å; L223-A321 HydrophobicContact CD1-CB 4.12Å; L223-M325 HydrophobicContact CD1-CG 3.53Å; L223-M325 HydrophobicContact CD1-SD 3.96Å
224	S	92.7	Very high	93.6	Very high	26 Å²	26	28.3 Å²	28.3	18%	0.182	18%	0.175	C	C	.	.			trans	-107.7	37.2	-179	-43	0	0	0	0	111.1	N150	N150-S224 WeakPolarHBondContact OD1-CB 3.41Å; N150-S224 PolarHBondContact OD1-OG 3.43Å
225	T	92.4	Very high	93.3	Very high	11 Å²	11	34.9 Å²	34.9	7%	0.067	21%	0.212	C	C	.	.			trans	-69.7	155.5	-179.8	61.5	0	0	0	0	111	W144 A227 A228 V229 M325	W144-T225 HydrophobicContact CB-CG2 3.71Å; W144-T225 HydrophobicContact CG-CG2 4.07Å; W144-T225 WeakPolarHBondContact O-CG2 3.34Å; T225-A227 PolarHBondContact O-N 3.04Å; T225-A228 PolarHBondContact O-N 3.09Å; T225-A228 VanDerWaalsContact O-N 3.07Å; T225-A228 VanDerWaalsContact OG1-CB 3.25Å; T225-A228 WeakPolarHBondContact OG1-CB 3.45Å; T225-A228 PolarHBondContact OG1-N 3.1Å; T225-V229 WeakPolarHBondContact O-CG2 3.47Å; T225-V229 PolarHBondContact O-N 3.43Å; T225-M325 HydrophobicContact CG2-CE 3.77Å; T225-M325 HydrophobicContact CG2-SD 3.69Å; T225-M325 VanDerWaalsContact OG1-CE 3.24Å; T225-M325 WeakPolarHBondContact OG1-CE 3.48Å; T225-M325 PolarHBondContact OG1-SD 2.93Å
226	S	92.3	Very high	93	Very high	102 Å²	102	33 Å²	33	71%	0.713	20%	0.204	S	C	*	.	H	α-helix	trans	-55.3	-37.1	178.1	52.2	0	0	0	0	113.1	A230	S226-A230 WeakPolarHBondContact O-CB 3.33Å; S226-A230 PolarHBondContact O-N 2.9Å
227	A	93.4	Very high	92.9	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-68	-45.2	174.8	0	0	0	0	0	112.9	T225 A230 V231 M325 C328 E329 L332	T225-A227 PolarHBondContact O-N 3.04Å; A227-A230 PolarHBondContact O-N 3.05Å; A227-V231 WeakPolarHBondContact O-CG2 3.24Å; A227-V231 PolarHBondContact O-N 3.44Å; A227-M325 HydrophobicContact CB-CE 4.39Å; A227-C328 HydrophobicContact CB-CB 4.13Å; A227-E329 HydrophobicContact CB-CB 4.48Å; A227-E329 HydrophobicContact CB-CG 3.8Å; A227-L332 HydrophobicContact CB-CD2 4.24Å
228	A	94.2	Very high	92.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-45	177.1	0	0	0	0	0	111.9	T225 S232 L307	T225-A228 PolarHBondContact O-N 3.09Å; T225-A228 VanDerWaalsContact O-N 3.07Å; T225-A228 VanDerWaalsContact OG1-CB 3.25Å; T225-A228 WeakPolarHBondContact OG1-CB 3.45Å; T225-A228 PolarHBondContact OG1-N 3.1Å; A228-S232 WeakPolarHBondContact O-CB 3.49Å; A228-S232 PolarHBondContact O-N 3.45Å; A228-L307 HydrophobicContact CB-CB 4.37Å; A228-L307 HydrophobicContact CB-CD2 3.6Å; A228-L307 HydrophobicContact CB-CG 3.88Å
229	V	94.1	Very high	92.7	Very high	45 Å²	45	30.4 Å²	30.4	27%	0.273	20%	0.195	S	C	.	.	H	α-helix	trans	-61.8	-49.6	176.9	175.8	0	0	0	0	110.3	T225 V231 S232 C233 Y305	T225-V229 WeakPolarHBondContact O-CG2 3.47Å; T225-V229 PolarHBondContact O-N 3.43Å; V229-V231 PolarHBondContact O-N 2.75Å; V229-S232 PolarHBondContact O-N 3.01Å; V229-S232 VanDerWaalsContact O-N 3.16Å; V229-S232 PolarHBondContact O-OG 3.36Å; V229-C233 PolarHBondContact O-N 3.05Å; V229-C233 VanDerWaalsContact O-N 3.1Å; V229-C233 PolarHBondContact O-SG 3.2Å; V229-Y305 WeakPolarHBondContact CG2-O 3.37Å
230	A	93.7	Very high	92.5	Very high	36 Å²	36	31.8 Å²	31.8	30%	0.298	20%	0.204	S	C	.	.	H	α-helix	trans	-58.2	-44.8	-179.7	0	0	0	0	0	112.4	S226 A227 C233 L332	S226-A230 WeakPolarHBondContact O-CB 3.33Å; S226-A230 PolarHBondContact O-N 2.9Å; A227-A230 PolarHBondContact O-N 3.05Å; A230-C233 PolarHBondContact O-N 3.37Å; A230-L332 HydrophobicContact CB-CD1 3.94Å; A230-L332 HydrophobicContact CB-CD2 4.39Å
231	V	93.8	Very high	92.2	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.024	21%	0.213	C	C	.	.	H	α-helix	trans	-67.5	-39	176.7	173	0	0	0	0	111.8	A227 V229 C233 T234 L238 L301 C328 Q331	A227-V231 WeakPolarHBondContact O-CG2 3.24Å; A227-V231 PolarHBondContact O-N 3.44Å; V229-V231 PolarHBondContact O-N 2.75Å; V231-C233 PolarHBondContact O-N 3.19Å; V231-T234 WeakPolarHBondContact O-CB 3.41Å; V231-T234 PolarHBondContact O-N 2.8Å; V231-T234 PolarHBondContact O-OG1 3.23Å; V231-L238 HydrophobicContact CG1-CB 4.39Å; V231-L238 HydrophobicContact CG1-CD1 4.17Å; V231-L301 HydrophobicContact CG1-CD1 4.34Å; V231-C328 HydrophobicContact CG2-CB 4.02Å; V231-Q331 HydrophobicContact CG2-CB 4.24Å; V231-Q331 HydrophobicContact CG2-CG 4.29Å
232	S	94.2	Very high	91.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-23.3	176.4	80.2	0	0	0	0	113.8	A228 V229 T234 V302 S304	A228-S232 WeakPolarHBondContact O-CB 3.49Å; A228-S232 PolarHBondContact O-N 3.45Å; V229-S232 PolarHBondContact O-N 3.01Å; V229-S232 VanDerWaalsContact O-N 3.16Å; V229-S232 PolarHBondContact O-OG 3.36Å; S232-T234 VanDerWaalsContact C-N 3.33Å; S232-V302 WeakPolarHBondContact CB-O 3.26Å; S232-V302 PolarHBondContact OG-O 3.01Å; S232-S304 PolarHBondContact OG-N 2.99Å
233	C	92.5	Very high	91.6	Very high	74 Å²	74	36.9 Å²	36.9	50%	0.5	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-7	174.5	-66.1	0	0	0	0	113.6	V229 A230 V231	V229-C233 PolarHBondContact O-N 3.05Å; V229-C233 VanDerWaalsContact O-N 3.1Å; V229-C233 PolarHBondContact O-SG 3.2Å; A230-C233 PolarHBondContact O-N 3.37Å; V231-C233 PolarHBondContact O-N 3.19Å
234	T	90.6	Very high	91.4	Very high	52 Å²	52	39.9 Å²	39.9	32%	0.319	24%	0.244	S	C	.	.	S	Bend	trans	-85.7	144.3	179.6	70	0	0	0	0	111.9	V231 S232 A236 G237	V231-T234 WeakPolarHBondContact O-CB 3.41Å; V231-T234 PolarHBondContact O-N 2.8Å; V231-T234 PolarHBondContact O-OG1 3.23Å; S232-T234 VanDerWaalsContact C-N 3.33Å; T234-A236 PolarHBondContact O-N 2.57Å; T234-G237 PolarHBondContact O-N 3.11Å; T234-G237 PolarHBondContact OG1-N 3.05Å; T234-G237 VanDerWaalsContact OG1-N 3.16Å; T234-G237 PolarHBondContact OG1-O 3.33Å
235	N	85.7	Confident	91.4	Very high	160 Å²	160	38.8 Å²	38.8	86%	0.856	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.1	174.8	-73.9	-25.9	0	0	0	113.1
236	A	84.1	Confident	91.3	Very high	54 Å²	54	39.7 Å²	39.7	45%	0.446	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-17.5	-179.6	0	0	0	0	0	113.8	T234 L239	T234-A236 PolarHBondContact O-N 2.57Å; A236-L239 HydrophobicContact CB-CD1 4.49Å; A236-L239 HydrophobicContact CB-CD2 3.88Å; A236-L239 HydrophobicContact CB-CG 4.16Å
237	G	89.5	Confident	91.2	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.031	21%	0.209	C	C	.	.			trans	65.7	-143.5	-171.1	0	0	0	0	0	111.9	T234 Q331	T234-G237 PolarHBondContact O-N 3.11Å; T234-G237 PolarHBondContact OG1-N 3.05Å; T234-G237 VanDerWaalsContact OG1-N 3.16Å; T234-G237 PolarHBondContact OG1-O 3.33Å; G237-Q331 PolarHBondContact O-NE2 3.48Å; G237-Q331 PolarHBondContact O-OE1 2.9Å
238	L	92.4	Very high	91.1	Very high	18 Å²	18	35.5 Å²	35.5	9%	0.094	21%	0.209	C	C	.	.	S	Bend	trans	-82.4	117.1	177.1	-170.2	70.1	0	0	0	110.4	V231 A245 L248 T251 L301 A327	V231-L238 HydrophobicContact CG1-CB 4.39Å; V231-L238 HydrophobicContact CG1-CD1 4.17Å; L238-A245 HydrophobicContact CD2-CB 4.36Å; L238-A245 HydrophobicContact CG-CB 4.35Å; L238-L248 HydrophobicContact CD2-CD1 3.73Å; L238-T251 HydrophobicContact CB-CG2 3.81Å; L238-T251 HydrophobicContact CD2-CG2 3.83Å; L238-T251 HydrophobicContact CG-CG2 4.45Å; L238-L301 HydrophobicContact CB-CD1 4.39Å; L238-A327 HydrophobicContact CD1-CB 3.9Å; L238-A327 HydrophobicContact CD2-CB 4.04Å; L238-A327 HydrophobicContact CG-CB 4.46Å
239	L	91.8	Very high	90.8	Very high	30 Å²	30	36.8 Å²	36.8	16%	0.157	22%	0.222	C	C	.	.			trans	-85.3	142.5	179.2	-70.2	170.1	0	0	0	111.4	A236 I241 A245 L339	A236-L239 HydrophobicContact CB-CD1 4.49Å; A236-L239 HydrophobicContact CB-CD2 3.88Å; A236-L239 HydrophobicContact CB-CG 4.16Å; L239-I241 HydrophobicContact CB-CG2 3.85Å; L239-I241 PolarHBondContact O-N 3.27Å; L239-A245 WeakPolarHBondContact O-CB 3.25Å; L239-L339 HydrophobicContact CD1-CD2 3.75Å
240	P	91.7	Very high	90.6	Very high	30 Å²	30	39.1 Å²	39.1	20%	0.195	23%	0.231	C	C	.	.	S	Bend	trans	-77.4	46.4	-179.4	33.4	-36.7	0	0	0	113.4	M246 I344 P345 Q350	P240-M246 HydrophobicContact CB-CG 4.15Å; P240-I344 HydrophobicContact CG-CG2 4.21Å; P240-P345 WeakPolarHBondContact O-CD 3.23Å; P240-Q350 HydrophobicContact CB-CG 4.1Å
241	I	90.2	Very high	90.5	Very high	36 Å²	36	38.6 Å²	38.6	19%	0.185	22%	0.223	C	C	.	.			trans	-86.8	-14.1	-175.8	62.5	-174.9	0	0	0	114.3	L239 Q331 L334 L342	L239-I241 HydrophobicContact CB-CG2 3.85Å; L239-I241 PolarHBondContact O-N 3.27Å; I241-Q331 HydrophobicContact CD1-CB 3.72Å; I241-Q331 HydrophobicContact CD1-CG 4.01Å; I241-L334 HydrophobicContact CD1-CD1 3.76Å; I241-L334 HydrophobicContact CG1-CD1 4.48Å; I241-L342 HydrophobicContact CG2-CD1 4.4Å
242	S	90.4	Very high	90.5	Very high	14 Å²	14	38.4 Å²	38.4	10%	0.098	22%	0.222	C	C	.	.	S	Bend	trans	-125.6	155.9	-176.1	57.4	0	0	0	0	110.2	E244 A245 M246	S242-E244 PolarHBondContact O-N 2.93Å; S242-A245 PolarHBondContact O-N 3.45Å; S242-A245 VanDerWaalsContact O-N 3.15Å; S242-A245 VanDerWaalsContact OG-CB 3.3Å; S242-A245 WeakPolarHBondContact OG-CB 3.41Å; S242-A245 PolarHBondContact OG-N 2.95Å; S242-A245 VanDerWaalsContact OG-N 3.11Å; S242-M246 WeakPolarHBondContact O-CG 3.45Å; S242-M246 PolarHBondContact O-N 2.7Å
243	Q	89	Confident	90.5	Very high	72 Å²	72	40.6 Å²	40.6	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-36.9	175.7	-173.8	175.6	19.2	0	0	110.6	M246 I247	Q243-M246 PolarHBondContact O-N 2.79Å; Q243-I247 HydrophobicContact CG-CD1 3.93Å; Q243-I247 WeakPolarHBondContact O-CB 3.37Å; Q243-I247 VanDerWaalsContact O-CG1 3.27Å; Q243-I247 WeakPolarHBondContact O-CG1 3.39Å; Q243-I247 PolarHBondContact O-N 2.85Å
244	E	91.4	Very high	90.5	Very high	64 Å²	64	37.1 Å²	37.1	30%	0.299	21%	0.212	S	C	.	.	H	α-helix	trans	-62	-47.7	175.6	-64.8	79	-173.8	0	0	111.8	S242 M246 I247 L248 T323 L326 A327	S242-E244 PolarHBondContact O-N 2.93Å; E244-M246 PolarHBondContact O-N 2.74Å; E244-I247 PolarHBondContact O-N 3.15Å; E244-L248 WeakPolarHBondContact O-CG 3.18Å; E244-L248 PolarHBondContact O-N 2.95Å; E244-T323 HydrophobicContact CB-CG2 3.61Å; E244-T323 HydrophobicContact CG-CG2 4.12Å; E244-T323 WeakPolarHBondContact O-CG2 3.44Å; E244-L326 HydrophobicContact CB-CB 4.33Å; E244-L326 HydrophobicContact CG-CB 3.86Å; E244-L326 HydrophobicContact CG-CD1 4.09Å; E244-A327 HydrophobicContact CB-CB 4.02Å
245	A	92.2	Very high	90.6	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.033	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-43.3	174.7	0	0	0	0	0	112.1	L238 L239 S242 I247 L248 G249 A327	L238-A245 HydrophobicContact CD2-CB 4.36Å; L238-A245 HydrophobicContact CG-CB 4.35Å; L239-A245 WeakPolarHBondContact O-CB 3.25Å; S242-A245 PolarHBondContact O-N 3.45Å; S242-A245 VanDerWaalsContact O-N 3.15Å; S242-A245 VanDerWaalsContact OG-CB 3.3Å; S242-A245 WeakPolarHBondContact OG-CB 3.41Å; S242-A245 PolarHBondContact OG-N 2.95Å; S242-A245 VanDerWaalsContact OG-N 3.11Å; A245-I247 PolarHBondContact O-N 3.32Å; A245-L248 PolarHBondContact O-N 3.46Å; A245-G249 PolarHBondContact O-N 2.97Å; A245-A327 HydrophobicContact CB-CB 4.01Å
246	M	90.3	Very high	90.7	Very high	30 Å²	30	29.6 Å²	29.6	15%	0.148	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-36.1	177.9	-64.2	-171.9	-74.1	0	0	112.9	P240 S242 Q243 E244 L248 G249 P345 Q350 A353 H354	P240-M246 HydrophobicContact CB-CG 4.15Å; S242-M246 WeakPolarHBondContact O-CG 3.45Å; S242-M246 PolarHBondContact O-N 2.7Å; Q243-M246 PolarHBondContact O-N 2.79Å; E244-M246 PolarHBondContact O-N 2.74Å; M246-L248 VanDerWaalsContact C-N 3.26Å; M246-L248 PolarHBondContact O-N 3.36Å; M246-G249 PolarHBondContact O-N 3.34Å; M246-P345 HydrophobicContact CE-CG 4.24Å; M246-P345 HydrophobicContact SD-CB 3.73Å; M246-P345 HydrophobicContact SD-CG 3.66Å; M246-Q350 HydrophobicContact CG-CG 4.17Å; M246-Q350 HydrophobicContact SD-CG 4.13Å; M246-A353 HydrophobicContact CB-CB 3.65Å; M246-A353 HydrophobicContact SD-CB 4.47Å; M246-H354 WeakPolarHBondContact O-CA 3.21Å; M246-H354 WeakPolarHBondContact O-CB 3.48Å; M246-H354 PolarHBondContact O-N 2.96Å
247	I	90.1	Very high	90.8	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.056	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-29.1	175.5	-79.6	168.9	0	0	0	112.5	Q243 E244 A245 F319 T323 R378 F464	Q243-I247 HydrophobicContact CG-CD1 3.93Å; Q243-I247 WeakPolarHBondContact O-CB 3.37Å; Q243-I247 VanDerWaalsContact O-CG1 3.27Å; Q243-I247 WeakPolarHBondContact O-CG1 3.39Å; Q243-I247 PolarHBondContact O-N 2.85Å; E244-I247 PolarHBondContact O-N 3.15Å; A245-I247 PolarHBondContact O-N 3.32Å; I247-F319 HydrophobicContact CG2-CE1 3.94Å; I247-F319 HydrophobicContact CG2-CZ 4Å; I247-T323 HydrophobicContact CB-CG2 4.36Å; I247-T323 HydrophobicContact CG2-CG2 4.03Å; I247-R378 PolarHBondContact O-NH2 2.98Å; I247-F464 HydrophobicContact CD1-CD2 4.43Å
248	L	90.5	Very high	90.5	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-77.2	-36.1	176.6	-64.9	163	0	0	0	111.9	L238 E244 A245 M246 V299 I320 T323 A327	L238-L248 HydrophobicContact CD2-CD1 3.73Å; E244-L248 WeakPolarHBondContact O-CG 3.18Å; E244-L248 PolarHBondContact O-N 2.95Å; A245-L248 PolarHBondContact O-N 3.46Å; M246-L248 VanDerWaalsContact C-N 3.26Å; M246-L248 PolarHBondContact O-N 3.36Å; L248-V299 HydrophobicContact CD2-CG2 3.98Å; L248-I320 HydrophobicContact CD2-CB 4.41Å; L248-I320 HydrophobicContact CD2-CG2 3.9Å; L248-T323 HydrophobicContact CD1-CG2 4.11Å; L248-T323 HydrophobicContact CD2-CG2 4.09Å; L248-T323 HydrophobicContact CG-CG2 3.84Å; L248-A327 HydrophobicContact CD1-CB 4.15Å
249	G	88.4	Confident	90	Very high	27 Å²	27	33.6 Å²	33.6	28%	0.278	18%	0.184	S	C	.	.			trans	75.3	-141.3	-177.3	0	0	0	0	0	112.4	A245 M246 T251	A245-G249 PolarHBondContact O-N 2.97Å; M246-G249 PolarHBondContact O-N 3.34Å; G249-T251 PolarHBondContact O-N 3Å
250	E	89.8	Confident	89.5	Confident	95 Å²	95	36.5 Å²	36.5	44%	0.444	20%	0.199	S	C	.	.			trans	-62.7	131.1	179.7	-65.3	-176.8	170.7	0	0	112.2	S294 C297	E250-S294 WeakPolarHBondContact OE2-CB 3.39Å; E250-S294 PolarHBondContact OE2-N 3.02Å; E250-C297 PolarHBondContact O-SG 2.98Å; E250-C297 VanDerWaalsContact O-SG 3.37Å
251	T	92.5	Very high	88.9	Confident	24 Å²	24	39.4 Å²	39.4	15%	0.147	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.6	169.5	65.3	0	0	0	0	111.2	L238 G249 V299	L238-T251 HydrophobicContact CB-CG2 3.81Å; L238-T251 HydrophobicContact CD2-CG2 3.83Å; L238-T251 HydrophobicContact CG-CG2 4.45Å; G249-T251 PolarHBondContact O-N 3Å; T251-V299 HydrophobicContact CG2-CB 4.02Å; T251-V299 HydrophobicContact CG2-CG1 4.12Å
252	A	93.9	Very high	88.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	151.7	169.5	0	0	0	0	0	110.8	I289 F290 C297 V299 L300 L301	A252-I289 HydrophobicContact CB-CG2 3.69Å; A252-F290 HydrophobicContact CB-CE1 4.11Å; A252-C297 PolarHBondContact N-SG 3.07Å; A252-C297 VanDerWaalsContact N-SG 3.37Å; A252-V299 PolarHBondContact N-O 3.43Å; A252-L300 HydrophobicContact CB-CD1 3.47Å; A252-L300 VanDerWaalsContact CB-CD1 3.47Å; A252-L301 PolarHBondContact O-N 3.26Å
253	V	93.8	Very high	87.5	Confident	49 Å²	49	45.1 Å²	45.1	30%	0.297	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.9	175	-177.7	0	0	0	0	108.6	L301 R303	V253-L301 CarbonylContact C-O 3.55Å; V253-L301 WeakPolarHBondContact CA-O 3.46Å; V253-L301 HydrophobicContact CG2-CB 4.36Å; V253-L301 HydrophobicContact CG2-CD1 4.37Å; V253-R303 HydrophobicContact CG1-CG 3.86Å
254	Y	93.2	Very high	86.3	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.7	173.8	169.3	-120.2	0	0	0	110.2	L206 P256 V259 Q282 E285 I286 I289 L301 V302 R303	L206-Y254 HydrophobicContact CD1-CD1 4.26Å; L206-Y254 HydrophobicContact CD1-CE1 3.94Å; Y254-P256 HydrophobicContact CD1-CG 4.35Å; Y254-P256 HydrophobicContact CE1-CB 4.43Å; Y254-P256 HydrophobicContact CE1-CG 3.9Å; Y254-V259 HydrophobicContact CE2-CG2 3.97Å; Y254-Q282 PolarHBondContact OH-NE2 2.87Å; Y254-E285 HydrophobicContact CD2-CG 4.1Å; Y254-E285 HydrophobicContact CE2-CB 4.48Å; Y254-E285 HydrophobicContact CE2-CG 3.94Å; Y254-I286 HydrophobicContact CD1-CD1 4.43Å; Y254-I286 HydrophobicContact CD1-CG1 4.49Å; Y254-I286 HydrophobicContact CD2-CG1 4.04Å; Y254-I286 HydrophobicContact CE1-CD1 4.34Å; Y254-I286 HydrophobicContact CE2-CG1 4.2Å; Y254-I286 HydrophobicContact CG-CG1 4.21Å; Y254-I289 HydrophobicContact CD2-CD1 3.81Å; Y254-I289 HydrophobicContact CG-CD1 4.37Å; Y254-L301 PolarHBondContact N-O 2.9Å; Y254-V302 HydrophobicContact CD1-CG1 4.02Å; Y254-V302 HydrophobicContact CD1-CG2 4.3Å; Y254-V302 WeakPolarHBondContact O-CA 3.3Å; Y254-R303 PolarHBondContact O-N 2.88Å
255	D	91.6	Very high	84.8	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.123	28%	0.276	C	S	.	.			trans	-115.5	107.9	177.2	-169.4	-24.2	0	0	0	109.7	L257 I258 R303	D255-L257 PolarHBondContact O-N 3.1Å; D255-L257 VanDerWaalsContact O-N 3.16Å; D255-L257 VanDerWaalsContact OD1-CB 3.25Å; D255-L257 WeakPolarHBondContact OD1-CB 3.43Å; D255-L257 WeakPolarHBondContact OD1-CG 3.32Å; D255-L257 PolarHBondContact OD1-N 2.98Å; D255-I258 HydrophobicContact CB-CD1 3.83Å; D255-I258 HydrophobicContact CB-CG1 3.97Å; D255-I258 PolarHBondContact O-N 3.45Å; D255-R303 HydrophobicContact CB-CG 4.41Å; D255-R303 VanDerWaalsContact OD2-CD 3.32Å; D255-R303 WeakPolarHBondContact OD2-CD 3.33Å; D255-R303 IonicContact OD2-CZ 2.6Å; D255-R303 IonicContact OD2-NE 3.99Å; D255-R303 IonicContact OD2-NH1 3.2Å; D255-R303 PolarHBondContact OD2-NH1 3.48Å
256	P	87	Confident	82.8	Confident	30 Å²	30	60.5 Å²	60.5	20%	0.195	32%	0.319	C	S	.	.	H	α-helix	trans	-57.9	-25.9	177.7	-26	35.6	0	0	0	114	Y254 I258 V259 L260 V302 Y305	Y254-P256 HydrophobicContact CD1-CG 4.35Å; Y254-P256 HydrophobicContact CE1-CB 4.43Å; Y254-P256 HydrophobicContact CE1-CG 3.9Å; P256-I258 VanDerWaalsContact C-N 3.28Å; P256-I258 PolarHBondContact O-N 2.87Å; P256-V259 PolarHBondContact O-N 2.85Å; P256-L260 PolarHBondContact O-N 3.21Å; P256-L260 VanDerWaalsContact O-N 3.12Å; P256-V302 HydrophobicContact CG-CG1 3.76Å; P256-Y305 HydrophobicContact CG-CD2 4.11Å; P256-Y305 HydrophobicContact CG-CE2 4.02Å
257	L	86.2	Confident	81.5	Confident	99 Å²	99	60.7 Å²	60.7	52%	0.518	33%	0.329	S	S	.	.	H	α-helix	trans	-67.7	-28.6	-178.8	-59	176.4	0	0	0	112.3	D255 V259 L260 N261	D255-L257 PolarHBondContact O-N 3.1Å; D255-L257 VanDerWaalsContact O-N 3.16Å; D255-L257 VanDerWaalsContact OD1-CB 3.25Å; D255-L257 WeakPolarHBondContact OD1-CB 3.43Å; D255-L257 WeakPolarHBondContact OD1-CG 3.32Å; D255-L257 PolarHBondContact OD1-N 2.98Å; L257-V259 PolarHBondContact O-N 2.91Å; L257-L260 PolarHBondContact O-N 2.89Å; L257-N261 VanDerWaalsContact O-CB 3.28Å; L257-N261 WeakPolarHBondContact O-CB 3.47Å; L257-N261 PolarHBondContact O-N 3.37Å; L257-N261 PolarHBondContact O-ND2 3.32Å
258	I	84.4	Confident	80.2	Confident	58 Å²	58	70.3 Å²	70.3	30%	0.297	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-47.6	176.1	-63.6	175	0	0	0	109.9	D255 P256 N262	D255-I258 HydrophobicContact CB-CD1 3.83Å; D255-I258 HydrophobicContact CB-CG1 3.97Å; D255-I258 PolarHBondContact O-N 3.45Å; P256-I258 VanDerWaalsContact C-N 3.28Å; P256-I258 PolarHBondContact O-N 2.87Å; I258-N262 WeakPolarHBondContact O-CB 3.44Å; I258-N262 PolarHBondContact O-N 3.46Å; I258-N262 VanDerWaalsContact O-N 3.1Å; I258-N262 PolarHBondContact O-ND2 2.65Å
259	V	81.9	Confident	79.1	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-66.7	-43.1	178.8	178.5	0	0	0	0	110.5	Y254 P256 L257 N262 L263 A281 Q282 E285	Y254-V259 HydrophobicContact CE2-CG2 3.97Å; P256-V259 PolarHBondContact O-N 2.85Å; L257-V259 PolarHBondContact O-N 2.91Å; V259-N262 PolarHBondContact O-N 3.37Å; V259-L263 HydrophobicContact CG1-CD1 3.73Å; V259-L263 WeakPolarHBondContact O-CD1 3.35Å; V259-L263 WeakPolarHBondContact O-CG 3.38Å; V259-L263 PolarHBondContact O-N 3.37Å; V259-A281 HydrophobicContact CG1-CB 3.92Å; V259-Q282 HydrophobicContact CG1-CB 4.44Å; V259-E285 HydrophobicContact CG2-CB 4.01Å; V259-E285 HydrophobicContact CG2-CG 4.21Å
260	L	80.7	Confident	78.7	Confident	90 Å²	90	76 Å²	76	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-61.4	-47.1	179.2	-173.8	62.2	0	0	0	112.2	P256 L257 L263	P256-L260 PolarHBondContact O-N 3.21Å; P256-L260 VanDerWaalsContact O-N 3.12Å; L257-L260 PolarHBondContact O-N 2.89Å; L260-L263 PolarHBondContact O-N 3.47Å
261	N	79.6	Confident	78.2	Confident	91 Å²	91	76.4 Å²	76.4	49%	0.487	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-42.5	-179.8	-68.8	-16.7	0	0	0	111.8	L257 L263 Q264	L257-N261 VanDerWaalsContact O-CB 3.28Å; L257-N261 WeakPolarHBondContact O-CB 3.47Å; L257-N261 PolarHBondContact O-N 3.37Å; L257-N261 PolarHBondContact O-ND2 3.32Å; N261-L263 PolarHBondContact O-N 2.93Å; N261-L263 VanDerWaalsContact O-N 3.16Å; N261-Q264 WeakPolarHBondContact O-CB 3.33Å; N261-Q264 PolarHBondContact O-N 3.25Å
262	N	75.4	Confident	77.5	Confident	120 Å²	120	80 Å²	80	64%	0.642	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-17.9	177.3	-70.6	-17.9	0	0	0	113.4	I258 V259	I258-N262 WeakPolarHBondContact O-CB 3.44Å; I258-N262 PolarHBondContact O-N 3.46Å; I258-N262 VanDerWaalsContact O-N 3.1Å; I258-N262 PolarHBondContact O-ND2 2.65Å; V259-N262 PolarHBondContact O-N 3.37Å
263	L	75.1	Confident	76.9	Confident	51 Å²	51	83.1 Å²	83.1	27%	0.267	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	5.9	-179.8	-65.5	170.7	0	0	0	113.8	V259 L260 N261 Q265 R277 H278 A281	V259-L263 HydrophobicContact CG1-CD1 3.73Å; V259-L263 WeakPolarHBondContact O-CD1 3.35Å; V259-L263 WeakPolarHBondContact O-CG 3.38Å; V259-L263 PolarHBondContact O-N 3.37Å; L260-L263 PolarHBondContact O-N 3.47Å; N261-L263 PolarHBondContact O-N 2.93Å; N261-L263 VanDerWaalsContact O-N 3.16Å; L263-Q265 PolarHBondContact O-N 2.85Å; L263-R277 HydrophobicContact CD2-CG 3.74Å; L263-H278 HydrophobicContact CD1-CB 4Å; L263-A281 HydrophobicContact CD1-CB 4.25Å; L263-A281 HydrophobicContact CD2-CB 4.32Å
264	Q	63.8	Low	76.3	Confident	136 Å²	136	86.3 Å²	86.3	64%	0.636	45%	0.447	S	S	*	.			trans	-73.7	48.9	177.5	-68.3	-176.6	-14.2	0	0	113.6	N261	N261-Q264 WeakPolarHBondContact O-CB 3.33Å; N261-Q264 PolarHBondContact O-N 3.25Å
265	Q	60.5	Low	75.7	Confident	150 Å²	150	90.7 Å²	90.7	70%	0.701	47%	0.466	S	S	*	.			trans	-93.8	125	170.7	-66.1	-169.1	2	0	0	110.5	L263 G267	L263-Q265 PolarHBondContact O-N 2.85Å; Q265-G267 PolarHBondContact O-N 3.43Å
266	N	51	Low	75.3	Confident	177 Å²	177	96.2 Å²	96.2	95%	0.947	49%	0.489	S	S	*	.			trans	-75.4	86.4	-179.2	-67.2	-29.2	0	0	0	110.8
267	G	62.4	Low	75.2	Confident	34 Å²	34	99.6 Å²	99.6	35%	0.351	50%	0.498	S	S	.	.			trans	-135.3	138	174.7	0	0	0	0	0	112.6	Q265 E269 R274	Q265-G267 PolarHBondContact O-N 3.43Å; G267-E269 PolarHBondContact O-N 2.89Å; G267-R274 PolarHBondContact O-NH2 3.39Å
268	E	63	Low	75.2	Confident	212 Å²	212	97.8 Å²	97.8	99%	0.991	49%	0.487	S	S	*	.			trans	-70.1	79.2	166.7	-72	-167.2	152.3	0	0	109.9
269	E	66.9	Low	75.3	Confident	58 Å²	58	96.8 Å²	96.8	27%	0.271	48%	0.481	S	S	.	.			trans	-99.8	140.5	176	-62.8	-175.7	170.5	0	0	111.1	G267 R274 R277	G267-E269 PolarHBondContact O-N 2.89Å; E269-R274 PolarHBondContact O-NH1 3.27Å; E269-R274 PolarHBondContact O-NH2 2.89Å; E269-R277 IonicContact OE1-CZ 3.61Å; E269-R277 IonicContact OE1-NH1 2.83Å; E269-R277 PolarHBondContact OE1-NH1 3.23Å; E269-R277 IonicContact OE1-NH2 3.53Å; E269-R277 PolarHBondContact OE1-NH2 3.11Å; E269-R277 IonicContact OE2-CZ 2.71Å; E269-R277 IonicContact OE2-NE 2.75Å; E269-R277 IonicContact OE2-NH1 3.58Å; E269-R277 PolarHBondContact OE2-NH1 3.18Å; E269-R277 IonicContact OE2-NH2 3.45Å; E269-R277 PolarHBondContact OE2-NH2 3.23Å; E269-R277 VanDerWaalsContact OE2-NH2 3.15Å
270	D	80.4	Confident	75.6	Confident	95 Å²	95	100.3 Å²	100.3	51%	0.508	50%	0.5	S	S	.	.			trans	-50.8	141.5	167.6	162.5	61.2	0	0	0	111.2	D272 S273 R274	D270-D272 VanDerWaalsContact C-N 3.31Å; D270-D272 PolarHBondContact O-N 3.05Å; D270-D272 PolarHBondContact OD2-N 2.93Å; D270-D272 VanDerWaalsContact OD2-N 3.15Å; D270-S273 WeakPolarHBondContact O-CB 3.44Å; D270-S273 PolarHBondContact O-N 3.06Å; D270-S273 PolarHBondContact OD2-N 2.91Å; D270-S273 PolarHBondContact OD2-OG 2.84Å; D270-S273 VanDerWaalsContact OD2-OG 3.08Å; D270-R274 PolarHBondContact O-N 3.43Å
271	L	77.9	Confident	76	Confident	103 Å²	103	97.5 Å²	97.5	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-35.6	-171.8	-178.8	62.7	0	0	0	112.2	K275	L271-K275 VanDerWaalsContact O-CG 3.31Å; L271-K275 WeakPolarHBondContact O-CG 3.19Å; L271-K275 PolarHBondContact O-N 3.48Å
272	D	78.3	Confident	76.5	Confident	100 Å²	100	93.9 Å²	93.9	54%	0.535	47%	0.469	S	S	.	.	H	α-helix	trans	-78.6	-34.9	179.8	-72.1	-15.8	0	0	0	111.6	D270 R274 K275 K276	D270-D272 VanDerWaalsContact C-N 3.31Å; D270-D272 PolarHBondContact O-N 3.05Å; D270-D272 PolarHBondContact OD2-N 2.93Å; D270-D272 VanDerWaalsContact OD2-N 3.15Å; D272-R274 VanDerWaalsContact C-N 3.33Å; D272-R274 PolarHBondContact O-N 3.46Å; D272-K275 PolarHBondContact O-N 3.06Å; D272-K275 IonicContact OD1-NZ 3.61Å; D272-K275 PolarHBondContact OD1-NZ 2.93Å; D272-K276 WeakPolarHBondContact O-CB 3.4Å; D272-K276 PolarHBondContact O-N 3.39Å
273	S	82.2	Confident	77.2	Confident	66 Å²	66	91.7 Å²	91.7	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-58.6	-43.5	168	-58.7	0	0	0	0	111.9	D270 K276 R277	D270-S273 WeakPolarHBondContact O-CB 3.44Å; D270-S273 PolarHBondContact O-N 3.06Å; D270-S273 PolarHBondContact OD2-N 2.91Å; D270-S273 PolarHBondContact OD2-OG 2.84Å; D270-S273 VanDerWaalsContact OD2-OG 3.08Å; S273-K276 PolarHBondContact O-N 2.66Å; S273-R277 PolarHBondContact O-N 2.99Å
274	R	81.1	Confident	78	Confident	115 Å²	115	92.2 Å²	92.2	43%	0.434	47%	0.465	S	S	.	.	H	α-helix	trans	-64.6	-44.6	175.5	-172.3	178	-70.4	124.6	-1.6	112.3	G267 E269 D270 D272 K276 R277 H278	G267-R274 PolarHBondContact O-NH2 3.39Å; E269-R274 PolarHBondContact O-NH1 3.27Å; E269-R274 PolarHBondContact O-NH2 2.89Å; D270-R274 PolarHBondContact O-N 3.43Å; D272-R274 VanDerWaalsContact C-N 3.33Å; D272-R274 PolarHBondContact O-N 3.46Å; R274-K276 PolarHBondContact O-N 2.96Å; R274-R277 PolarHBondContact O-N 3.08Å; R274-H278 WeakPolarHBondContact O-CB 3.49Å; R274-H278 PolarHBondContact O-N 2.99Å
275	K	80.2	Confident	79.3	Confident	93 Å²	93	86.8 Å²	86.8	40%	0.404	44%	0.44	S	S	.	.	H	α-helix	trans	-59.6	-44.5	174.7	-72.9	167.9	-164.3	149.8	0	111.9	M205 L271 D272 H278 F279	M205-K275 WeakPolarHBondContact CE-O 3.33Å; L271-K275 VanDerWaalsContact O-CG 3.31Å; L271-K275 WeakPolarHBondContact O-CG 3.19Å; L271-K275 PolarHBondContact O-N 3.48Å; D272-K275 PolarHBondContact O-N 3.06Å; D272-K275 IonicContact OD1-NZ 3.61Å; D272-K275 PolarHBondContact OD1-NZ 2.93Å; K275-H278 PolarHBondContact O-N 3.41Å; K275-F279 PolarHBondContact O-N 2.88Å
276	K	83.4	Confident	80.9	Confident	139 Å²	139	79.6 Å²	79.6	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-62.2	-47.6	178.8	-175.8	178.1	177	-177.1	0	111.2	D272 S273 R274 H278 F279 D280	D272-K276 WeakPolarHBondContact O-CB 3.4Å; D272-K276 PolarHBondContact O-N 3.39Å; S273-K276 PolarHBondContact O-N 2.66Å; R274-K276 PolarHBondContact O-N 2.96Å; K276-H278 VanDerWaalsContact C-N 3.31Å; K276-H278 PolarHBondContact O-N 3.01Å; K276-F279 WeakPolarHBondContact O-CB 3.27Å; K276-F279 PolarHBondContact O-N 3.24Å; K276-F279 VanDerWaalsContact O-N 3.15Å; K276-D280 PolarHBondContact O-N 3Å
277	R	85.3	Confident	82.8	Confident	101 Å²	101	73.2 Å²	73.2	38%	0.381	38%	0.376	S	S	.	.	H	α-helix	trans	-59.2	-41.4	175.1	-171.2	-176.1	-62.4	165.9	6.9	112.3	L263 E269 S273 R274 D280 A281	L263-R277 HydrophobicContact CD2-CG 3.74Å; E269-R277 IonicContact OE1-CZ 3.61Å; E269-R277 IonicContact OE1-NH1 2.83Å; E269-R277 PolarHBondContact OE1-NH1 3.23Å; E269-R277 IonicContact OE1-NH2 3.53Å; E269-R277 PolarHBondContact OE1-NH2 3.11Å; E269-R277 IonicContact OE2-CZ 2.71Å; E269-R277 IonicContact OE2-NE 2.75Å; E269-R277 IonicContact OE2-NH1 3.58Å; E269-R277 PolarHBondContact OE2-NH1 3.18Å; E269-R277 IonicContact OE2-NH2 3.45Å; E269-R277 PolarHBondContact OE2-NH2 3.23Å; E269-R277 VanDerWaalsContact OE2-NH2 3.15Å; S273-R277 PolarHBondContact O-N 2.99Å; R274-R277 PolarHBondContact O-N 3.08Å; R277-D280 PolarHBondContact O-N 3.32Å; R277-A281 VanDerWaalsContact O-CB 3.3Å; R277-A281 WeakPolarHBondContact O-CB 3.48Å; R277-A281 PolarHBondContact O-N 3.34Å
278	H	85.4	Confident	84.3	Confident	62 Å²	62	77.2 Å²	77.2	29%	0.287	38%	0.38	S	S	.	.	H	α-helix	trans	-62.2	-42.5	175.8	-174.5	-73.2	0	0	0	112.1	L263 R274 K275 K276 Q282	L263-H278 HydrophobicContact CD1-CB 4Å; R274-H278 WeakPolarHBondContact O-CB 3.49Å; R274-H278 PolarHBondContact O-N 2.99Å; K275-H278 PolarHBondContact O-N 3.41Å; K276-H278 VanDerWaalsContact C-N 3.31Å; K276-H278 PolarHBondContact O-N 3.01Å; H278-Q282 VanDerWaalsContact O-CB 3.25Å; H278-Q282 WeakPolarHBondContact O-CB 3.49Å; H278-Q282 PolarHBondContact O-N 3.09Å
279	F	86	Confident	85.7	Confident	37 Å²	37	67.6 Å²	67.6	16%	0.162	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-48.1	174	176.6	-103.1	0	0	0	112.3	M205 A208 A209 K275 K276 A281 Q282 K283	M205-F279 HydrophobicContact CB-CD2 4.31Å; M205-F279 HydrophobicContact CE-CB 3.89Å; M205-F279 HydrophobicContact CG-CD2 4.47Å; A208-F279 HydrophobicContact CB-CE2 3.78Å; A208-F279 HydrophobicContact CB-CZ 4.22Å; A209-F279 HydrophobicContact CB-CE2 4.1Å; K275-F279 PolarHBondContact O-N 2.88Å; K276-F279 WeakPolarHBondContact O-CB 3.27Å; K276-F279 PolarHBondContact O-N 3.24Å; K276-F279 VanDerWaalsContact O-N 3.15Å; F279-A281 VanDerWaalsContact C-N 3.34Å; F279-A281 PolarHBondContact O-N 3.06Å; F279-Q282 PolarHBondContact O-N 3.43Å; F279-K283 HydrophobicContact CE1-CD 4.34Å; F279-K283 VanDerWaalsContact O-CB 3.29Å; F279-K283 WeakPolarHBondContact O-CB 3.49Å; F279-K283 PolarHBondContact O-N 2.95Å
280	D	88	Confident	86.8	Confident	77 Å²	77	65.5 Å²	65.5	41%	0.412	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-40.8	-179.6	-69.4	-31.3	0	0	0	111.4	K276 R277 A284	K276-D280 PolarHBondContact O-N 3Å; R277-D280 PolarHBondContact O-N 3.32Å; D280-A284 WeakPolarHBondContact O-CB 3.01Å; D280-A284 PolarHBondContact O-N 3.08Å
281	A	89.6	Confident	87.3	Confident	30 Å²	30	68.3 Å²	68.3	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-43	174.8	0	0	0	0	0	112.7	V259 L263 R277 F279 A284 E285	V259-A281 HydrophobicContact CG1-CB 3.92Å; L263-A281 HydrophobicContact CD1-CB 4.25Å; L263-A281 HydrophobicContact CD2-CB 4.32Å; R277-A281 VanDerWaalsContact O-CB 3.3Å; R277-A281 WeakPolarHBondContact O-CB 3.48Å; R277-A281 PolarHBondContact O-N 3.34Å; F279-A281 VanDerWaalsContact C-N 3.34Å; F279-A281 PolarHBondContact O-N 3.06Å; A281-A284 PolarHBondContact O-N 3Å; A281-E285 WeakPolarHBondContact O-CB 3.44Å; A281-E285 PolarHBondContact O-N 3.2Å
282	Q	90.3	Very high	87.9	Confident	15 Å²	15	68.3 Å²	68.3	7%	0.07	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-42.8	174.7	174.7	168.6	78.3	0	0	111.9	A209 Y254 V259 H278 F279 E285 I286	A209-Q282 HydrophobicContact CB-CG 4Å; Y254-Q282 PolarHBondContact OH-NE2 2.87Å; V259-Q282 HydrophobicContact CG1-CB 4.44Å; H278-Q282 VanDerWaalsContact O-CB 3.25Å; H278-Q282 WeakPolarHBondContact O-CB 3.49Å; H278-Q282 PolarHBondContact O-N 3.09Å; F279-Q282 PolarHBondContact O-N 3.43Å; Q282-E285 PolarHBondContact O-N 3.34Å; Q282-I286 HydrophobicContact CG-CD1 3.73Å; Q282-I286 WeakPolarHBondContact O-CB 3.34Å; Q282-I286 VanDerWaalsContact O-CG1 3.29Å; Q282-I286 WeakPolarHBondContact O-CG1 3.47Å; Q282-I286 PolarHBondContact O-N 3.29Å
283	K	90.9	Very high	88.4	Confident	75 Å²	75	68.3 Å²	68.3	33%	0.326	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-44.5	174.5	175.6	178.1	170.5	173.3	0	111.6	A209 F279 S287	A209-K283 HydrophobicContact CB-CB 4.28Å; F279-K283 HydrophobicContact CE1-CD 4.34Å; F279-K283 VanDerWaalsContact O-CB 3.29Å; F279-K283 WeakPolarHBondContact O-CB 3.49Å; F279-K283 PolarHBondContact O-N 2.95Å; K283-S287 VanDerWaalsContact O-CB 3.28Å; K283-S287 WeakPolarHBondContact O-CB 3.41Å; K283-S287 PolarHBondContact O-N 3.24Å; K283-S287 PolarHBondContact O-OG 3.42Å
284	A	91.6	Very high	88.3	Confident	61 Å²	61	67 Å²	67	50%	0.504	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-46.1	177.4	0	0	0	0	0	111.8	D280 A281 S287 R288	D280-A284 WeakPolarHBondContact O-CB 3.01Å; D280-A284 PolarHBondContact O-N 3.08Å; A281-A284 PolarHBondContact O-N 3Å; A284-S287 PolarHBondContact O-N 2.76Å; A284-R288 PolarHBondContact O-N 2.88Å
285	E	91.5	Very high	88.4	Confident	22 Å²	22	66.3 Å²	66.3	10%	0.103	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-45.9	179.8	-179.6	58.4	-172.1	0	0	112.5	Y254 V259 A281 Q282 S287 R288 I289	Y254-E285 HydrophobicContact CD2-CG 4.1Å; Y254-E285 HydrophobicContact CE2-CB 4.48Å; Y254-E285 HydrophobicContact CE2-CG 3.94Å; V259-E285 HydrophobicContact CG2-CB 4.01Å; V259-E285 HydrophobicContact CG2-CG 4.21Å; A281-E285 WeakPolarHBondContact O-CB 3.44Å; A281-E285 PolarHBondContact O-N 3.2Å; Q282-E285 PolarHBondContact O-N 3.34Å; E285-S287 VanDerWaalsContact C-N 3.3Å; E285-S287 PolarHBondContact O-N 3.06Å; E285-R288 WeakPolarHBondContact O-CB 3.13Å; E285-R288 PolarHBondContact O-N 2.76Å; E285-R288 IonicContact OE1-CZ 2.76Å; E285-R288 IonicContact OE1-NE 3.32Å; E285-R288 IonicContact OE1-NH2 3.2Å; E285-R288 PolarHBondContact OE1-NH2 3.32Å; E285-R288 IonicContact OE2-CZ 3.33Å; E285-R288 VanDerWaalsContact OE2-CZ 3.29Å; E285-R288 IonicContact OE2-NE 3.93Å; E285-R288 PolarHBondContact OE2-NE 3.25Å; E285-R288 IonicContact OE2-NH2 2.63Å; E285-R288 PolarHBondContact OE2-NH2 2.96Å; E285-I289 HydrophobicContact CG-CD1 4.01Å; E285-I289 VanDerWaalsContact O-CG1 3.31Å; E285-I289 WeakPolarHBondContact O-CG1 3.39Å; E285-I289 PolarHBondContact O-N 2.98Å
286	I	92.9	Very high	88.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-38	176	-69.8	172.6	0	0	0	111	L206 A209 V210 A213 Y254 Q282 I289 F290 L300	L206-I286 HydrophobicContact CD1-CD1 3.76Å; A209-I286 HydrophobicContact CB-CD1 4.02Å; V210-I286 HydrophobicContact CG2-CD1 4.15Å; V210-I286 HydrophobicContact CG2-CG2 4.02Å; A213-I286 HydrophobicContact CB-CG2 4.12Å; Y254-I286 HydrophobicContact CD1-CD1 4.43Å; Y254-I286 HydrophobicContact CD1-CG1 4.49Å; Y254-I286 HydrophobicContact CD2-CG1 4.04Å; Y254-I286 HydrophobicContact CE1-CD1 4.34Å; Y254-I286 HydrophobicContact CE2-CG1 4.2Å; Y254-I286 HydrophobicContact CG-CG1 4.21Å; Q282-I286 HydrophobicContact CG-CD1 3.73Å; Q282-I286 WeakPolarHBondContact O-CB 3.34Å; Q282-I286 VanDerWaalsContact O-CG1 3.29Å; Q282-I286 WeakPolarHBondContact O-CG1 3.47Å; Q282-I286 PolarHBondContact O-N 3.29Å; I286-I289 PolarHBondContact O-N 3.25Å; I286-F290 HydrophobicContact CG2-CD2 3.74Å; I286-F290 HydrophobicContact CG2-CE2 3.56Å; I286-F290 WeakPolarHBondContact O-CD2 3.39Å; I286-F290 PolarHBondContact O-N 3.5Å; I286-F290 VanDerWaalsContact O-N 3.08Å; I286-L300 HydrophobicContact CG2-CD2 4.43Å
287	S	92.1	Very high	89	Confident	43 Å²	43	56.3 Å²	56.3	30%	0.301	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-39.9	175.3	-56.8	0	0	0	0	112	A213 K283 A284 E285 F290 L291	A213-S287 WeakPolarHBondContact CB-OG 3.48Å; K283-S287 VanDerWaalsContact O-CB 3.28Å; K283-S287 WeakPolarHBondContact O-CB 3.41Å; K283-S287 PolarHBondContact O-N 3.24Å; K283-S287 PolarHBondContact O-OG 3.42Å; A284-S287 PolarHBondContact O-N 2.76Å; E285-S287 VanDerWaalsContact C-N 3.3Å; E285-S287 PolarHBondContact O-N 3.06Å; S287-F290 PolarHBondContact O-N 3.32Å; S287-L291 WeakPolarHBondContact O-CB 3.35Å; S287-L291 PolarHBondContact O-N 2.93Å
288	R	92.5	Very high	89.4	Confident	117 Å²	117	51.9 Å²	51.9	44%	0.442	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-49.7	174.2	-179.3	176	75.3	111.4	-7	111.3	A284 E285 F290 L291 E292	A284-R288 PolarHBondContact O-N 2.88Å; E285-R288 WeakPolarHBondContact O-CB 3.13Å; E285-R288 PolarHBondContact O-N 2.76Å; E285-R288 IonicContact OE1-CZ 2.76Å; E285-R288 IonicContact OE1-NE 3.32Å; E285-R288 IonicContact OE1-NH2 3.2Å; E285-R288 PolarHBondContact OE1-NH2 3.32Å; E285-R288 IonicContact OE2-CZ 3.33Å; E285-R288 VanDerWaalsContact OE2-CZ 3.29Å; E285-R288 IonicContact OE2-NE 3.93Å; E285-R288 PolarHBondContact OE2-NE 3.25Å; E285-R288 IonicContact OE2-NH2 2.63Å; E285-R288 PolarHBondContact OE2-NH2 2.96Å; R288-F290 VanDerWaalsContact C-N 3.3Å; R288-F290 PolarHBondContact O-N 3.32Å; R288-L291 PolarHBondContact O-N 2.99Å; R288-E292 HydrophobicContact CG-CG 4.46Å; R288-E292 WeakPolarHBondContact CG-OE1 3.38Å; R288-E292 IonicContact CZ-OE1 3.7Å; R288-E292 IonicContact NH1-OE1 2.63Å; R288-E292 PolarHBondContact NH1-OE1 3.25Å; R288-E292 WeakPolarHBondContact O-CG 3.47Å; R288-E292 PolarHBondContact O-N 3.45Å
289	I	92.2	Very high	89.8	Confident	11 Å²	11	49 Å²	49	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-41.8	179.2	-67.4	161.4	0	0	0	111.4	A252 Y254 E285 I286 R293 L300	A252-I289 HydrophobicContact CB-CG2 3.69Å; Y254-I289 HydrophobicContact CD2-CD1 3.81Å; Y254-I289 HydrophobicContact CG-CD1 4.37Å; E285-I289 HydrophobicContact CG-CD1 4.01Å; E285-I289 VanDerWaalsContact O-CG1 3.31Å; E285-I289 WeakPolarHBondContact O-CG1 3.39Å; E285-I289 PolarHBondContact O-N 2.98Å; I286-I289 PolarHBondContact O-N 3.25Å; I289-R293 WeakPolarHBondContact O-CG 3.41Å; I289-L300 HydrophobicContact CG2-CD1 4.39Å
290	F	91.4	Very high	90.3	Very high	13 Å²	13	47.3 Å²	47.3	6%	0.057	25%	0.253	C	S	.	.	H	α-helix	trans	-74.7	-21.8	176.5	-75.8	-57.5	0	0	0	114.5	V210 R214 A252 I286 S287 R288 L300 L310	V210-F290 HydrophobicContact CG1-CE2 4.41Å; R214-F290 HydrophobicContact CG-CD2 3.93Å; R214-F290 HydrophobicContact CG-CE2 4.27Å; R214-F290 HydrophobicContact CG-CG 4.15Å; A252-F290 HydrophobicContact CB-CE1 4.11Å; I286-F290 HydrophobicContact CG2-CD2 3.74Å; I286-F290 HydrophobicContact CG2-CE2 3.56Å; I286-F290 WeakPolarHBondContact O-CD2 3.39Å; I286-F290 PolarHBondContact O-N 3.5Å; I286-F290 VanDerWaalsContact O-N 3.08Å; S287-F290 PolarHBondContact O-N 3.32Å; R288-F290 VanDerWaalsContact C-N 3.3Å; R288-F290 PolarHBondContact O-N 3.32Å; F290-L300 HydrophobicContact CE2-CD2 4.14Å; F290-L300 HydrophobicContact CZ-CB 4.1Å; F290-L300 HydrophobicContact CZ-CD1 4.35Å; F290-L300 HydrophobicContact CZ-CD2 4Å; F290-L300 HydrophobicContact CZ-CG 4.4Å; F290-L310 HydrophobicContact CE1-CD1 4.04Å; F290-L310 HydrophobicContact CE2-CD1 4.4Å; F290-L310 HydrophobicContact CZ-CD1 3.57Å
291	L	90.9	Very high	90.6	Very high	154 Å²	154	43.7 Å²	43.7	81%	0.806	23%	0.234	S	C	*	.	H	α-helix	trans	-79.3	-32.1	174	-174	65.3	0	0	0	111.9	S287 R288 R293	S287-L291 WeakPolarHBondContact O-CB 3.35Å; S287-L291 PolarHBondContact O-N 2.93Å; R288-L291 PolarHBondContact O-N 2.99Å; L291-R293 PolarHBondContact O-N 2.93Å
292	E	90	Very high	90.8	Very high	103 Å²	103	42.4 Å²	42.4	48%	0.481	22%	0.223	S	C	.	.	S	Bend	trans	-77.5	0.6	173.5	-66.9	178.3	-164	0	0	113.7	R288	R288-E292 HydrophobicContact CG-CG 4.46Å; R288-E292 WeakPolarHBondContact CG-OE1 3.38Å; R288-E292 IonicContact CZ-OE1 3.7Å; R288-E292 IonicContact NH1-OE1 2.63Å; R288-E292 PolarHBondContact NH1-OE1 3.25Å; R288-E292 WeakPolarHBondContact O-CG 3.47Å; R288-E292 PolarHBondContact O-N 3.45Å
293	R	87.9	Confident	91	Very high	101 Å²	101	45.8 Å²	45.8	38%	0.381	24%	0.235	S	C	.	.	S	Bend	trans	-125.5	166.1	-180	-65.6	-63.1	175.2	-75.4	-6.2	110.6	I289 L291 C297	I289-R293 WeakPolarHBondContact O-CG 3.41Å; L291-R293 PolarHBondContact O-N 2.93Å; R293-C297 HydrophobicContact CB-CB 4.22Å
294	S	81.8	Confident	90.9	Very high	39 Å²	39	46.1 Å²	46.1	27%	0.273	25%	0.246	S	C	.	.			trans	-55.2	139.4	172	-172.1	0	0	0	0	110.3	E250 S296 C297	E250-S294 WeakPolarHBondContact OE2-CB 3.39Å; E250-S294 PolarHBondContact OE2-N 3.02Å; S294-S296 WeakPolarHBondContact CB-OG 3.42Å; S294-S296 PolarHBondContact O-N 2.71Å; S294-S296 WeakPolarHBondContact OG-CB 3.19Å; S294-S296 PolarHBondContact OG-N 3.3Å; S294-S296 PolarHBondContact OG-OG 2.96Å; S294-C297 VanDerWaalsContact O-CB 3.26Å; S294-C297 WeakPolarHBondContact O-CB 3.49Å; S294-C297 PolarHBondContact O-N 3.33Å
295	P	82.8	Confident	90.9	Very high	100 Å²	100	50.1 Å²	50.1	65%	0.649	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-14	169.5	27	-36	0	0	0	111.9	R214	R214-P295 PolarHBondContact NH1-O 3.5Å; R214-P295 VanDerWaalsContact NH1-O 3.09Å; R214-P295 PolarHBondContact NH2-O 3.14Å
296	S	84	Confident	90.9	Very high	21 Å²	21	49 Å²	49	15%	0.147	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-12.6	174.8	91.7	0	0	0	0	114.3	S294 M298 H354 R358	S294-S296 WeakPolarHBondContact CB-OG 3.42Å; S294-S296 PolarHBondContact O-N 2.71Å; S294-S296 WeakPolarHBondContact OG-CB 3.19Å; S294-S296 PolarHBondContact OG-N 3.3Å; S294-S296 PolarHBondContact OG-OG 2.96Å; S296-M298 PolarHBondContact O-N 3.18Å; S296-H354 PolarHBondContact OG-CE1 3.48Å; S296-R358 VanDerWaalsContact CA-NH2 3.29Å; S296-R358 VanDerWaalsContact CB-CZ 3.47Å; S296-R358 PolarHBondContact O-NH2 2.85Å
297	C	91.6	Very high	91	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.			trans	-65.2	122.2	174.1	172.9	0	0	0	0	110.9	E250 A252 R293 S294 V299	E250-C297 PolarHBondContact O-SG 2.98Å; E250-C297 VanDerWaalsContact O-SG 3.37Å; A252-C297 PolarHBondContact N-SG 3.07Å; A252-C297 VanDerWaalsContact N-SG 3.37Å; R293-C297 HydrophobicContact CB-CB 4.22Å; S294-C297 VanDerWaalsContact O-CB 3.26Å; S294-C297 WeakPolarHBondContact O-CB 3.49Å; S294-C297 PolarHBondContact O-N 3.33Å; C297-V299 PolarHBondContact SG-O 3.28Å
298	M	92.9	Very high	91.2	Very high	8 Å²	8	47 Å²	47	4%	0.039	23%	0.23	C	C	.	.			trans	-126.2	8	-177.4	-64.8	-67.3	-179.8	0	0	113.9	S296 L310 Q312 I320	S296-M298 PolarHBondContact O-N 3.18Å; M298-L310 HydrophobicContact CB-CB 4.45Å; M298-L310 WeakPolarHBondContact O-CB 3.43Å; M298-L310 WeakPolarHBondContact O-CG 3.39Å; M298-L310 PolarHBondContact O-N 2.89Å; M298-L310 HydrophobicContact SD-CB 4.33Å; M298-Q312 HydrophobicContact CE-CG 4.41Å; M298-I320 HydrophobicContact CB-CD1 3.69Å; M298-I320 HydrophobicContact CB-CG2 4.49Å; M298-I320 HydrophobicContact CG-CD1 4.12Å
299	V	95.1	Very high	91.4	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.7	175.3	-179.6	0	0	0	0	108.6	L248 T251 A252 C297 L301 I320 S324	L248-V299 HydrophobicContact CD2-CG2 3.98Å; T251-V299 HydrophobicContact CG2-CB 4.02Å; T251-V299 HydrophobicContact CG2-CG1 4.12Å; A252-V299 PolarHBondContact N-O 3.43Å; C297-V299 PolarHBondContact SG-O 3.28Å; V299-L301 HydrophobicContact CG1-CD2 4.35Å; V299-I320 HydrophobicContact CG2-CG2 3.63Å; V299-S324 WeakPolarHBondContact CG2-OG 3.23Å
300	L	95.5	Very high	91.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	108.2	173.9	-179.5	63.9	0	0	0	109.2	V210 A252 I286 I289 F290 L308	V210-L300 HydrophobicContact CG2-CD2 4.02Å; A252-L300 HydrophobicContact CB-CD1 3.47Å; A252-L300 VanDerWaalsContact CB-CD1 3.47Å; I286-L300 HydrophobicContact CG2-CD2 4.43Å; I289-L300 HydrophobicContact CG2-CD1 4.39Å; F290-L300 HydrophobicContact CE2-CD2 4.14Å; F290-L300 HydrophobicContact CZ-CB 4.1Å; F290-L300 HydrophobicContact CZ-CD1 4.35Å; F290-L300 HydrophobicContact CZ-CD2 4Å; F290-L300 HydrophobicContact CZ-CG 4.4Å; L300-L308 HydrophobicContact CB-CB 4.29Å; L300-L308 HydrophobicContact CD2-CD1 4.21Å; L300-L308 PolarHBondContact N-O 2.93Å; L300-L308 PolarHBondContact O-N 2.89Å
301	L	95.7	Very high	91.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.3	171.8	-60.9	177.7	0	0	0	108.9	V231 L238 A252 V253 Y254 V299 L307	V231-L301 HydrophobicContact CG1-CD1 4.34Å; L238-L301 HydrophobicContact CB-CD1 4.39Å; A252-L301 PolarHBondContact O-N 3.26Å; V253-L301 CarbonylContact C-O 3.55Å; V253-L301 WeakPolarHBondContact CA-O 3.46Å; V253-L301 HydrophobicContact CG2-CB 4.36Å; V253-L301 HydrophobicContact CG2-CD1 4.37Å; Y254-L301 PolarHBondContact N-O 2.9Å; V299-L301 HydrophobicContact CG1-CD2 4.35Å; L301-L307 HydrophobicContact CD2-CB 3.77Å
302	V	94.1	Very high	91.8	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	110.7	175.4	-174.2	0	0	0	0	107.5	L206 S232 Y254 P256 S304 Y305 G306 L308	L206-V302 HydrophobicContact CD2-CG2 4.43Å; S232-V302 WeakPolarHBondContact CB-O 3.26Å; S232-V302 PolarHBondContact OG-O 3.01Å; Y254-V302 HydrophobicContact CD1-CG1 4.02Å; Y254-V302 HydrophobicContact CD1-CG2 4.3Å; Y254-V302 WeakPolarHBondContact O-CA 3.3Å; P256-V302 HydrophobicContact CG-CG1 3.76Å; V302-S304 PolarHBondContact O-N 3.43Å; V302-Y305 HydrophobicContact CG1-CD2 3.99Å; V302-Y305 HydrophobicContact CG1-CG 4.3Å; V302-Y305 PolarHBondContact O-N 3.11Å; V302-G306 PolarHBondContact N-O 3.01Å; V302-G306 PolarHBondContact O-N 2.63Å; V302-G306 VanDerWaalsContact O-N 3.08Å; V302-L308 HydrophobicContact CG2-CD1 4.09Å; V302-L308 HydrophobicContact CG2-CG 4.17Å
303	R	93.5	Very high	92	Very high	87 Å²	87	33.2 Å²	33.2	33%	0.328	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	128.6	-174.1	-74.6	-168.5	171.2	159.3	-5.8	111.4	V253 Y254 D255 Y305	V253-R303 HydrophobicContact CG1-CG 3.86Å; Y254-R303 PolarHBondContact O-N 2.88Å; D255-R303 HydrophobicContact CB-CG 4.41Å; D255-R303 VanDerWaalsContact OD2-CD 3.32Å; D255-R303 WeakPolarHBondContact OD2-CD 3.33Å; D255-R303 IonicContact OD2-CZ 2.6Å; D255-R303 IonicContact OD2-NE 3.99Å; D255-R303 IonicContact OD2-NH1 3.2Å; D255-R303 PolarHBondContact OD2-NH1 3.48Å; R303-Y305 VanDerWaalsContact O-CD2 3.29Å; R303-Y305 WeakPolarHBondContact O-CD2 3.45Å; R303-Y305 PolarHBondContact O-N 3.03Å
304	S	89.5	Confident	92.4	Very high	81 Å²	81	29 Å²	29	57%	0.566	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	5.2	-179.8	-48.5	0	0	0	0	116.4	S232 V302	S232-S304 PolarHBondContact OG-N 2.99Å; V302-S304 PolarHBondContact O-N 3.43Å
305	Y	90.4	Very high	93	Very high	145 Å²	145	27.6 Å²	27.6	57%	0.569	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-37.7	178.3	-73.2	-85.9	0	0	0	113.6	V229 P256 V302 R303	V229-Y305 WeakPolarHBondContact CG2-O 3.37Å; P256-Y305 HydrophobicContact CG-CD2 4.11Å; P256-Y305 HydrophobicContact CG-CE2 4.02Å; V302-Y305 HydrophobicContact CG1-CD2 3.99Å; V302-Y305 HydrophobicContact CG1-CG 4.3Å; V302-Y305 PolarHBondContact O-N 3.11Å; R303-Y305 VanDerWaalsContact O-CD2 3.29Å; R303-Y305 WeakPolarHBondContact O-CD2 3.45Å; R303-Y305 PolarHBondContact O-N 3.03Å
306	G	92.8	Very high	93.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.6	-140.8	-179.8	0	0	0	0	0	113.4	V302	V302-G306 PolarHBondContact N-O 3.01Å; V302-G306 PolarHBondContact O-N 2.63Å; V302-G306 VanDerWaalsContact O-N 3.08Å
307	L	95	Very high	94.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147.8	-179.8	71.4	85.2	0	0	0	113.2	H222 L223 A228 L301 A309	H222-L307 PolarHBondContact CD2-O 3.08Å; L223-L307 HydrophobicContact CB-CD1 4.14Å; L223-L307 HydrophobicContact CB-CG 4.22Å; L223-L307 HydrophobicContact CD1-CD1 4.4Å; L223-L307 HydrophobicContact CG-CD1 4.46Å; L223-L307 PolarHBondContact N-O 2.81Å; L223-L307 PolarHBondContact O-N 3.47Å; A228-L307 HydrophobicContact CB-CB 4.37Å; A228-L307 HydrophobicContact CB-CD2 3.6Å; A228-L307 HydrophobicContact CB-CG 3.88Å; L301-L307 HydrophobicContact CD2-CB 3.77Å; L307-A309 HydrophobicContact CD1-CB 4.22Å
308	L	95.9	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.2	167.8	-60.4	176.2	0	0	0	108.8	L206 V210 I220 H222 L300 V302 L310	L206-L308 HydrophobicContact CD1-CD1 4.42Å; L206-L308 HydrophobicContact CD2-CD1 4.03Å; L206-L308 HydrophobicContact CG-CD1 4.02Å; V210-L308 HydrophobicContact CG2-CD1 4.2Å; I220-L308 HydrophobicContact CG2-CB 4.18Å; I220-L308 HydrophobicContact CG2-CD2 4.02Å; H222-L308 HydrophobicContact CB-CD2 3.51Å; H222-L308 VanDerWaalsContact CG-CD2 3.42Å; L300-L308 HydrophobicContact CB-CB 4.29Å; L300-L308 HydrophobicContact CD2-CD1 4.21Å; L300-L308 PolarHBondContact N-O 2.93Å; L300-L308 PolarHBondContact O-N 2.89Å; V302-L308 HydrophobicContact CG2-CD1 4.09Å; V302-L308 HydrophobicContact CG2-CG 4.17Å; L308-L310 HydrophobicContact CB-CD2 4.34Å
309	A	96.2	Very high	94.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.4	172	0	0	0	0	0	109.9	I220 I221 L307 I320 A321	I220-A309 WeakPolarHBondContact CA-O 3.48Å; I221-A309 HydrophobicContact CB-CB 4.42Å; I221-A309 PolarHBondContact N-O 3.09Å; I221-A309 PolarHBondContact O-N 2.83Å; L307-A309 HydrophobicContact CD1-CB 4.22Å; A309-I320 HydrophobicContact CB-CG2 3.97Å; A309-A321 HydrophobicContact CB-CB 3.68Å
310	L	96.3	Very high	94.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	144.9	-174.6	-46.6	-177.8	0	0	0	110.3	V210 V217 I220 F290 M298 L308 I320	V210-L310 HydrophobicContact CG1-CD1 4.06Å; V210-L310 HydrophobicContact CG1-CD2 3.74Å; V217-L310 HydrophobicContact CG1-CB 3.96Å; V217-L310 HydrophobicContact CG1-CD2 4.31Å; V217-L310 HydrophobicContact CG2-CB 3.95Å; V217-L310 HydrophobicContact CG2-CD1 4.29Å; I220-L310 HydrophobicContact CB-CD2 4.3Å; I220-L310 HydrophobicContact CD1-CD2 4.21Å; I220-L310 HydrophobicContact CG1-CD2 3.79Å; I220-L310 HydrophobicContact CG2-CD2 3.9Å; F290-L310 HydrophobicContact CE1-CD1 4.04Å; F290-L310 HydrophobicContact CE2-CD1 4.4Å; F290-L310 HydrophobicContact CZ-CD1 3.57Å; M298-L310 HydrophobicContact CB-CB 4.45Å; M298-L310 WeakPolarHBondContact O-CB 3.43Å; M298-L310 WeakPolarHBondContact O-CG 3.39Å; M298-L310 PolarHBondContact O-N 2.89Å; M298-L310 HydrophobicContact SD-CB 4.33Å; L308-L310 HydrophobicContact CB-CD2 4.34Å; L310-I320 WeakPolarHBondContact O-CD1 3.25Å
311	G	94.2	Very high	94.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.3	173.1	0	0	0	0	0	114.1	R218 C219 S313	R218-G311 PolarHBondContact N-O 2.83Å; C219-G311 PolarHBondContact N-O 2.73Å; C219-G311 PolarHBondContact O-N 3.44Å; G311-S313 PolarHBondContact O-N 3.42Å
312	Q	93.1	Very high	94.4	Very high	89 Å²	89	25.1 Å²	25.1	42%	0.416	12%	0.119	S	C	.	.	S	Bend	trans	-77.3	-7.2	173	-53.1	-176.7	-0.9	0	0	112	R218 M298 E316	R218-Q312 VanDerWaalsContact CD-O 3.26Å; R218-Q312 WeakPolarHBondContact CD-O 3.34Å; R218-Q312 WeakPolarHBondContact CG-O 3.45Å; M298-Q312 HydrophobicContact CE-CG 4.41Å; Q312-E316 VanDerWaalsContact CB-OE2 3.3Å; Q312-E316 WeakPolarHBondContact CB-OE2 3.42Å; Q312-E316 PolarHBondContact N-OE2 2.87Å
313	S	93.8	Very high	94.3	Very high	19 Å²	19	25.4 Å²	25.4	13%	0.133	12%	0.121	C	C	.	.	S	Bend	trans	-142.3	167.3	170.7	64.1	0	0	0	0	110.2	G311 E315 E316 A317	G311-S313 PolarHBondContact O-N 3.42Å; S313-E315 VanDerWaalsContact C-N 3.29Å; S313-E316 WeakPolarHBondContact OG-CB 3.39Å; S313-E316 PolarHBondContact OG-N 3.48Å; S313-A317 WeakPolarHBondContact O-CB 3.34Å; S313-A317 PolarHBondContact O-N 2.72Å; S313-A317 VanDerWaalsContact O-N 3.08Å
314	I	95.9	Very high	94.4	Very high	12 Å²	12	21.3 Å²	21.3	6%	0.062	11%	0.106	C	C	.	.	H	α-helix	trans	-70.4	-35.6	176.1	-66.2	174	0	0	0	109.4	I128 K131 L132 V135 A154 C219 A317 W318 F383	I128-I314 HydrophobicContact CG2-CD1 3.96Å; K131-I314 HydrophobicContact CB-CD1 3.77Å; K131-I314 HydrophobicContact CB-CG2 4.25Å; L132-I314 HydrophobicContact CB-CD1 4.33Å; V135-I314 HydrophobicContact CG2-CG2 3.48Å; V135-I314 VanDerWaalsContact CG2-CG2 3.48Å; A154-I314 HydrophobicContact CB-CD1 4.18Å; A154-I314 HydrophobicContact CB-CG1 4.42Å; C219-I314 HydrophobicContact CB-CG1 4Å; I314-A317 PolarHBondContact O-N 3.4Å; I314-W318 WeakPolarHBondContact O-CB 3.38Å; I314-W318 PolarHBondContact O-N 3.17Å; I314-F383 HydrophobicContact CG2-CE2 4.31Å; I314-F383 HydrophobicContact CG2-CZ 4.34Å
315	E	94.4	Very high	94.7	Very high	10 Å²	10	17.6 Å²	17.6	5%	0.047	8%	0.079	C	C	.	.	H	α-helix	trans	-63.7	-45.9	177.3	-61.2	91.2	152.6	0	0	112.1	K131 S313 W318 F319 E380 F383	K131-E315 WeakPolarHBondContact CD-OE1 3.39Å; K131-E315 WeakPolarHBondContact CE-OE1 3.41Å; K131-E315 IonicContact NZ-OE1 2.91Å; K131-E315 PolarHBondContact NZ-OE1 2.9Å; S313-E315 VanDerWaalsContact C-N 3.29Å; E315-W318 PolarHBondContact O-N 2.99Å; E315-F319 PolarHBondContact O-N 3.28Å; E315-E380 HydrophobicContact CB-CG 4.1Å; E315-E380 HydrophobicContact CG-CG 4.24Å; E315-F383 HydrophobicContact CB-CB 4.02Å; E315-F383 HydrophobicContact CB-CD2 4.44Å; E315-F383 HydrophobicContact CB-CG 4.17Å; E315-F383 HydrophobicContact CG-CB 3.77Å; E315-F383 HydrophobicContact CG-CD1 3.71Å; E315-F383 HydrophobicContact CG-CD2 4.17Å; E315-F383 HydrophobicContact CG-CE1 4.33Å; E315-F383 HydrophobicContact CG-CG 3.61Å
316	E	93.9	Very high	94.9	Very high	20 Å²	20	13.6 Å²	13.6	9%	0.093	7%	0.067	C	C	.	.	H	α-helix	trans	-66.6	-44.9	174.6	177.5	176.1	-144.1	0	0	111.8	Q312 S313 W318 F319 I320 R378	Q312-E316 VanDerWaalsContact CB-OE2 3.3Å; Q312-E316 WeakPolarHBondContact CB-OE2 3.42Å; Q312-E316 PolarHBondContact N-OE2 2.87Å; S313-E316 WeakPolarHBondContact OG-CB 3.39Å; S313-E316 PolarHBondContact OG-N 3.48Å; E316-W318 VanDerWaalsContact C-N 3.27Å; E316-W318 PolarHBondContact O-N 2.98Å; E316-F319 PolarHBondContact O-N 3Å; E316-I320 HydrophobicContact CG-CD1 3.62Å; E316-I320 HydrophobicContact CG-CG1 4.41Å; E316-I320 WeakPolarHBondContact O-CB 3.38Å; E316-I320 WeakPolarHBondContact O-CG1 3.4Å; E316-I320 PolarHBondContact O-N 2.9Å; E316-R378 IonicContact OE1-NH1 2.86Å
317	A	96.1	Very high	94.9	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60	-40.6	177	0	0	0	0	0	111	C219 I221 S313 I314 I320 A321	C219-A317 HydrophobicContact CB-CB 3.79Å; I221-A317 HydrophobicContact CD1-CB 4.09Å; I221-A317 HydrophobicContact CG1-CB 4.27Å; S313-A317 WeakPolarHBondContact O-CB 3.34Å; S313-A317 PolarHBondContact O-N 2.72Å; S313-A317 VanDerWaalsContact O-N 3.08Å; I314-A317 PolarHBondContact O-N 3.4Å; A317-I320 PolarHBondContact O-N 2.95Å; A317-A321 VanDerWaalsContact O-CB 3.29Å; A317-A321 WeakPolarHBondContact O-CB 3.49Å; A317-A321 PolarHBondContact O-N 3.34Å
318	W	96.1	Very high	94.9	Very high	5 Å²	5	13.7 Å²	13.7	2%	0.019	7%	0.068	C	C	.	.	H	α-helix	trans	-63.3	-46.3	174.1	174.7	-96.3	0	0	0	112.6	V135 L138 V139 F142 W144 I221 I314 E315 E316 I320 A321 F322 F383 L386	V135-W318 HydrophobicContact CG1-CE3 3.99Å; V135-W318 HydrophobicContact CG1-CZ3 4.43Å; V135-W318 HydrophobicContact CG2-CB 4.47Å; V135-W318 HydrophobicContact CG2-CE3 4.36Å; L138-W318 HydrophobicContact CB-CE3 4.37Å; L138-W318 HydrophobicContact CB-CH2 3.47Å; L138-W318 VanDerWaalsContact CB-CH2 3.47Å; L138-W318 HydrophobicContact CB-CZ2 3.96Å; L138-W318 HydrophobicContact CB-CZ3 3.69Å; L138-W318 HydrophobicContact CD1-CD2 4.16Å; L138-W318 HydrophobicContact CD1-CE3 4.38Å; L138-W318 HydrophobicContact CD1-CH2 4.34Å; L138-W318 HydrophobicContact CD1-CZ2 4.1Å; L138-W318 HydrophobicContact CD1-CZ3 4.46Å; L138-W318 HydrophobicContact CG-CH2 4.46Å; V139-W318 HydrophobicContact CG2-CZ3 3.79Å; F142-W318 AromaticContact CD2-CH2 3.68Å; F142-W318 HydrophobicContact CD2-CH2 3.68Å; F142-W318 AromaticContact CD2-CZ2 3.89Å; F142-W318 HydrophobicContact CD2-CZ2 3.89Å; F142-W318 AromaticContact CE2-CH2 3.93Å; F142-W318 HydrophobicContact CE2-CH2 3.93Å; F142-W318 AromaticContact CE2-CZ2 3.63Å; F142-W318 HydrophobicContact CE2-CZ2 3.63Å; F142-W318 HydrophobicContact CZ-CZ2 4.47Å; W144-W318 HydrophobicContact CE3-CH2 4.23Å; W144-W318 HydrophobicContact CE3-CZ3 4.42Å; W144-W318 AromaticContact CH2-CH2 3.99Å; W144-W318 HydrophobicContact CH2-CH2 3.99Å; W144-W318 HydrophobicContact CH2-CZ2 4.32Å; W144-W318 AromaticContact CZ3-CH2 3.46Å; W144-W318 HydrophobicContact CZ3-CH2 3.46Å; W144-W318 VanDerWaalsContact CZ3-CH2 3.46Å; W144-W318 HydrophobicContact CZ3-CZ2 4.18Å; W144-W318 AromaticContact CZ3-CZ3 3.8Å; W144-W318 HydrophobicContact CZ3-CZ3 3.8Å; I221-W318 HydrophobicContact CD1-CB 4.34Å; I221-W318 HydrophobicContact CD1-CE3 4.34Å; I314-W318 WeakPolarHBondContact O-CB 3.38Å; I314-W318 PolarHBondContact O-N 3.17Å; E315-W318 PolarHBondContact O-N 2.99Å; E316-W318 VanDerWaalsContact C-N 3.27Å; E316-W318 PolarHBondContact O-N 2.98Å; W318-I320 VanDerWaalsContact C-N 3.33Å; W318-I320 PolarHBondContact O-N 2.81Å; W318-A321 PolarHBondContact O-N 3.29Å; W318-F322 HydrophobicContact CZ2-CD2 4.16Å; W318-F322 WeakPolarHBondContact O-CB 3.22Å; W318-F322 PolarHBondContact O-N 3.29Å; W318-F383 HydrophobicContact CB-CD2 4.01Å; W318-F383 HydrophobicContact CB-CE2 4.21Å; W318-F383 AromaticContact CD1-CD2 3.99Å; W318-F383 HydrophobicContact CG-CD2 4.01Å; W318-F383 HydrophobicContact CG-CE2 4.31Å; W318-L386 HydrophobicContact CZ2-CD1 4.13Å
319	F	94.5	Very high	94.8	Very high	19 Å²	19	16.3 Å²	16.3	8%	0.083	8%	0.08	C	C	.	.	H	α-helix	trans	-56.5	-48.3	175.5	175.3	-90	0	0	0	111	I247 E315 E316 F322 T323 R378	I247-F319 HydrophobicContact CG2-CE1 3.94Å; I247-F319 HydrophobicContact CG2-CZ 4Å; E315-F319 PolarHBondContact O-N 3.28Å; E316-F319 PolarHBondContact O-N 3Å; F319-F322 PolarHBondContact O-N 3.29Å; F319-T323 WeakPolarHBondContact O-CB 3.31Å; F319-T323 PolarHBondContact O-N 3.49Å; F319-T323 PolarHBondContact O-OG1 3.07Å; F319-R378 HydrophobicContact CD1-CG 4.11Å; F319-R378 HydrophobicContact CE1-CG 4.28Å
320	I	95	Very high	94.7	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-65	-42	179.8	-68.3	167.5	0	0	0	111.1	L248 M298 V299 A309 L310 E316 A317 W318 S324	L248-I320 HydrophobicContact CD2-CB 4.41Å; L248-I320 HydrophobicContact CD2-CG2 3.9Å; M298-I320 HydrophobicContact CB-CD1 3.69Å; M298-I320 HydrophobicContact CB-CG2 4.49Å; M298-I320 HydrophobicContact CG-CD1 4.12Å; V299-I320 HydrophobicContact CG2-CG2 3.63Å; A309-I320 HydrophobicContact CB-CG2 3.97Å; L310-I320 WeakPolarHBondContact O-CD1 3.25Å; E316-I320 HydrophobicContact CG-CD1 3.62Å; E316-I320 HydrophobicContact CG-CG1 4.41Å; E316-I320 WeakPolarHBondContact O-CB 3.38Å; E316-I320 WeakPolarHBondContact O-CG1 3.4Å; E316-I320 PolarHBondContact O-N 2.9Å; A317-I320 PolarHBondContact O-N 2.95Å; W318-I320 VanDerWaalsContact C-N 3.33Å; W318-I320 PolarHBondContact O-N 2.81Å; I320-S324 WeakPolarHBondContact O-CB 3.46Å; I320-S324 PolarHBondContact O-N 3.34Å; I320-S324 PolarHBondContact O-OG 3.01Å
321	A	95.9	Very high	94.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.8	-45.2	175.3	0	0	0	0	0	112.2	I221 L223 A309 A317 W318 S324 M325	I221-A321 HydrophobicContact CB-CB 4.29Å; I221-A321 HydrophobicContact CD1-CB 3.89Å; I221-A321 HydrophobicContact CG2-CB 4.19Å; L223-A321 HydrophobicContact CD1-CB 4.12Å; A309-A321 HydrophobicContact CB-CB 3.68Å; A317-A321 VanDerWaalsContact O-CB 3.29Å; A317-A321 WeakPolarHBondContact O-CB 3.49Å; A317-A321 PolarHBondContact O-N 3.34Å; W318-A321 PolarHBondContact O-N 3.29Å; A321-S324 PolarHBondContact O-N 2.93Å; A321-M325 WeakPolarHBondContact O-CB 3.47Å; A321-M325 WeakPolarHBondContact O-CG 3.33Å; A321-M325 PolarHBondContact O-N 3.01Å
322	F	95.1	Very high	94.4	Very high	37 Å²	37	22.2 Å²	22.2	16%	0.162	11%	0.114	C	C	.	.	H	α-helix	trans	-64	-47.5	179	-179.6	-84.8	0	0	0	111.9	F142 W144 W318 F319 M325 L326 T460	F142-F322 AromaticContact CE1-CE2 3.9Å; F142-F322 HydrophobicContact CE1-CE2 3.9Å; F142-F322 HydrophobicContact CZ-CD2 4.39Å; F142-F322 AromaticContact CZ-CE2 3.95Å; F142-F322 HydrophobicContact CZ-CE2 3.95Å; W144-F322 HydrophobicContact CH2-CB 4.03Å; W144-F322 AromaticContact CH2-CD2 3.69Å; W144-F322 HydrophobicContact CH2-CD2 3.69Å; W144-F322 HydrophobicContact CH2-CG 4.2Å; W144-F322 HydrophobicContact CZ2-CD2 4.24Å; W318-F322 HydrophobicContact CZ2-CD2 4.16Å; W318-F322 WeakPolarHBondContact O-CB 3.22Å; W318-F322 PolarHBondContact O-N 3.29Å; F319-F322 PolarHBondContact O-N 3.29Å; F322-M325 PolarHBondContact O-N 2.92Å; F322-L326 HydrophobicContact CD1-CD1 4.01Å; F322-L326 HydrophobicContact CE1-CD1 3.47Å; F322-L326 VanDerWaalsContact CE1-CD1 3.47Å; F322-L326 HydrophobicContact CE1-CG 4.29Å; F322-L326 HydrophobicContact CZ-CD1 4.07Å; F322-L326 PolarHBondContact O-N 3.23Å; F322-L326 VanDerWaalsContact O-N 3.15Å; F322-T460 HydrophobicContact CE1-CG2 4.36Å; F322-T460 HydrophobicContact CE2-CG2 4.35Å; F322-T460 HydrophobicContact CZ-CG2 4Å
323	T	93.9	Very high	94.3	Very high	9 Å²	9	26.1 Å²	26.1	6%	0.055	13%	0.125	C	C	.	.	H	α-helix	trans	-65.3	-39.6	176.7	-55	0	0	0	0	111.6	E244 I247 L248 F319 M325 L326 A327	E244-T323 HydrophobicContact CB-CG2 3.61Å; E244-T323 HydrophobicContact CG-CG2 4.12Å; E244-T323 WeakPolarHBondContact O-CG2 3.44Å; I247-T323 HydrophobicContact CB-CG2 4.36Å; I247-T323 HydrophobicContact CG2-CG2 4.03Å; L248-T323 HydrophobicContact CD1-CG2 4.11Å; L248-T323 HydrophobicContact CD2-CG2 4.09Å; L248-T323 HydrophobicContact CG-CG2 3.84Å; F319-T323 WeakPolarHBondContact O-CB 3.31Å; F319-T323 PolarHBondContact O-N 3.49Å; F319-T323 PolarHBondContact O-OG1 3.07Å; T323-M325 VanDerWaalsContact C-N 3.35Å; T323-M325 PolarHBondContact O-N 3.26Å; T323-L326 PolarHBondContact O-N 3.43Å; T323-A327 WeakPolarHBondContact O-CB 3.37Å; T323-A327 PolarHBondContact O-N 3.46Å
324	S	95.3	Very high	94.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.007	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-41	175.8	-58.3	0	0	0	0	112.1	V299 I320 A321 A327 C328	V299-S324 WeakPolarHBondContact CG2-OG 3.23Å; I320-S324 WeakPolarHBondContact O-CB 3.46Å; I320-S324 PolarHBondContact O-N 3.34Å; I320-S324 PolarHBondContact O-OG 3.01Å; A321-S324 PolarHBondContact O-N 2.93Å; S324-A327 PolarHBondContact O-N 3.01Å; S324-C328 WeakPolarHBondContact O-CB 3.24Å; S324-C328 PolarHBondContact O-N 2.96Å; S324-C328 PolarHBondContact O-SG 3.25Å
325	M	94.5	Very high	93.6	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-46.5	176.4	-81.9	-57.6	-44.5	0	0	112.3	W144 L223 T225 A227 A321 F322 T323 A327 C328 E329	W144-M325 HydrophobicContact CD2-CG 3.91Å; W144-M325 HydrophobicContact CE3-CG 4.14Å; W144-M325 HydrophobicContact CG-CG 4.5Å; W144-M325 HydrophobicContact CH2-CB 4.17Å; W144-M325 HydrophobicContact CH2-CG 4.17Å; W144-M325 HydrophobicContact CZ2-CB 3.74Å; W144-M325 HydrophobicContact CZ2-CG 3.92Å; W144-M325 HydrophobicContact CZ3-CG 4.26Å; L223-M325 HydrophobicContact CD1-CG 3.53Å; L223-M325 HydrophobicContact CD1-SD 3.96Å; T225-M325 HydrophobicContact CG2-CE 3.77Å; T225-M325 HydrophobicContact CG2-SD 3.69Å; T225-M325 VanDerWaalsContact OG1-CE 3.24Å; T225-M325 WeakPolarHBondContact OG1-CE 3.48Å; T225-M325 PolarHBondContact OG1-SD 2.93Å; A227-M325 HydrophobicContact CB-CE 4.39Å; A321-M325 WeakPolarHBondContact O-CB 3.47Å; A321-M325 WeakPolarHBondContact O-CG 3.33Å; A321-M325 PolarHBondContact O-N 3.01Å; F322-M325 PolarHBondContact O-N 2.92Å; T323-M325 VanDerWaalsContact C-N 3.35Å; T323-M325 PolarHBondContact O-N 3.26Å; M325-A327 PolarHBondContact O-N 2.93Å; M325-C328 PolarHBondContact O-N 3.46Å; M325-E329 HydrophobicContact CE-CG 4.32Å; M325-E329 WeakPolarHBondContact O-CG 3.16Å; M325-E329 PolarHBondContact O-N 3.26Å
326	L	94.3	Very high	93.3	Very high	61 Å²	61	36 Å²	36	32%	0.319	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-43.9	175.8	-69.2	179	0	0	0	112.1	E244 F322 T323 E329 A330	E244-L326 HydrophobicContact CB-CB 4.33Å; E244-L326 HydrophobicContact CG-CB 3.86Å; E244-L326 HydrophobicContact CG-CD1 4.09Å; F322-L326 HydrophobicContact CD1-CD1 4.01Å; F322-L326 HydrophobicContact CE1-CD1 3.47Å; F322-L326 VanDerWaalsContact CE1-CD1 3.47Å; F322-L326 HydrophobicContact CE1-CG 4.29Å; F322-L326 HydrophobicContact CZ-CD1 4.07Å; F322-L326 PolarHBondContact O-N 3.23Å; F322-L326 VanDerWaalsContact O-N 3.15Å; T323-L326 PolarHBondContact O-N 3.43Å; L326-E329 PolarHBondContact O-N 2.71Å; L326-A330 WeakPolarHBondContact O-CB 3.49Å; L326-A330 PolarHBondContact O-N 2.88Å
327	A	94.4	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-46.4	178.1	0	0	0	0	0	112.2	L238 E244 A245 L248 T323 S324 M325 E329 A330 Q331	L238-A327 HydrophobicContact CD1-CB 3.9Å; L238-A327 HydrophobicContact CD2-CB 4.04Å; L238-A327 HydrophobicContact CG-CB 4.46Å; E244-A327 HydrophobicContact CB-CB 4.02Å; A245-A327 HydrophobicContact CB-CB 4.01Å; L248-A327 HydrophobicContact CD1-CB 4.15Å; T323-A327 WeakPolarHBondContact O-CB 3.37Å; T323-A327 PolarHBondContact O-N 3.46Å; S324-A327 PolarHBondContact O-N 3.01Å; M325-A327 PolarHBondContact O-N 2.93Å; A327-E329 PolarHBondContact O-N 2.83Å; A327-A330 PolarHBondContact O-N 3.23Å; A327-Q331 PolarHBondContact O-N 3.23Å
328	C	94.9	Very high	92.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-41.5	176.9	-72.5	0	0	0	0	112.3	A227 V231 S324 M325 Q331 L332	A227-C328 HydrophobicContact CB-CB 4.13Å; V231-C328 HydrophobicContact CG2-CB 4.02Å; S324-C328 WeakPolarHBondContact O-CB 3.24Å; S324-C328 PolarHBondContact O-N 2.96Å; S324-C328 PolarHBondContact O-SG 3.25Å; M325-C328 PolarHBondContact O-N 3.46Å; C328-Q331 PolarHBondContact O-N 2.94Å; C328-L332 WeakPolarHBondContact O-CB 3.26Å; C328-L332 PolarHBondContact O-N 3.2Å
329	E	93.8	Very high	92	Very high	56 Å²	56	45.4 Å²	45.4	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-35.5	176.1	-69.1	-176.9	-167.7	0	0	112.7	A227 M325 L326 A327 L332 R333	A227-E329 HydrophobicContact CB-CB 4.48Å; A227-E329 HydrophobicContact CB-CG 3.8Å; M325-E329 HydrophobicContact CE-CG 4.32Å; M325-E329 WeakPolarHBondContact O-CG 3.16Å; M325-E329 PolarHBondContact O-N 3.26Å; L326-E329 PolarHBondContact O-N 2.71Å; A327-E329 PolarHBondContact O-N 2.83Å; E329-L332 PolarHBondContact O-N 2.82Å; E329-R333 VanDerWaalsContact CB-NH1 3.25Å; E329-R333 VanDerWaalsContact O-CG 3.27Å; E329-R333 WeakPolarHBondContact O-CG 3.35Å; E329-R333 PolarHBondContact O-N 3.01Å; E329-R333 IonicContact OE2-CZ 2.8Å; E329-R333 IonicContact OE2-NH1 2.7Å; E329-R333 PolarHBondContact OE2-NH1 2.84Å; E329-R333 VanDerWaalsContact OE2-NH1 3.09Å; E329-R333 IonicContact OE2-NH2 3.34Å; E329-R333 PolarHBondContact OE2-NH2 2.74Å
330	A	92.6	Very high	91.5	Very high	26 Å²	26	52.1 Å²	52.1	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-45.7	174.3	0	0	0	0	0	111.1	L326 A327 R333 L334	L326-A330 WeakPolarHBondContact O-CB 3.49Å; L326-A330 PolarHBondContact O-N 2.88Å; A327-A330 PolarHBondContact O-N 3.23Å; A330-R333 PolarHBondContact O-N 3.46Å; A330-L334 WeakPolarHBondContact O-CG 3.49Å; A330-L334 PolarHBondContact O-N 2.96Å
331	Q	93.5	Very high	91.2	Very high	18 Å²	18	58.7 Å²	58.7	8%	0.084	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-41.9	175.2	-173.9	171.8	-29.6	0	0	112.6	V231 G237 I241 A327 C328 R333 L334 A335	V231-Q331 HydrophobicContact CG2-CB 4.24Å; V231-Q331 HydrophobicContact CG2-CG 4.29Å; G237-Q331 PolarHBondContact O-NE2 3.48Å; G237-Q331 PolarHBondContact O-OE1 2.9Å; I241-Q331 HydrophobicContact CD1-CB 3.72Å; I241-Q331 HydrophobicContact CD1-CG 4.01Å; A327-Q331 PolarHBondContact O-N 3.23Å; C328-Q331 PolarHBondContact O-N 2.94Å; Q331-R333 VanDerWaalsContact C-N 3.32Å; Q331-R333 PolarHBondContact O-N 3.38Å; Q331-L334 CarbonylContact O-C 3.57Å; Q331-L334 PolarHBondContact O-N 2.94Å; Q331-L334 VanDerWaalsContact O-N 3.15Å; Q331-A335 PolarHBondContact O-N 2.98Å; Q331-A335 VanDerWaalsContact O-N 3.07Å
332	L	91.7	Very high	90.8	Very high	80 Å²	80	60.2 Å²	60.2	42%	0.419	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-35.4	176.8	-176	59.7	0	0	0	112.5	A227 A230 C328 E329 L334 A335	A227-L332 HydrophobicContact CB-CD2 4.24Å; A230-L332 HydrophobicContact CB-CD1 3.94Å; A230-L332 HydrophobicContact CB-CD2 4.39Å; C328-L332 WeakPolarHBondContact O-CB 3.26Å; C328-L332 PolarHBondContact O-N 3.2Å; E329-L332 PolarHBondContact O-N 2.82Å; L332-L334 VanDerWaalsContact C-N 3.27Å; L332-L334 PolarHBondContact O-N 3.19Å; L332-A335 HydrophobicContact CD1-CB 4.45Å; L332-A335 WeakPolarHBondContact O-CB 3.29Å; L332-A335 PolarHBondContact O-N 2.66Å
333	R	91.3	Very high	90.4	Very high	170 Å²	170	65 Å²	65	64%	0.642	36%	0.357	S	S	*	.	H	α-helix	trans	-67.4	-26.7	174.3	-73.4	172.3	-172.4	112.4	9.4	113.1	E329 A330 Q331	E329-R333 VanDerWaalsContact CB-NH1 3.25Å; E329-R333 VanDerWaalsContact O-CG 3.27Å; E329-R333 WeakPolarHBondContact O-CG 3.35Å; E329-R333 PolarHBondContact O-N 3.01Å; E329-R333 IonicContact OE2-CZ 2.8Å; E329-R333 IonicContact OE2-NH1 2.7Å; E329-R333 PolarHBondContact OE2-NH1 2.84Å; E329-R333 VanDerWaalsContact OE2-NH1 3.09Å; E329-R333 IonicContact OE2-NH2 3.34Å; E329-R333 PolarHBondContact OE2-NH2 2.74Å; A330-R333 PolarHBondContact O-N 3.46Å; Q331-R333 VanDerWaalsContact C-N 3.32Å; Q331-R333 PolarHBondContact O-N 3.38Å
334	L	90	Very high	90.1	Very high	63 Å²	63	69.1 Å²	69.1	33%	0.33	38%	0.378	S	S	.	.	H	α-helix	trans	-93.2	-2.2	177.8	-65.7	167.4	0	0	0	113.2	I241 A330 Q331 L332 S336 I337 L342	I241-L334 HydrophobicContact CD1-CD1 3.76Å; I241-L334 HydrophobicContact CG1-CD1 4.48Å; A330-L334 WeakPolarHBondContact O-CG 3.49Å; A330-L334 PolarHBondContact O-N 2.96Å; Q331-L334 CarbonylContact O-C 3.57Å; Q331-L334 PolarHBondContact O-N 2.94Å; Q331-L334 VanDerWaalsContact O-N 3.15Å; L332-L334 VanDerWaalsContact C-N 3.27Å; L332-L334 PolarHBondContact O-N 3.19Å; L334-S336 PolarHBondContact O-N 3.28Å; L334-I337 HydrophobicContact CD2-CD1 3.77Å; L334-I337 WeakPolarHBondContact O-CB 3.47Å; L334-I337 PolarHBondContact O-N 2.87Å; L334-L342 HydrophobicContact CB-CD2 4.48Å
335	A	84.8	Confident	89.8	Confident	73 Å²	73	70.8 Å²	70.8	60%	0.603	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-7.3	-175.2	0	0	0	0	0	115.4	Q331 L332	Q331-A335 PolarHBondContact O-N 2.98Å; Q331-A335 VanDerWaalsContact O-N 3.07Å; L332-A335 HydrophobicContact CD1-CB 4.45Å; L332-A335 WeakPolarHBondContact O-CB 3.29Å; L332-A335 PolarHBondContact O-N 2.66Å
336	S	87.1	Confident	89.7	Confident	114 Å²	114	75 Å²	75	80%	0.797	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-8.7	171.2	59.9	0	0	0	0	113.9	L334	L334-S336 PolarHBondContact O-N 3.28Å
337	I	88.3	Confident	89.5	Confident	63 Å²	63	79.6 Å²	79.6	32%	0.323	43%	0.432	S	S	.	.	S	Bend	trans	-99	142.5	-178.1	-58.7	177.1	0	0	0	108.4	L334 E341 L342	L334-I337 HydrophobicContact CD2-CD1 3.77Å; L334-I337 WeakPolarHBondContact O-CB 3.47Å; L334-I337 PolarHBondContact O-N 2.87Å; I337-E341 HydrophobicContact CG2-CB 3.54Å; I337-E341 HydrophobicContact CG2-CG 4.48Å; I337-L342 HydrophobicContact CB-CD2 4.39Å; I337-L342 HydrophobicContact CG2-CD2 4.03Å; I337-L342 HydrophobicContact CG2-CG 4.49Å
338	S	85.8	Confident	89.2	Confident	47 Å²	47	87.1 Å²	87.1	33%	0.329	47%	0.467	S	S	.	.			trans	-67.3	150.8	176.6	72.5	0	0	0	0	111.1	D340 E341	S338-D340 PolarHBondContact O-N 3.25Å; S338-E341 WeakPolarHBondContact CB-OE1 3.25Å; S338-E341 PolarHBondContact O-N 3Å; S338-E341 VanDerWaalsContact O-N 3.16Å; S338-E341 VanDerWaalsContact OG-CD 3.26Å; S338-E341 VanDerWaalsContact OG-CG 3.32Å; S338-E341 WeakPolarHBondContact OG-CG 3.48Å; S338-E341 PolarHBondContact OG-N 2.81Å; S338-E341 PolarHBondContact OG-OE1 3.32Å
339	L	84.6	Confident	88.9	Confident	111 Å²	111	89 Å²	89	58%	0.581	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-62.2	-28.2	179.2	-67.5	179.1	0	0	0	112.4	L239 E341 L342	L239-L339 HydrophobicContact CD1-CD2 3.75Å; L339-E341 VanDerWaalsContact C-N 3.31Å; L339-E341 PolarHBondContact O-N 3.4Å; L339-L342 HydrophobicContact CD2-CD1 3.91Å; L339-L342 PolarHBondContact O-N 2.85Å
340	D	85.3	Confident	88.6	Confident	161 Å²	161	88.9 Å²	88.9	86%	0.861	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-73.9	-20.8	-179.7	-54.5	-42	0	0	0	112.8	S338	S338-D340 PolarHBondContact O-N 3.25Å
341	E	87.5	Confident	88.4	Confident	139 Å²	139	93.8 Å²	93.8	65%	0.65	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-85.9	-9.9	173.6	-75.5	164.4	-112.8	0	0	113.1	I337 S338 L339	I337-E341 HydrophobicContact CG2-CB 3.54Å; I337-E341 HydrophobicContact CG2-CG 4.48Å; S338-E341 WeakPolarHBondContact CB-OE1 3.25Å; S338-E341 PolarHBondContact O-N 3Å; S338-E341 VanDerWaalsContact O-N 3.16Å; S338-E341 VanDerWaalsContact OG-CD 3.26Å; S338-E341 VanDerWaalsContact OG-CG 3.32Å; S338-E341 WeakPolarHBondContact OG-CG 3.48Å; S338-E341 PolarHBondContact OG-N 2.81Å; S338-E341 PolarHBondContact OG-OE1 3.32Å; L339-E341 VanDerWaalsContact C-N 3.31Å; L339-E341 PolarHBondContact O-N 3.4Å
342	L	87.4	Confident	88	Confident	32 Å²	32	95.3 Å²	95.3	17%	0.168	52%	0.516	C	S	.	.	S	Bend	trans	-83.8	121.5	-178.5	-63.7	178.1	0	0	0	111.6	I241 L334 I337 L339 I344	I241-L342 HydrophobicContact CG2-CD1 4.4Å; L334-L342 HydrophobicContact CB-CD2 4.48Å; I337-L342 HydrophobicContact CB-CD2 4.39Å; I337-L342 HydrophobicContact CG2-CD2 4.03Å; I337-L342 HydrophobicContact CG2-CG 4.49Å; L339-L342 HydrophobicContact CD2-CD1 3.91Å; L339-L342 PolarHBondContact O-N 2.85Å; L342-I344 PolarHBondContact O-N 3.44Å; L342-I344 VanDerWaalsContact O-N 3.09Å
343	V	87.3	Confident	87.8	Confident	137 Å²	137	92.3 Å²	92.3	83%	0.83	50%	0.504	S	S	*	.			trans	-73.8	101.2	171.5	-177.9	0	0	0	0	109.4
344	I	88.7	Confident	87.5	Confident	96 Å²	96	85.7 Å²	85.7	49%	0.492	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-84.5	124.6	175.4	-57.7	178	0	0	0	109.3	P240 L342	P240-I344 HydrophobicContact CG-CG2 4.21Å; L342-I344 PolarHBondContact O-N 3.44Å; L342-I344 VanDerWaalsContact O-N 3.09Å
345	P	88.6	Confident	87.2	Confident	36 Å²	36	85.9 Å²	85.9	23%	0.234	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-59.2	152.8	176.4	-25.5	36.2	0	0	0	113.3	P240 M246 A349 Q350	P240-P345 WeakPolarHBondContact O-CD 3.23Å; M246-P345 HydrophobicContact CE-CG 4.24Å; M246-P345 HydrophobicContact SD-CB 3.73Å; M246-P345 HydrophobicContact SD-CG 3.66Å; P345-A349 HydrophobicContact CB-CB 4.29Å; P345-Q350 HydrophobicContact CB-CG 4.34Å; P345-Q350 PolarHBondContact O-NE2 2.92Å
346	T	91.6	Very high	87	Confident	92 Å²	92	85.2 Å²	85.2	56%	0.564	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-61	153	175.6	61.8	0	0	0	0	111.4	E348 A349 Q350	T346-E348 VanDerWaalsContact C-N 3.25Å; T346-E348 PolarHBondContact O-N 3.44Å; T346-A349 WeakPolarHBondContact O-CB 3.45Å; T346-A349 PolarHBondContact O-N 3.09Å; T346-A349 WeakPolarHBondContact OG1-CB 3.5Å; T346-A349 PolarHBondContact OG1-N 3.5Å; T346-Q350 WeakPolarHBondContact O-CG 3.17Å; T346-Q350 PolarHBondContact O-N 2.86Å
347	K	89.8	Confident	86.5	Confident	156 Å²	156	80 Å²	80	68%	0.678	44%	0.438	S	S	*	.	H	α-helix	trans	-56.6	-40.7	178.5	-70.3	-171	175.9	-173.5	0	112.3	A349 Q350 E351	K347-A349 VanDerWaalsContact C-N 3.32Å; K347-A349 PolarHBondContact O-N 2.93Å; K347-Q350 WeakPolarHBondContact O-CB 3.19Å; K347-Q350 PolarHBondContact O-N 2.89Å; K347-Q350 VanDerWaalsContact O-N 3.13Å; K347-E351 WeakPolarHBondContact O-CB 3.35Å; K347-E351 WeakPolarHBondContact O-CG 3.18Å; K347-E351 PolarHBondContact O-N 3.39Å
348	E	88.8	Confident	85.9	Confident	158 Å²	158	80.8 Å²	80.8	74%	0.738	44%	0.437	S	S	*	.	H	α-helix	trans	-56.8	-43.3	174.4	-64.4	169.9	-179.2	0	0	112.3	T346 E351 A352	T346-E348 VanDerWaalsContact C-N 3.25Å; T346-E348 PolarHBondContact O-N 3.44Å; E348-E351 PolarHBondContact O-N 3.46Å; E348-A352 WeakPolarHBondContact O-CB 3.33Å; E348-A352 PolarHBondContact O-N 3.42Å
349	A	87.9	Confident	85	Confident	42 Å²	42	82.6 Å²	82.6	35%	0.347	45%	0.446	S	S	.	.	H	α-helix	trans	-67.4	-37.5	176.4	0	0	0	0	0	112.3	P345 T346 K347 A353	P345-A349 HydrophobicContact CB-CB 4.29Å; T346-A349 WeakPolarHBondContact O-CB 3.45Å; T346-A349 PolarHBondContact O-N 3.09Å; T346-A349 WeakPolarHBondContact OG1-CB 3.5Å; T346-A349 PolarHBondContact OG1-N 3.5Å; K347-A349 VanDerWaalsContact C-N 3.32Å; K347-A349 PolarHBondContact O-N 2.93Å; A349-A353 VanDerWaalsContact O-CB 3.28Å; A349-A353 WeakPolarHBondContact O-CB 3.33Å; A349-A353 PolarHBondContact O-N 3.33Å
350	Q	89.1	Confident	83.9	Confident	52 Å²	52	81.1 Å²	81.1	24%	0.243	44%	0.443	C	S	.	.	H	α-helix	trans	-64.5	-46.7	174.7	-61.1	174.6	32	0	0	111.1	P240 M246 P345 T346 K347 A353 H354	P240-Q350 HydrophobicContact CB-CG 4.1Å; M246-Q350 HydrophobicContact CG-CG 4.17Å; M246-Q350 HydrophobicContact SD-CG 4.13Å; P345-Q350 HydrophobicContact CB-CG 4.34Å; P345-Q350 PolarHBondContact O-NE2 2.92Å; T346-Q350 WeakPolarHBondContact O-CG 3.17Å; T346-Q350 PolarHBondContact O-N 2.86Å; K347-Q350 WeakPolarHBondContact O-CB 3.19Å; K347-Q350 PolarHBondContact O-N 2.89Å; K347-Q350 VanDerWaalsContact O-N 3.13Å; Q350-A353 PolarHBondContact O-N 2.87Å; Q350-H354 WeakPolarHBondContact O-CB 3.43Å; Q350-H354 PolarHBondContact O-N 3.16Å
351	E	86.5	Confident	82.6	Confident	129 Å²	129	74.5 Å²	74.5	60%	0.603	41%	0.41	S	S	*	.	H	α-helix	trans	-66.1	-40.8	178.3	-72.2	172.6	-156.4	0	0	112.1	K347 E348 H354 S355	K347-E351 WeakPolarHBondContact O-CB 3.35Å; K347-E351 WeakPolarHBondContact O-CG 3.18Å; K347-E351 PolarHBondContact O-N 3.39Å; E348-E351 PolarHBondContact O-N 3.46Å; E351-H354 PolarHBondContact O-N 3.13Å; E351-S355 WeakPolarHBondContact O-CB 3.37Å; E351-S355 PolarHBondContact O-N 2.99Å
352	A	86.9	Confident	80.8	Confident	50 Å²	50	70.8 Å²	70.8	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-62	-49	173.9	0	0	0	0	0	111.4	E348 H354 S355 V356	E348-A352 WeakPolarHBondContact O-CB 3.33Å; E348-A352 PolarHBondContact O-N 3.42Å; A352-H354 PolarHBondContact O-N 3.46Å; A352-S355 PolarHBondContact O-N 2.84Å; A352-S355 PolarHBondContact O-OG 3.19Å; A352-V356 WeakPolarHBondContact O-CG2 3.39Å; A352-V356 PolarHBondContact O-N 3.39Å
353	A	86.5	Confident	79.2	Confident	18 Å²	18	72.5 Å²	72.5	15%	0.149	41%	0.414	C	S	.	.	H	α-helix	trans	-63.7	-38.5	177.1	0	0	0	0	0	112.6	M246 A349 Q350 G357	M246-A353 HydrophobicContact CB-CB 3.65Å; M246-A353 HydrophobicContact SD-CB 4.47Å; A349-A353 VanDerWaalsContact O-CB 3.28Å; A349-A353 WeakPolarHBondContact O-CB 3.33Å; A349-A353 PolarHBondContact O-N 3.33Å; Q350-A353 PolarHBondContact O-N 2.87Å; A353-G357 PolarHBondContact O-N 2.81Å
354	H	85.3	Confident	77.4	Confident	31 Å²	31	70.9 Å²	70.9	14%	0.144	40%	0.398	C	S	.	.	H	α-helix	trans	-65.5	-37.3	174.6	179.8	-134	0	0	0	112.4	M246 S296 Q350 E351 A352 R358	M246-H354 WeakPolarHBondContact O-CA 3.21Å; M246-H354 WeakPolarHBondContact O-CB 3.48Å; M246-H354 PolarHBondContact O-N 2.96Å; S296-H354 PolarHBondContact OG-CE1 3.48Å; Q350-H354 WeakPolarHBondContact O-CB 3.43Å; Q350-H354 PolarHBondContact O-N 3.16Å; E351-H354 PolarHBondContact O-N 3.13Å; A352-H354 PolarHBondContact O-N 3.46Å; H354-R358 PolarHBondContact CE1-NH1 2.89Å; H354-R358 PolarHBondContact NE2-NH1 2.93Å; H354-R358 PolarHBondContact O-N 3.46Å
355	S	83.6	Confident	75.9	Confident	66 Å²	66	69.4 Å²	69.4	46%	0.462	39%	0.391	S	S	.	.	H	α-helix	trans	-69.1	-46.2	176.1	76	0	0	0	0	111.9	E351 A352 G357 R358 T359	E351-S355 WeakPolarHBondContact O-CB 3.37Å; E351-S355 PolarHBondContact O-N 2.99Å; A352-S355 PolarHBondContact O-N 2.84Å; A352-S355 PolarHBondContact O-OG 3.19Å; S355-G357 VanDerWaalsContact C-N 3.31Å; S355-G357 PolarHBondContact O-N 3.19Å; S355-R358 WeakPolarHBondContact O-CA 3.32Å; S355-R358 WeakPolarHBondContact O-CB 3.2Å; S355-R358 PolarHBondContact O-N 3.44Å; S355-T359 PolarHBondContact O-N 3.46Å
356	V	80.6	Confident	74.4	Confident	60 Å²	60	75.3 Å²	75.3	36%	0.364	41%	0.408	S	S	.	.	H	α-helix	trans	-59	-43.3	172.7	171.8	0	0	0	0	111	A352 R358 T359 F464	A352-V356 WeakPolarHBondContact O-CG2 3.39Å; A352-V356 PolarHBondContact O-N 3.39Å; V356-R358 PolarHBondContact O-N 3.04Å; V356-R358 VanDerWaalsContact O-N 3.15Å; V356-T359 PolarHBondContact O-N 2.91Å; V356-T359 PolarHBondContact O-OG1 2.89Å; V356-F464 HydrophobicContact CG1-CD1 3.99Å; V356-F464 HydrophobicContact CG1-CE1 4.17Å
357	G	76	Confident	72.5	Confident	3 Å²	3	78.4 Å²	78.4	3%	0.031	43%	0.427	C	S	.	.	H	α-helix	trans	-60.8	-21.2	175.4	0	0	0	0	0	114	A353 S355 R378	A353-G357 PolarHBondContact O-N 2.81Å; S355-G357 VanDerWaalsContact C-N 3.31Å; S355-G357 PolarHBondContact O-N 3.19Å; G357-R378 VanDerWaalsContact O-CZ 3.26Å; G357-R378 PolarHBondContact O-NE 3.48Å; G357-R378 PolarHBondContact O-NH2 3.42Å; G357-R378 VanDerWaalsContact O-NH2 3.12Å
358	R	75.6	Confident	70.6	Confident	81 Å²	81	74.3 Å²	74.3	31%	0.306	43%	0.429	S	S	.	.	H	α-helix	trans	-93.3	-33.1	177.3	-118.7	-167.8	-172.2	71.2	21.8	114.4	S296 H354 S355 V356	S296-R358 VanDerWaalsContact CA-NH2 3.29Å; S296-R358 VanDerWaalsContact CB-CZ 3.47Å; S296-R358 PolarHBondContact O-NH2 2.85Å; H354-R358 PolarHBondContact CE1-NH1 2.89Å; H354-R358 PolarHBondContact NE2-NH1 2.93Å; H354-R358 PolarHBondContact O-N 3.46Å; S355-R358 WeakPolarHBondContact O-CA 3.32Å; S355-R358 WeakPolarHBondContact O-CB 3.2Å; S355-R358 PolarHBondContact O-N 3.44Å; V356-R358 PolarHBondContact O-N 3.04Å; V356-R358 VanDerWaalsContact O-N 3.15Å
359	T	68.5	Low	68.9	Low	84 Å²	84	69.6 Å²	69.6	52%	0.515	41%	0.407	S	S	.	.	S	Bend	trans	-60.7	140.5	-177.2	45.1	0	0	0	0	110.6	S355 V356 S361	S355-T359 PolarHBondContact O-N 3.46Å; V356-T359 PolarHBondContact O-N 2.91Å; V356-T359 PolarHBondContact O-OG1 2.89Å; T359-S361 PolarHBondContact O-N 2.66Å
360	P	61.5	Low	66.9	Low	80 Å²	80	72.8 Å²	72.8	52%	0.519	42%	0.422	S	S	.	.			trans	-56.1	135.9	170.5	25.7	-34.2	0	0	0	109.1	A362 W376	P360-A362 PolarHBondContact O-N 2.81Å; P360-W376 WeakPolarHBondContact CB-O 3.31Å
361	S	57.3	Low	64.8	Low	22 Å²	22	75.1 Å²	75.1	15%	0.154	44%	0.439	C	S	.	.			trans	-62.6	98.8	-173.6	-165.1	0	0	0	0	110.5	T359 V363 S374	T359-S361 PolarHBondContact O-N 2.66Å; S361-V363 PolarHBondContact O-N 2.79Å; S361-V363 WeakPolarHBondContact OG-CG2 3.41Å; S361-S374 PolarHBondContact O-OG 3.49Å
362	A	49.4	Very low	63	Low	61 Å²	61	71.6 Å²	71.6	50%	0.504	44%	0.438	S	S	.	.			trans	-78.4	37.4	-174.6	0	0	0	0	0	112.5	P360	P360-A362 PolarHBondContact O-N 2.81Å
363	V	53.1	Low	61.1	Low	68 Å²	68	73.2 Å²	73.2	41%	0.412	45%	0.446	S	S	.	.			trans	-73.2	127	178.3	177.2	0	0	0	0	109.3	S361 L365	S361-V363 PolarHBondContact O-N 2.79Å; S361-V363 WeakPolarHBondContact OG-CG2 3.41Å; V363-L365 HydrophobicContact CB-CD2 4.47Å; V363-L365 HydrophobicContact CB-CG 4.48Å; V363-L365 HydrophobicContact CG1-CD2 3.76Å; V363-L365 HydrophobicContact CG1-CG 4.09Å; V363-L365 PolarHBondContact O-N 2.91Å; V363-L365 VanDerWaalsContact O-N 3.16Å
364	Q	51.2	Low	59.7	Low	104 Å²	104	73.3 Å²	73.3	49%	0.486	45%	0.446	S	S	.	.			trans	-73.5	98.9	168.7	-176.5	174.6	40.5	0	0	108.6	R366 E369 T371	Q364-R366 WeakPolarHBondContact CG-O 3.47Å; Q364-E369 WeakPolarHBondContact CG-O 3.31Å; Q364-E369 PolarHBondContact NE2-O 2.89Å; Q364-T371 HydrophobicContact CB-CG2 4.33Å
365	L	57	Low	59	Low	64 Å²	64	74.4 Å²	74.4	34%	0.335	47%	0.465	S	S	.	.			trans	-86.6	-14.6	-175.4	-69.1	167.6	0	0	0	113.2	V363 W376 L381 L403	V363-L365 HydrophobicContact CB-CD2 4.47Å; V363-L365 HydrophobicContact CB-CG 4.48Å; V363-L365 HydrophobicContact CG1-CD2 3.76Å; V363-L365 HydrophobicContact CG1-CG 4.09Å; V363-L365 PolarHBondContact O-N 2.91Å; V363-L365 VanDerWaalsContact O-N 3.16Å; L365-W376 HydrophobicContact CD1-CZ2 4.26Å; L365-W376 VanDerWaalsContact CD1-NE1 3.35Å; L365-L381 HydrophobicContact CD1-CD1 3.81Å; L365-L381 HydrophobicContact CD1-CD2 4.26Å; L365-L381 HydrophobicContact CD2-CD1 4.38Å; L365-L381 HydrophobicContact CD2-CD2 4.28Å; L365-L403 HydrophobicContact CD1-CD1 4.27Å; L365-L403 HydrophobicContact CD1-CD2 4.33Å
366	R	56.3	Low	58.9	Low	160 Å²	160	71.8 Å²	71.8	60%	0.604	45%	0.445	S	S	*	.	S	Bend	trans	-134.4	140.8	174.7	-60.3	-172.2	-177.4	-143.1	2.1	110.6	Q364 G368 E369	Q364-R366 WeakPolarHBondContact CG-O 3.47Å; R366-G368 PolarHBondContact O-N 2.89Å; R366-E369 HydrophobicContact CB-CB 4.36Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 3.44Å
367	V	51.5	Low	59.1	Low	158 Å²	158	76.6 Å²	76.6	96%	0.958	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	119.9	169.9	-177.6	0	0	0	0	108.8
368	G	50.2	Low	59.5	Low	70 Å²	70	77.4 Å²	77.4	72%	0.722	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.8	-3.5	-178.1	0	0	0	0	0	116	R366	R366-G368 PolarHBondContact O-N 2.89Å
369	E	53.6	Low	60	Low	59 Å²	59	73.6 Å²	73.6	28%	0.276	45%	0.445	S	S	.	.			trans	-80	129.3	171.6	-167.4	170.9	-161.4	0	0	109.9	Q364 R366 T371	Q364-E369 WeakPolarHBondContact CG-O 3.31Å; Q364-E369 PolarHBondContact NE2-O 2.89Å; R366-E369 HydrophobicContact CB-CB 4.36Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 3.44Å; E369-T371 PolarHBondContact O-N 3.42Å
370	V	44.9	Very low	61	Low	109 Å²	109	70.4 Å²	70.4	66%	0.661	43%	0.425	S	S	*	.			trans	-67.4	129.8	-178.3	-175	0	0	0	0	109.8	G372 S373	V370-G372 PolarHBondContact O-N 3.33Å; V370-G372 VanDerWaalsContact O-N 3.08Å; V370-S373 WeakPolarHBondContact O-CB 3.28Å; V370-S373 PolarHBondContact O-N 2.98Å
371	T	46	Very low	62.2	Low	100 Å²	100	67.6 Å²	67.6	61%	0.613	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	113.6	175	45.3	0	0	0	0	110.4	Q364 E369	Q364-T371 HydrophobicContact CB-CG2 4.33Å; E369-T371 PolarHBondContact O-N 3.42Å
372	G	48.5	Very low	63.7	Low	55 Å²	55	68.4 Å²	68.4	57%	0.567	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.1	-13.7	-175.4	0	0	0	0	0	115.7	V370 S374	V370-G372 PolarHBondContact O-N 3.33Å; V370-G372 VanDerWaalsContact O-N 3.08Å; G372-S374 PolarHBondContact O-N 2.9Å
373	S	47	Very low	65.8	Low	85 Å²	85	65.5 Å²	65.5	59%	0.594	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.3	-178.9	-167.4	0	0	0	0	115.1	V370 G375	V370-S373 WeakPolarHBondContact O-CB 3.28Å; V370-S373 PolarHBondContact O-N 2.98Å; S373-G375 VanDerWaalsContact C-N 3.29Å; S373-G375 PolarHBondContact O-N 3.36Å
374	S	57.3	Low	67.6	Low	19 Å²	19	62.2 Å²	62.2	13%	0.133	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.9	-164.6	62.4	0	0	0	0	115.3	S361 G372 W376	S361-S374 PolarHBondContact O-OG 3.49Å; G372-S374 PolarHBondContact O-N 2.9Å; S374-W376 PolarHBondContact O-N 3.16Å; S374-W376 PolarHBondContact O-NE1 2.92Å
375	G	70.7	Confident	69.4	Low	54 Å²	54	57.5 Å²	57.5	56%	0.557	34%	0.341	S	S	*	.			trans	65.6	11.4	166	0	0	0	0	0	116.8	S373 R402	S373-G375 VanDerWaalsContact C-N 3.29Å; S373-G375 PolarHBondContact O-N 3.36Å; G375-R402 PolarHBondContact O-NH1 3.35Å
376	W	80.6	Confident	71.1	Confident	11 Å²	11	54.5 Å²	54.5	4%	0.042	33%	0.325	C	S	.	.			trans	-75.5	136.5	174.3	-60.7	96.7	0	0	0	110.9	P360 L365 S374 E380 L381 E384 R402 L403	P360-W376 WeakPolarHBondContact CB-O 3.31Å; L365-W376 HydrophobicContact CD1-CZ2 4.26Å; L365-W376 VanDerWaalsContact CD1-NE1 3.35Å; S374-W376 PolarHBondContact O-N 3.16Å; S374-W376 PolarHBondContact O-NE1 2.92Å; W376-E380 HydrophobicContact CE3-CB 3.73Å; W376-E380 HydrophobicContact CZ3-CB 4.39Å; W376-L381 HydrophobicContact CD2-CB 4.01Å; W376-L381 HydrophobicContact CD2-CD1 4.22Å; W376-L381 HydrophobicContact CE3-CB 4.01Å; W376-L381 HydrophobicContact CE3-CD1 4.48Å; W376-L381 HydrophobicContact CG-CB 4.25Å; W376-L381 HydrophobicContact CH2-CD1 4.16Å; W376-L381 HydrophobicContact CZ2-CD1 3.92Å; W376-L381 HydrophobicContact CZ3-CD1 4.44Å; W376-E384 WeakPolarHBondContact CH2-OE2 3.36Å; W376-E384 HydrophobicContact CZ3-CB 4.28Å; W376-R402 HydrophobicContact CH2-CB 3.73Å; W376-R402 HydrophobicContact CH2-CG 4.16Å; W376-R402 HydrophobicContact CZ2-CB 4.13Å; W376-R402 HydrophobicContact CZ3-CB 4.44Å; W376-R402 HydrophobicContact CZ3-CG 4.4Å; W376-L403 HydrophobicContact CH2-CD1 4.27Å; W376-L403 HydrophobicContact CH2-CG 4.05Å; W376-L403 HydrophobicContact CZ2-CD1 3.98Å; W376-L403 HydrophobicContact CZ2-CD2 4.11Å; W376-L403 HydrophobicContact CZ2-CG 3.75Å
377	R	84.2	Confident	72.9	Confident	161 Å²	161	46.9 Å²	46.9	61%	0.608	30%	0.297	S	S	*	.			trans	-85.5	165.6	166	-54.5	177.9	-179.6	-85.6	-8.9	110.1	G379 E380	R377-G379 PolarHBondContact O-N 3.02Å; R377-E380 HydrophobicContact CB-CG 3.87Å; R377-E380 PolarHBondContact N-OE2 3.1Å; R377-E380 WeakPolarHBondContact O-CB 3.35Å; R377-E380 PolarHBondContact O-N 3.33Å
378	R	84.8	Confident	74.7	Confident	20 Å²	20	42.1 Å²	42.1	8%	0.075	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	120.1	174.7	-168.8	-178.3	-163.6	-168.8	7.9	111	I247 E316 F319 G357 E380	I247-R378 PolarHBondContact O-NH2 2.98Å; E316-R378 IonicContact OE1-NH1 2.86Å; F319-R378 HydrophobicContact CD1-CG 4.11Å; F319-R378 HydrophobicContact CE1-CG 4.28Å; G357-R378 VanDerWaalsContact O-CZ 3.26Å; G357-R378 PolarHBondContact O-NE 3.48Å; G357-R378 PolarHBondContact O-NH2 3.42Å; G357-R378 VanDerWaalsContact O-NH2 3.12Å; R378-E380 VanDerWaalsContact C-N 3.33Å; R378-E380 PolarHBondContact O-N 3.07Å
379	G	85.9	Confident	76.4	Confident	2 Å²	2	44.8 Å²	44.8	2%	0.021	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-10.4	179	0	0	0	0	0	116.9	R377 L381 E382 F383	R377-G379 PolarHBondContact O-N 3.02Å; G379-L381 PolarHBondContact O-N 2.83Å; G379-E382 WeakPolarHBondContact CA-OE2 3.24Å; G379-F383 WeakPolarHBondContact O-CB 3.39Å; G379-F383 PolarHBondContact O-N 3.35Å
380	E	89.6	Confident	78.2	Confident	17 Å²	17	42.1 Å²	42.1	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-35.9	-174.9	-72.9	-175.6	156.5	0	0	112.9	E315 W376 R377 R378 E384 R402	E315-E380 HydrophobicContact CB-CG 4.1Å; E315-E380 HydrophobicContact CG-CG 4.24Å; W376-E380 HydrophobicContact CE3-CB 3.73Å; W376-E380 HydrophobicContact CZ3-CB 4.39Å; R377-E380 HydrophobicContact CB-CG 3.87Å; R377-E380 PolarHBondContact N-OE2 3.1Å; R377-E380 WeakPolarHBondContact O-CB 3.35Å; R377-E380 PolarHBondContact O-N 3.33Å; R378-E380 VanDerWaalsContact C-N 3.33Å; R378-E380 PolarHBondContact O-N 3.07Å; E380-E384 WeakPolarHBondContact O-CB 3.48Å; E380-E384 PolarHBondContact O-N 2.75Å; E380-R402 IonicContact OE1-NH2 2.88Å; E380-R402 PolarHBondContact OE1-NH2 2.97Å; E380-R402 IonicContact OE2-CZ 2.76Å; E380-R402 VanDerWaalsContact OE2-CZ 3.31Å; E380-R402 IonicContact OE2-NH1 3.28Å; E380-R402 PolarHBondContact OE2-NH1 3.43Å; E380-R402 IonicContact OE2-NH2 3.94Å; E380-R402 PolarHBondContact OE2-NH2 2.75Å
381	L	87.3	Confident	80.3	Confident	21 Å²	21	39.3 Å²	39.3	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-72.9	-43.9	-177.6	178.3	61.9	0	0	0	111.4	L365 W376 G379 E384 A385 L403	L365-L381 HydrophobicContact CD1-CD1 3.81Å; L365-L381 HydrophobicContact CD1-CD2 4.26Å; L365-L381 HydrophobicContact CD2-CD1 4.38Å; L365-L381 HydrophobicContact CD2-CD2 4.28Å; W376-L381 HydrophobicContact CD2-CB 4.01Å; W376-L381 HydrophobicContact CD2-CD1 4.22Å; W376-L381 HydrophobicContact CE3-CB 4.01Å; W376-L381 HydrophobicContact CE3-CD1 4.48Å; W376-L381 HydrophobicContact CG-CB 4.25Å; W376-L381 HydrophobicContact CH2-CD1 4.16Å; W376-L381 HydrophobicContact CZ2-CD1 3.92Å; W376-L381 HydrophobicContact CZ3-CD1 4.44Å; G379-L381 PolarHBondContact O-N 2.83Å; L381-E384 PolarHBondContact O-N 3.18Å; L381-A385 PolarHBondContact O-N 3.02Å; L381-A385 VanDerWaalsContact O-N 3.1Å; L381-L403 HydrophobicContact CD1-CD1 3.94Å
382	E	88.7	Confident	82.1	Confident	38 Å²	38	39.8 Å²	39.8	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-42.2	175.8	-59.2	82.2	174.9	0	0	110.5	G379 A385 L386	G379-E382 WeakPolarHBondContact CA-OE2 3.24Å; E382-A385 WeakPolarHBondContact O-CB 3.4Å; E382-A385 PolarHBondContact O-N 3.33Å; E382-L386 WeakPolarHBondContact O-CG 3.33Å; E382-L386 PolarHBondContact O-N 3.27Å; E382-L386 VanDerWaalsContact O-N 3.09Å
383	F	93.1	Very high	83.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-46.4	175.8	-166.5	-89.8	0	0	0	111.4	K131 V135 I314 E315 W318 G379 A385 L386 M387 Y399	K131-F383 HydrophobicContact CB-CZ 4.4Å; K131-F383 HydrophobicContact CG-CE1 4.22Å; V135-F383 HydrophobicContact CG2-CE2 3.67Å; V135-F383 HydrophobicContact CG2-CZ 4.12Å; I314-F383 HydrophobicContact CG2-CE2 4.31Å; I314-F383 HydrophobicContact CG2-CZ 4.34Å; E315-F383 HydrophobicContact CB-CB 4.02Å; E315-F383 HydrophobicContact CB-CD2 4.44Å; E315-F383 HydrophobicContact CB-CG 4.17Å; E315-F383 HydrophobicContact CG-CB 3.77Å; E315-F383 HydrophobicContact CG-CD1 3.71Å; E315-F383 HydrophobicContact CG-CD2 4.17Å; E315-F383 HydrophobicContact CG-CE1 4.33Å; E315-F383 HydrophobicContact CG-CG 3.61Å; W318-F383 HydrophobicContact CB-CD2 4.01Å; W318-F383 HydrophobicContact CB-CE2 4.21Å; W318-F383 AromaticContact CD1-CD2 3.99Å; W318-F383 HydrophobicContact CG-CD2 4.01Å; W318-F383 HydrophobicContact CG-CE2 4.31Å; G379-F383 WeakPolarHBondContact O-CB 3.39Å; G379-F383 PolarHBondContact O-N 3.35Å; F383-A385 VanDerWaalsContact C-N 3.28Å; F383-A385 PolarHBondContact O-N 2.97Å; F383-L386 WeakPolarHBondContact O-CB 3.48Å; F383-L386 PolarHBondContact O-N 2.79Å; F383-M387 HydrophobicContact CD1-CE 4Å; F383-M387 HydrophobicContact CD1-CG 3.82Å; F383-M387 HydrophobicContact CD1-SD 4.17Å; F383-M387 HydrophobicContact CD2-CE 4.41Å; F383-M387 HydrophobicContact CE1-CE 3.52Å; F383-M387 HydrophobicContact CE1-CG 3.71Å; F383-M387 HydrophobicContact CE1-SD 3.48Å; F383-M387 WeakPolarHBondContact CE1-SD 3.22Å; F383-M387 HydrophobicContact CE2-CE 3.98Å; F383-M387 HydrophobicContact CG-CE 4.43Å; F383-M387 HydrophobicContact CZ-CE 3.51Å; F383-M387 HydrophobicContact CZ-SD 3.92Å; F383-M387 WeakPolarHBondContact O-CG 3.26Å; F383-M387 PolarHBondContact O-N 2.98Å; F383-Y399 HydrophobicContact CD1-CD2 4.38Å; F383-Y399 AromaticContact CD1-CE2 3.63Å; F383-Y399 HydrophobicContact CD1-CE2 3.63Å; F383-Y399 HydrophobicContact CE1-CD2 4.01Å; F383-Y399 AromaticContact CE1-CE2 3.59Å; F383-Y399 HydrophobicContact CE1-CE2 3.59Å
384	E	91.7	Very high	85.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-37.1	176.9	-169.1	-179.6	105.4	0	0	112.2	W376 E380 L381 L386 M387 R388 Y399 Y401 R402 L403	W376-E384 WeakPolarHBondContact CH2-OE2 3.36Å; W376-E384 HydrophobicContact CZ3-CB 4.28Å; E380-E384 WeakPolarHBondContact O-CB 3.48Å; E380-E384 PolarHBondContact O-N 2.75Å; L381-E384 PolarHBondContact O-N 3.18Å; E384-L386 VanDerWaalsContact C-N 3.33Å; E384-L386 PolarHBondContact O-N 3Å; E384-M387 PolarHBondContact O-N 2.94Å; E384-R388 PolarHBondContact O-N 2.83Å; E384-R388 IonicContact OE1-NH1 3.62Å; E384-R388 PolarHBondContact OE1-NH1 3.04Å; E384-Y399 HydrophobicContact CB-CE1 4.1Å; E384-Y399 HydrophobicContact CG-CD1 4.32Å; E384-Y399 HydrophobicContact CG-CE1 3.73Å; E384-Y401 HydrophobicContact CG-CD1 3.46Å; E384-Y401 VanDerWaalsContact CG-CD1 3.46Å; E384-Y401 HydrophobicContact CG-CE1 3.91Å; E384-Y401 WeakPolarHBondContact OE2-CA 3.28Å; E384-R402 PolarHBondContact OE2-N 3.47Å; E384-L403 VanDerWaalsContact OE1-CB 3.22Å; E384-L403 WeakPolarHBondContact OE1-CB 3.43Å; E384-L403 WeakPolarHBondContact OE1-CG 3.43Å; E384-L403 PolarHBondContact OE1-N 2.91Å; E384-L403 VanDerWaalsContact OE1-N 3.1Å
385	A	89.4	Confident	87.1	Confident	4 Å²	4	37.9 Å²	37.9	3%	0.033	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-36.6	173.4	0	0	0	0	0	112.9	L381 E382 F383 R388 R389 P459	L381-A385 PolarHBondContact O-N 3.02Å; L381-A385 VanDerWaalsContact O-N 3.1Å; E382-A385 WeakPolarHBondContact O-CB 3.4Å; E382-A385 PolarHBondContact O-N 3.33Å; F383-A385 VanDerWaalsContact C-N 3.28Å; F383-A385 PolarHBondContact O-N 2.97Å; A385-R388 PolarHBondContact O-N 3.44Å; A385-R389 PolarHBondContact O-N 2.83Å; A385-P459 HydrophobicContact CB-CG 3.94Å
386	L	92.2	Very high	88	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-71.2	-34.1	174.2	-68.8	168.9	0	0	0	112.4	L138 F142 W318 E382 F383 E384 R389 L390	L138-L386 HydrophobicContact CD1-CB 4.19Å; L138-L386 HydrophobicContact CD1-CD1 4.22Å; L138-L386 HydrophobicContact CD2-CB 4.17Å; L138-L386 HydrophobicContact CD2-CD2 4.37Å; F142-L386 HydrophobicContact CZ-CD2 4.47Å; W318-L386 HydrophobicContact CZ2-CD1 4.13Å; E382-L386 WeakPolarHBondContact O-CG 3.33Å; E382-L386 PolarHBondContact O-N 3.27Å; E382-L386 VanDerWaalsContact O-N 3.09Å; F383-L386 WeakPolarHBondContact O-CB 3.48Å; F383-L386 PolarHBondContact O-N 2.79Å; E384-L386 VanDerWaalsContact C-N 3.33Å; E384-L386 PolarHBondContact O-N 3Å; L386-R389 WeakPolarHBondContact O-CB 3.27Å; L386-R389 PolarHBondContact O-N 3.03Å; L386-R389 VanDerWaalsContact O-N 3.17Å; L386-L390 PolarHBondContact O-N 3.19Å
387	M	93.4	Very high	88.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-43	172.7	-60	-59	100.6	0	0	111	S134 L138 F383 E384 R389 L390 D391 T397 Y399 Y401	S134-M387 VanDerWaalsContact CB-SD 3.58Å; L138-M387 HydrophobicContact CD1-CE 3.79Å; F383-M387 HydrophobicContact CD1-CE 4Å; F383-M387 HydrophobicContact CD1-CG 3.82Å; F383-M387 HydrophobicContact CD1-SD 4.17Å; F383-M387 HydrophobicContact CD2-CE 4.41Å; F383-M387 HydrophobicContact CE1-CE 3.52Å; F383-M387 HydrophobicContact CE1-CG 3.71Å; F383-M387 HydrophobicContact CE1-SD 3.48Å; F383-M387 WeakPolarHBondContact CE1-SD 3.22Å; F383-M387 HydrophobicContact CE2-CE 3.98Å; F383-M387 HydrophobicContact CG-CE 4.43Å; F383-M387 HydrophobicContact CZ-CE 3.51Å; F383-M387 HydrophobicContact CZ-SD 3.92Å; F383-M387 WeakPolarHBondContact O-CG 3.26Å; F383-M387 PolarHBondContact O-N 2.98Å; E384-M387 PolarHBondContact O-N 2.94Å; M387-R389 PolarHBondContact O-N 3.47Å; M387-L390 HydrophobicContact CE-CD1 3.73Å; M387-L390 PolarHBondContact O-N 3.43Å; M387-L390 VanDerWaalsContact O-N 3.1Å; M387-L390 HydrophobicContact SD-CD1 4.24Å; M387-D391 PolarHBondContact O-N 3.02Å; M387-T397 HydrophobicContact SD-CG2 3.9Å; M387-Y399 HydrophobicContact CB-CD1 4.17Å; M387-Y399 HydrophobicContact CB-CD2 4.41Å; M387-Y399 HydrophobicContact CB-CG 3.94Å; M387-Y399 HydrophobicContact CG-CD1 4.06Å; M387-Y399 HydrophobicContact CG-CD2 3.52Å; M387-Y399 HydrophobicContact CG-CE1 4.48Å; M387-Y399 HydrophobicContact CG-CE2 3.95Å; M387-Y399 HydrophobicContact CG-CG 3.56Å; M387-Y399 HydrophobicContact SD-CD2 4.04Å; M387-Y399 HydrophobicContact SD-CG 4.39Å; M387-Y401 HydrophobicContact CB-CE1 3.9Å; M387-Y401 WeakPolarHBondContact CB-OH 3.39Å; M387-Y401 PolarHBondContact O-OH 2.86Å; M387-Y401 VanDerWaalsContact O-OH 3.11Å
388	R	89.1	Confident	88.5	Confident	59 Å²	59	34.2 Å²	34.2	22%	0.223	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-38.4	173	-70.5	-169.8	-73.6	-88.2	1.4	112	E384 A385 S392 Y401	E384-R388 PolarHBondContact O-N 2.83Å; E384-R388 IonicContact OE1-NH1 3.62Å; E384-R388 PolarHBondContact OE1-NH1 3.04Å; A385-R388 PolarHBondContact O-N 3.44Å; R388-S392 VanDerWaalsContact O-CB 3.25Å; R388-S392 WeakPolarHBondContact O-CB 3.46Å; R388-S392 PolarHBondContact O-N 3.32Å; R388-S392 PolarHBondContact O-OG 3.43Å; R388-Y401 HydrophobicContact CB-CE1 4.41Å; R388-Y401 HydrophobicContact CG-CD1 4.01Å; R388-Y401 HydrophobicContact CG-CE1 3.44Å; R388-Y401 VanDerWaalsContact CG-CE1 3.44Å; R388-Y401 PolarHBondContact N-OH 2.88Å
389	R	87.5	Confident	88.8	Confident	125 Å²	125	34.5 Å²	34.5	47%	0.472	19%	0.19	S	C	.	.	H	α-helix	trans	-67.3	-41.4	176.4	-177	177.7	176.3	179.7	-3.3	112.3	A385 L386 M387 A393	A385-R389 PolarHBondContact O-N 2.83Å; L386-R389 WeakPolarHBondContact O-CB 3.27Å; L386-R389 PolarHBondContact O-N 3.03Å; L386-R389 VanDerWaalsContact O-N 3.17Å; M387-R389 PolarHBondContact O-N 3.47Å; R389-A393 WeakPolarHBondContact O-CB 3.28Å; R389-A393 PolarHBondContact O-N 2.9Å
390	L	89.6	Confident	88.9	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-47.4	175.3	-71.8	178.3	0	0	0	111.9	I110 R137 L138 I141 L386 M387 S392 A393 G394 Y395 T397	I110-L390 HydrophobicContact CD1-CD1 4.12Å; R137-L390 HydrophobicContact CB-CD2 4.4Å; L138-L390 HydrophobicContact CD2-CD1 4.09Å; L138-L390 HydrophobicContact CD2-CD2 4.12Å; L138-L390 HydrophobicContact CD2-CG 4.09Å; L138-L390 HydrophobicContact CG-CD1 4.12Å; I141-L390 HydrophobicContact CD1-CD2 3.49Å; I141-L390 VanDerWaalsContact CD1-CD2 3.49Å; L386-L390 PolarHBondContact O-N 3.19Å; M387-L390 HydrophobicContact CE-CD1 3.73Å; M387-L390 PolarHBondContact O-N 3.43Å; M387-L390 VanDerWaalsContact O-N 3.1Å; M387-L390 HydrophobicContact SD-CD1 4.24Å; L390-S392 VanDerWaalsContact C-N 3.34Å; L390-S392 PolarHBondContact O-N 3.08Å; L390-A393 CarbonylContact O-C 3.55Å; L390-A393 WeakPolarHBondContact O-CA 3.41Å; L390-A393 PolarHBondContact O-N 2.96Å; L390-G394 PolarHBondContact O-N 3.2Å; L390-Y395 HydrophobicContact CB-CD2 4.43Å; L390-Y395 HydrophobicContact CB-CG 4.5Å; L390-Y395 HydrophobicContact CD2-CD2 3.91Å; L390-Y395 HydrophobicContact CD2-CE2 4.23Å; L390-Y395 HydrophobicContact CD2-CG 4.1Å; L390-Y395 WeakPolarHBondContact O-CB 3.43Å; L390-Y395 WeakPolarHBondContact O-CD2 3.31Å; L390-Y395 PolarHBondContact O-N 2.97Å; L390-T397 HydrophobicContact CB-CG2 3.52Å; L390-T397 HydrophobicContact CD1-CG2 3.73Å; L390-T397 HydrophobicContact CG-CG2 4.3Å
391	D	88.9	Confident	88.7	Confident	50 Å²	50	41 Å²	41	27%	0.267	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-38.7	178.8	-76.4	-12.8	0	0	0	111.9	M387 A393 G394 H396 T397 Y401	M387-D391 PolarHBondContact O-N 3.02Å; D391-A393 PolarHBondContact O-N 2.74Å; D391-G394 PolarHBondContact O-N 3.02Å; D391-H396 WeakPolarHBondContact OD1-CA 3.38Å; D391-T397 VanDerWaalsContact CG-OG1 3.26Å; D391-T397 WeakPolarHBondContact OD1-CB 3.29Å; D391-T397 WeakPolarHBondContact OD1-CG2 3.22Å; D391-T397 PolarHBondContact OD1-N 3.39Å; D391-T397 PolarHBondContact OD1-OG1 2.8Å; D391-T397 PolarHBondContact OD2-OG1 2.9Å; D391-Y401 WeakPolarHBondContact OD2-CE2 3.42Å; D391-Y401 PolarHBondContact OD2-OH 2.77Å
392	S	84.8	Confident	88.5	Confident	110 Å²	110	45.7 Å²	45.7	77%	0.769	24%	0.241	S	C	*	.	H	α-helix	trans	-63.8	-23.4	173.2	-58.9	0	0	0	0	113.3	R388 L390	R388-S392 VanDerWaalsContact O-CB 3.25Å; R388-S392 WeakPolarHBondContact O-CB 3.46Å; R388-S392 PolarHBondContact O-N 3.32Å; R388-S392 PolarHBondContact O-OG 3.43Å; L390-S392 VanDerWaalsContact C-N 3.34Å; L390-S392 PolarHBondContact O-N 3.08Å
393	A	85.1	Confident	87.9	Confident	54 Å²	54	45.4 Å²	45.4	45%	0.446	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.4	174.4	0	0	0	0	0	113.3	R389 L390 D391 Y395	R389-A393 WeakPolarHBondContact O-CB 3.28Å; R389-A393 PolarHBondContact O-N 2.9Å; L390-A393 CarbonylContact O-C 3.55Å; L390-A393 WeakPolarHBondContact O-CA 3.41Å; L390-A393 PolarHBondContact O-N 2.96Å; D391-A393 PolarHBondContact O-N 2.74Å; A393-Y395 HydrophobicContact CB-CD2 3.83Å; A393-Y395 HydrophobicContact CB-CE2 3.89Å
394	G	85	Confident	86.3	Confident	24 Å²	24	50 Å²	50	25%	0.247	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	13.5	176	0	0	0	0	0	115.5	L390 D391 H396	L390-G394 PolarHBondContact O-N 3.2Å; D391-G394 PolarHBondContact O-N 3.02Å; G394-H396 VanDerWaalsContact C-N 3.31Å; G394-H396 PolarHBondContact O-CD2 2.94Å; G394-H396 PolarHBondContact O-N 3.4Å
395	Y	87.1	Confident	84.5	Confident	41 Å²	41	57.3 Å²	57.3	16%	0.161	31%	0.307	C	S	.	.			trans	-75.4	-14.1	180	-75.3	-93.7	0	0	0	114.4	V107 P109 I110 R137 I141 L390 A393 T397	V107-Y395 HydrophobicContact CG1-CD1 3.36Å; V107-Y395 HydrophobicContact CG1-CD2 3.86Å; V107-Y395 HydrophobicContact CG1-CE1 3.61Å; V107-Y395 HydrophobicContact CG1-CE2 4.07Å; V107-Y395 HydrophobicContact CG1-CG 3.5Å; P109-Y395 CarbonylContact C-O 3.6Å; P109-Y395 WeakPolarHBondContact CA-O 3.3Å; I110-Y395 HydrophobicContact CD1-CD1 4.25Å; I110-Y395 HydrophobicContact CD1-CG 4.35Å; I110-Y395 HydrophobicContact CG1-CD1 4.43Å; I110-Y395 PolarHBondContact N-O 2.93Å; R137-Y395 HydrophobicContact CB-CD1 4.38Å; R137-Y395 HydrophobicContact CB-CE1 4.32Å; R137-Y395 HydrophobicContact CG-CD1 4Å; R137-Y395 HydrophobicContact CG-CE1 4.18Å; I141-Y395 HydrophobicContact CD1-CE2 4.04Å; L390-Y395 HydrophobicContact CB-CD2 4.43Å; L390-Y395 HydrophobicContact CB-CG 4.5Å; L390-Y395 HydrophobicContact CD2-CD2 3.91Å; L390-Y395 HydrophobicContact CD2-CE2 4.23Å; L390-Y395 HydrophobicContact CD2-CG 4.1Å; L390-Y395 WeakPolarHBondContact O-CB 3.43Å; L390-Y395 WeakPolarHBondContact O-CD2 3.31Å; L390-Y395 PolarHBondContact O-N 2.97Å; A393-Y395 HydrophobicContact CB-CD2 3.83Å; A393-Y395 HydrophobicContact CB-CE2 3.89Å; Y395-T397 PolarHBondContact O-N 3.05Å
396	H	89.4	Confident	83	Confident	120 Å²	120	61.5 Å²	61.5	56%	0.556	33%	0.331	S	S	*	.			trans	46	63.2	179.2	-57.5	-65.3	0	0	0	113	P109 N111 D391 G394 G398	P109-H396 HydrophobicContact CB-CB 4.11Å; N111-H396 VanDerWaalsContact CB-O 3.28Å; N111-H396 WeakPolarHBondContact CB-O 3.33Å; N111-H396 PolarHBondContact N-O 3.33Å; D391-H396 WeakPolarHBondContact OD1-CA 3.38Å; G394-H396 VanDerWaalsContact C-N 3.31Å; G394-H396 PolarHBondContact O-CD2 2.94Å; G394-H396 PolarHBondContact O-N 3.4Å; H396-G398 PolarHBondContact O-N 2.98Å
397	T	89.8	Confident	80.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.358	C	S	.	.			trans	-54.1	-32.9	-178	59.7	0	0	0	0	113.7	I110 C130 M387 L390 D391 Y395 Y399	I110-T397 HydrophobicContact CD1-CG2 3.88Å; C130-T397 WeakPolarHBondContact CB-O 3.42Å; M387-T397 HydrophobicContact SD-CG2 3.9Å; L390-T397 HydrophobicContact CB-CG2 3.52Å; L390-T397 HydrophobicContact CD1-CG2 3.73Å; L390-T397 HydrophobicContact CG-CG2 4.3Å; D391-T397 VanDerWaalsContact CG-OG1 3.26Å; D391-T397 WeakPolarHBondContact OD1-CB 3.29Å; D391-T397 WeakPolarHBondContact OD1-CG2 3.22Å; D391-T397 PolarHBondContact OD1-N 3.39Å; D391-T397 PolarHBondContact OD1-OG1 2.8Å; D391-T397 PolarHBondContact OD2-OG1 2.9Å; Y395-T397 PolarHBondContact O-N 3.05Å; T397-Y399 PolarHBondContact O-N 3.34Å; T397-Y399 WeakPolarHBondContact OG1-CB 3.39Å; T397-Y399 PolarHBondContact OG1-N 3.47Å; T397-Y399 VanDerWaalsContact OG1-N 3.11Å
398	G	86.3	Confident	77.9	Confident	29 Å²	29	77 Å²	77	30%	0.299	40%	0.397	S	S	.	.			trans	68.8	20.2	-167.8	0	0	0	0	0	113.2	H396	H396-G398 PolarHBondContact O-N 2.98Å
399	Y	90.1	Very high	75	Confident	26 Å²	26	77.5 Å²	77.5	10%	0.102	42%	0.421	C	S	.	.			trans	-69.4	147.6	177.2	-166.9	-93.3	0	0	0	111.9	K131 F383 E384 M387 T397 Y401	K131-Y399 HydrophobicContact CD-CE2 4.24Å; K131-Y399 HydrophobicContact CG-CD2 4.09Å; K131-Y399 HydrophobicContact CG-CE2 4.14Å; F383-Y399 HydrophobicContact CD1-CD2 4.38Å; F383-Y399 AromaticContact CD1-CE2 3.63Å; F383-Y399 HydrophobicContact CD1-CE2 3.63Å; F383-Y399 HydrophobicContact CE1-CD2 4.01Å; F383-Y399 AromaticContact CE1-CE2 3.59Å; F383-Y399 HydrophobicContact CE1-CE2 3.59Å; E384-Y399 HydrophobicContact CB-CE1 4.1Å; E384-Y399 HydrophobicContact CG-CD1 4.32Å; E384-Y399 HydrophobicContact CG-CE1 3.73Å; M387-Y399 HydrophobicContact CB-CD1 4.17Å; M387-Y399 HydrophobicContact CB-CD2 4.41Å; M387-Y399 HydrophobicContact CB-CG 3.94Å; M387-Y399 HydrophobicContact CG-CD1 4.06Å; M387-Y399 HydrophobicContact CG-CD2 3.52Å; M387-Y399 HydrophobicContact CG-CE1 4.48Å; M387-Y399 HydrophobicContact CG-CE2 3.95Å; M387-Y399 HydrophobicContact CG-CG 3.56Å; M387-Y399 HydrophobicContact SD-CD2 4.04Å; M387-Y399 HydrophobicContact SD-CG 4.39Å; T397-Y399 PolarHBondContact O-N 3.34Å; T397-Y399 WeakPolarHBondContact OG1-CB 3.39Å; T397-Y399 PolarHBondContact OG1-N 3.47Å; T397-Y399 VanDerWaalsContact OG1-N 3.11Å; Y399-Y401 HydrophobicContact CD1-CD1 4.04Å; Y399-Y401 HydrophobicContact CD1-CE1 4.02Å; Y399-Y401 HydrophobicContact CD1-CG 4.31Å
400	V	87.7	Confident	72.1	Confident	100 Å²	100	76.5 Å²	76.5	61%	0.606	43%	0.434	S	S	*	.			trans	-101.3	100.6	178.3	-179	0	0	0	0	108.9	L127	L127-V400 HydrophobicContact CD2-CG2 3.77Å
401	Y	87.4	Confident	69.1	Low	56 Å²	56	83.1 Å²	83.1	22%	0.22	47%	0.474	C	S	.	.			trans	-72.3	127.9	-177.3	-64.7	-79.7	0	0	0	113	E384 M387 R388 D391 Y399	E384-Y401 HydrophobicContact CG-CD1 3.46Å; E384-Y401 VanDerWaalsContact CG-CD1 3.46Å; E384-Y401 HydrophobicContact CG-CE1 3.91Å; E384-Y401 WeakPolarHBondContact OE2-CA 3.28Å; M387-Y401 HydrophobicContact CB-CE1 3.9Å; M387-Y401 WeakPolarHBondContact CB-OH 3.39Å; M387-Y401 PolarHBondContact O-OH 2.86Å; M387-Y401 VanDerWaalsContact O-OH 3.11Å; R388-Y401 HydrophobicContact CB-CE1 4.41Å; R388-Y401 HydrophobicContact CG-CD1 4.01Å; R388-Y401 HydrophobicContact CG-CE1 3.44Å; R388-Y401 VanDerWaalsContact CG-CE1 3.44Å; R388-Y401 PolarHBondContact N-OH 2.88Å; D391-Y401 WeakPolarHBondContact OD2-CE2 3.42Å; D391-Y401 PolarHBondContact OD2-OH 2.77Å; Y399-Y401 HydrophobicContact CD1-CD1 4.04Å; Y399-Y401 HydrophobicContact CD1-CE1 4.02Å; Y399-Y401 HydrophobicContact CD1-CG 4.31Å
402	R	82.4	Confident	66.2	Low	119 Å²	119	84.9 Å²	84.9	45%	0.449	50%	0.496	S	S	.	.	S	Bend	trans	-77	-41.1	165.4	-55.3	-172.8	-170.9	174.4	10.1	110.9	G375 W376 E380 E384 S404	G375-R402 PolarHBondContact O-NH1 3.35Å; W376-R402 HydrophobicContact CH2-CB 3.73Å; W376-R402 HydrophobicContact CH2-CG 4.16Å; W376-R402 HydrophobicContact CZ2-CB 4.13Å; W376-R402 HydrophobicContact CZ3-CB 4.44Å; W376-R402 HydrophobicContact CZ3-CG 4.4Å; E380-R402 IonicContact OE1-NH2 2.88Å; E380-R402 PolarHBondContact OE1-NH2 2.97Å; E380-R402 IonicContact OE2-CZ 2.76Å; E380-R402 VanDerWaalsContact OE2-CZ 3.31Å; E380-R402 IonicContact OE2-NH1 3.28Å; E380-R402 PolarHBondContact OE2-NH1 3.43Å; E380-R402 IonicContact OE2-NH2 3.94Å; E380-R402 PolarHBondContact OE2-NH2 2.75Å; E384-R402 PolarHBondContact OE2-N 3.47Å; R402-S404 VanDerWaalsContact C-N 3.31Å; R402-S404 PolarHBondContact O-N 2.83Å; R402-S404 VanDerWaalsContact O-N 3.09Å
403	L	76.8	Confident	63.5	Low	32 Å²	32	83.7 Å²	83.7	17%	0.168	49%	0.493	C	S	.	.	S	Bend	trans	-85.3	76.8	172.6	-55.8	170.5	0	0	0	109.3	L365 W376 L381 E384 Q405 V406	L365-L403 HydrophobicContact CD1-CD1 4.27Å; L365-L403 HydrophobicContact CD1-CD2 4.33Å; W376-L403 HydrophobicContact CH2-CD1 4.27Å; W376-L403 HydrophobicContact CH2-CG 4.05Å; W376-L403 HydrophobicContact CZ2-CD1 3.98Å; W376-L403 HydrophobicContact CZ2-CD2 4.11Å; W376-L403 HydrophobicContact CZ2-CG 3.75Å; L381-L403 HydrophobicContact CD1-CD1 3.94Å; E384-L403 VanDerWaalsContact OE1-CB 3.22Å; E384-L403 WeakPolarHBondContact OE1-CB 3.43Å; E384-L403 WeakPolarHBondContact OE1-CG 3.43Å; E384-L403 PolarHBondContact OE1-N 2.91Å; E384-L403 VanDerWaalsContact OE1-N 3.1Å; L403-Q405 PolarHBondContact O-N 2.94Å; L403-V406 HydrophobicContact CB-CG2 4.25Å
404	S	58.3	Low	60.8	Low	97 Å²	97	86.3 Å²	86.3	68%	0.678	51%	0.508	S	S	*	.			trans	-58.8	-25.2	-166.7	-44	0	0	0	0	115	R402	R402-S404 VanDerWaalsContact C-N 3.31Å; R402-S404 PolarHBondContact O-N 2.83Å; R402-S404 VanDerWaalsContact O-N 3.09Å
405	Q	53.7	Low	58	Low	153 Å²	153	90.9 Å²	90.9	72%	0.715	53%	0.531	S	S	*	.			trans	-148.9	116.4	173	-63.5	-178	-7.9	0	0	110.1	L403	L403-Q405 PolarHBondContact O-N 2.94Å
406	V	57.4	Low	55.1	Low	92 Å²	92	97.3 Å²	97.3	56%	0.558	57%	0.567	S	S	*	*	S	Bend	trans	-91.8	-29.2	173	179.6	0	0	0	0	111.6	L403	L403-V406 HydrophobicContact CB-CG2 4.25Å
407	R	46.3	Very low	52.3	Low	151 Å²	151	100.5 Å²	100.5	57%	0.57	58%	0.582	S	S	*	*			trans	-104.7	105.6	171.5	-68.2	-174.7	179.5	-178	0	109.5	G409 D454 E456	R407-G409 PolarHBondContact O-N 2.91Å; R407-D454 PolarHBondContact NH2-O 3.32Å; R407-E456 IonicContact CZ-OE2 3.09Å; R407-E456 IonicContact NE-OE2 2.91Å; R407-E456 IonicContact NH2-OE2 3.71Å; R407-E456 PolarHBondContact NH2-OE2 2.9Å
408	Q	34.2	Very low	49.2	Very low	174 Å²	174	111.3 Å²	111.3	81%	0.813	62%	0.623	S	S	*	*			trans	-65.8	122.3	155.1	-69.1	-175.4	2.7	0	0	107	S410	Q408-S410 PolarHBondContact O-N 2.85Å
409	G	27.5	Very low	46.5	Very low	71 Å²	71	115.3 Å²	115.3	73%	0.732	64%	0.644	S	S	*	*			trans	-66.2	106.1	170.6	0	0	0	0	0	108.4	R407 T411	R407-G409 PolarHBondContact O-N 2.91Å; G409-T411 PolarHBondContact O-N 3.34Å
410	S	26.6	Very low	43.8	Very low	104 Å²	104	120.2 Å²	120.2	73%	0.727	68%	0.679	S	S	*	*			trans	-64.1	109.3	178.6	67.2	0	0	0	0	108.9	Q408 A412	Q408-S410 PolarHBondContact O-N 2.85Å; S410-A412 PolarHBondContact O-N 3.5Å
411	T	26.2	Very low	41.3	Very low	142 Å²	142	119.9 Å²	119.9	87%	0.871	69%	0.687	S	S	*	*			trans	-71.4	65.4	163	47.4	0	0	0	0	109	G409 A413	G409-T411 PolarHBondContact O-N 3.34Å; T411-A413 PolarHBondContact O-N 3.33Å
412	A	28.9	Very low	38.7	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	72%	0.716	S	S	*	*			trans	-75.9	61.8	171.3	0	0	0	0	0	109.4	S410	S410-A412 PolarHBondContact O-N 3.5Å
413	A	27.6	Very low	36.5	Very low	86 Å²	86	126.9 Å²	126.9	71%	0.711	74%	0.736	S	S	*	*			trans	-66.9	133.2	159.1	0	0	0	0	0	108	T411	T411-A413 PolarHBondContact O-N 3.33Å
414	S	27.4	Very low	34.4	Very low	109 Å²	109	133 Å²	133	76%	0.762	77%	0.768	S	S	*	*	S	Bend	trans	48.9	102.8	162	-161.1	0	0	0	0	117.6
415	T	27.1	Very low	33.3	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	77%	0.77	S	S	*	*				161.9	121.5	107.2	-64.2	0	0	0	0	109.3	Q417	T415-Q417 PolarHBondContact O-N 3.18Å; T415-Q417 VanDerWaalsContact O-N 3.16Å
416	L	27	Very low	32.2	Very low	175 Å²	175	133.5 Å²	133.5	92%	0.916	77%	0.768	S	S	*	*			trans	-68.5	105.7	168.9	-78.6	155.7	0	0	0	109.4	R418	L416-R418 PolarHBondContact O-N 2.59Å
417	Q	29	Very low	31.1	Very low	187 Å²	187	136 Å²	136	87%	0.874	78%	0.778	S	S	*	*			trans	-84	108.8	166.2	-159	161.7	0.6	0	0	108.3	T415	T415-Q417 PolarHBondContact O-N 3.18Å; T415-Q417 VanDerWaalsContact O-N 3.16Å
418	R	25.4	Very low	30.5	Very low	227 Å²	227	133.9 Å²	133.9	86%	0.857	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62	144.9	172.8	-79.8	-179.9	171.3	175.1	-3.3	109.7	L416	L416-R418 PolarHBondContact O-N 2.59Å
419	P	30.1	Very low	30.5	Very low	114 Å²	114	131 Å²	131	74%	0.74	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-61.6	146.2	158.4	30	-33.3	0	0	0	109.1
420	P	33.7	Very low	30.9	Very low	129 Å²	129	135.1 Å²	135.1	84%	0.838	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64	143.1	-179.8	27.6	-34	0	0	0	110.7
421	A	35.5	Very low	31.3	Very low	93 Å²	93	138.2 Å²	138.2	77%	0.769	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-79.8	154.1	177.8	0	0	0	0	0	111.4
422	D	31.9	Very low	31.7	Very low	156 Å²	156	135.6 Å²	135.6	83%	0.834	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.4	134.9	-178.4	-53.2	-72.9	0	0	0	112.9
423	L	35.4	Very low	32	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	78%	0.778	S	S	*	*			trans	-121.1	97.1	160.5	-110.2	160.6	0	0	0	107.3
424	L	32.6	Very low	32.1	Very low	160 Å²	160	144.9 Å²	144.9	84%	0.838	78%	0.781	S	S	*	*			trans	-76.6	125.2	169.7	-80.8	161.2	0	0	0	108.8
425	D	35.2	Very low	32.3	Very low	136 Å²	136	144.4 Å²	144.4	73%	0.727	78%	0.783	S	S	*	*			trans	-137.8	105.1	159	-121.8	-34.4	0	0	0	111
426	N	32.6	Very low	32.6	Very low	124 Å²	124	144 Å²	144	66%	0.663	79%	0.792	S	S	*	*			trans	53.5	126.6	146.9	-73.6	-55.5	0	0	0	123.2
427	N	32.4	Very low	32.8	Very low	146 Å²	146	140 Å²	140	78%	0.781	78%	0.784	S	S	*	*			trans	64.2	118.8	147.6	-55.3	-28.9	0	0	0	117.3
428	S	33.7	Very low	32.9	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	78%	0.784	S	S	*	*			cis	-176.6	150.8	43.3	49.7	0	0	0	0	113.3
429	T	35.5	Very low	33.1	Very low	114 Å²	114	135.8 Å²	135.8	70%	0.699	78%	0.783	S	S	*	*			trans	52	109.2	150.7	42.6	0	0	0	0	122.7
430	Q	36	Very low	33.2	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	79%	0.792	S	S	*	*				79	124.3	123	-72.1	-179	-16.5	0	0	122.6
431	Q	35.3	Very low	33	Very low	169 Å²	169	147.5 Å²	147.5	79%	0.79	80%	0.795	S	S	*	*			trans	72	138.9	143.8	-65	173.3	22	0	0	117.8
432	S	34.3	Very low	32.8	Very low	87 Å²	87	148.1 Å²	148.1	61%	0.608	80%	0.8	S	S	*	*			cis	-169	165.2	-6.7	60.5	0	0	0	0	111.6
433	R	33.7	Very low	32.9	Very low	223 Å²	223	146.9 Å²	146.9	84%	0.842	80%	0.799	S	S	*	*			trans	68.7	151.1	160.8	-57.8	177.3	168.7	149.7	-2.3	117.9
434	D	30.9	Very low	32.9	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	79%	0.794	S	S	*	*			cis	-163.6	166.4	-26.3	-105.8	-33.6	0	0	0	110
435	A	32	Very low	32.9	Very low	99 Å²	99	145.3 Å²	145.3	82%	0.818	80%	0.8	S	S	*	*			trans	63.7	98.8	156.9	0	0	0	0	0	121.3
436	A	31.4	Very low	32.7	Very low	110 Å²	110	142.2 Å²	142.2	91%	0.909	80%	0.8	S	S	*	*			trans	-172.7	84.5	131.1	0	0	0	0	0	112.6
437	A	31.2	Very low	32.6	Very low	92 Å²	92	148.7 Å²	148.7	76%	0.76	82%	0.815	S	S	*	*			trans	-133.4	117.9	167.7	0	0	0	0	0	110.1
438	H	31.4	Very low	32.4	Very low	190 Å²	190	145.3 Å²	145.3	88%	0.88	82%	0.815	S	S	*	*			trans	-179.1	162.6	140.6	-103.6	70.1	0	0	0	112
439	V	31.1	Very low	32.4	Very low	135 Å²	135	148.1 Å²	148.1	82%	0.818	82%	0.821	S	S	*	*			trans	69.4	83.6	172.8	-159.6	0	0	0	0	117.4
440	R	30.2	Very low	32.2	Very low	247 Å²	247	155 Å²	155	93%	0.932	83%	0.834	S	S	*	*			trans	-130.6	96.7	152.6	-73	-173	-174.4	170.1	3.7	110.9
441	R	30.1	Very low	31.9	Very low	242 Å²	242	151.2 Å²	151.2	91%	0.913	84%	0.837	S	S	*	*			trans	-168.5	92.6	157.3	-122.7	-179.4	-73.7	162.6	-4.6	112.7
442	A	32.2	Very low	32	Very low	106 Å²	106	150.2 Å²	150.2	88%	0.876	84%	0.836	S	S	*	*			trans	-159.9	81.4	162.5	0	0	0	0	0	109.2
443	T	34.2	Very low	32	Very low	130 Å²	130	155.7 Å²	155.7	80%	0.798	85%	0.849	S	S	*	*			trans	-100.9	157.7	177.7	44.2	0	0	0	0	111.6
444	S	34.3	Very low	32	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	84%	0.841	S	S	*	*			trans	68.8	75.4	169.4	74.5	0	0	0	0	119.4
445	L	32.8	Very low	32.3	Very low	183 Å²	183	149.4 Å²	149.4	96%	0.958	84%	0.836	S	S	*	*				-136.2	126.9	121	-78.8	-175.1	0	0	0	107.9
446	G	30.7	Very low	32.6	Very low	72 Å²	72	151.2 Å²	151.2	74%	0.742	83%	0.827	S	S	*	*			trans	-147.5	163.3	-167.4	0	0	0	0	0	115
447	R	31.8	Very low	32.8	Very low	260 Å²	260	150.4 Å²	150.4	98%	0.981	81%	0.807	S	S	*	*			trans	77.2	119.3	-179.4	-52.2	-175.5	-172.6	-92.2	-0.2	114.4
448	G	28.3	Very low	33.1	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	78%	0.779	S	S	*	*	S	Bend	trans	164.5	-28.2	175.3	0	0	0	0	0	114.8
449	L	33.6	Very low	33.5	Very low	166 Å²	166	142.2 Å²	142.2	87%	0.869	76%	0.763	S	S	*	*			trans	-137.3	77.4	-177.8	-69.8	171.7	0	0	0	112.2
450	R	29.7	Very low	34	Very low	259 Å²	259	137.5 Å²	137.5	98%	0.977	73%	0.734	S	S	*	*			trans	-139	115.6	160.5	-65.2	-171.1	-165.8	-121.7	2.4	107.3
451	G	31.5	Very low	34.3	Very low	77 Å²	77	131 Å²	131	79%	0.794	72%	0.722	S	S	*	*	S	Bend	trans	154.5	-10.9	-173.8	0	0	0	0	0	115.5
452	L	36.4	Very low	34.7	Very low	148 Å²	148	123 Å²	123	78%	0.775	70%	0.703	S	S	*	*			trans	-114.9	25.5	-179.1	-89	157.3	0	0	0	113.3	V455	L452-V455 HydrophobicContact CD2-CG2 4.17Å
453	K	34.3	Very low	35	Very low	201 Å²	201	120.2 Å²	120.2	87%	0.874	68%	0.677	S	S	*	*	S	Bend	trans	-88.3	-8.4	-177.7	-102	-164.2	170.1	-159.8	0	115.5
454	D	34.1	Very low	35.3	Very low	127 Å²	127	117 Å²	117	68%	0.679	65%	0.652	S	S	*	*			trans	-109.9	14.8	-173.9	-55.1	-19.5	0	0	0	113.7	R407 E456	R407-D454 PolarHBondContact NH2-O 3.32Å; D454-E456 PolarHBondContact O-N 2.98Å
455	V	37.4	Very low	35.7	Very low	110 Å²	110	112.9 Å²	112.9	67%	0.667	62%	0.624	S	S	*	*			trans	-80.7	81.9	165.8	-173.5	0	0	0	0	108.1	L452 I457	L452-V455 HydrophobicContact CD2-CG2 4.17Å; V455-I457 PolarHBondContact O-N 3.32Å
456	E	38.8	Very low	36.1	Very low	136 Å²	136	108 Å²	108	64%	0.636	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-52.8	125.7	166.9	-165.6	166	-161.4	0	0	109	R407 D454	R407-E456 IonicContact CZ-OE2 3.09Å; R407-E456 IonicContact NE-OE2 2.91Å; R407-E456 IonicContact NH2-OE2 3.71Å; R407-E456 PolarHBondContact NH2-OE2 2.9Å; D454-E456 PolarHBondContact O-N 2.98Å
457	I	34.6	Very low	36.9	Very low	93 Å²	93	109.4 Å²	109.4	48%	0.477	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-63.3	123.7	178.3	-63.5	169.8	0	0	0	106.1	V455 V461	V455-I457 PolarHBondContact O-N 3.32Å; I457-V461 HydrophobicContact CG2-CB 3.97Å; I457-V461 HydrophobicContact CG2-CG2 3.44Å; I457-V461 VanDerWaalsContact CG2-CG2 3.44Å
458	P	38	Very low	37.5	Very low	29 Å²	29	105.8 Å²	105.8	19%	0.188	59%	0.588	C	S	.	*	P	Polyproline II helix	trans	-60.6	153.1	-178.1	26.9	-35.3	0	0	0	109.8	T460 V461	P458-T460 PolarHBondContact O-N 3.5Å; P458-V461 PolarHBondContact O-N 3.39Å
459	P	39.2	Very low	38.2	Very low	82 Å²	82	110.5 Å²	110.5	53%	0.532	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-60.1	-1.5	-178.7	23.5	-34.3	0	0	0	114.5	A385 V461 S462	A385-P459 HydrophobicContact CB-CG 3.94Å; P459-V461 PolarHBondContact O-N 3.21Å; P459-S462 WeakPolarHBondContact O-CB 3.4Å; P459-S462 PolarHBondContact O-N 3.16Å
460	T	42	Very low	38.7	Very low	35 Å²	35	106.9 Å²	106.9	22%	0.215	59%	0.587	C	S	.	*	G	3₁₀ helix	trans	-59.8	0.4	165.7	-14.3	0	0	0	0	114.9	F322 P458	F322-T460 HydrophobicContact CE1-CG2 4.36Å; F322-T460 HydrophobicContact CE2-CG2 4.35Å; F322-T460 HydrophobicContact CZ-CG2 4Å; P458-T460 PolarHBondContact O-N 3.5Å
461	V	36.5	Very low	39.8	Very low	111 Å²	111	99.5 Å²	99.5	67%	0.673	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-115.5	8.4	168.6	-161.6	0	0	0	0	111.8	I457 P458 P459 S463	I457-V461 HydrophobicContact CG2-CB 3.97Å; I457-V461 HydrophobicContact CG2-CG2 3.44Å; I457-V461 VanDerWaalsContact CG2-CG2 3.44Å; P458-V461 PolarHBondContact O-N 3.39Å; P459-V461 PolarHBondContact O-N 3.21Å; V461-S463 PolarHBondContact O-N 3.12Å
462	S	38.4	Very low	40.7	Very low	73 Å²	73	103.5 Å²	103.5	51%	0.51	57%	0.565	S	S	.	*			trans	-74.1	92.7	165.8	-173.3	0	0	0	0	108.6	P459 F464 T466	P459-S462 WeakPolarHBondContact O-CB 3.4Å; P459-S462 PolarHBondContact O-N 3.16Å; S462-F464 PolarHBondContact O-N 3.1Å; S462-T466 PolarHBondContact OG-OG1 3.19Å
463	S	37.6	Very low	41.9	Very low	49 Å²	49	104.2 Å²	104.2	34%	0.343	56%	0.564	S	S	.	*			trans	-52.7	136.9	164.5	170.1	0	0	0	0	109.2	V461 A465 T466	V461-S463 PolarHBondContact O-N 3.12Å; S463-A465 PolarHBondContact O-N 2.88Å; S463-A465 VanDerWaalsContact OG-CB 3.29Å; S463-A465 WeakPolarHBondContact OG-CB 3.42Å; S463-A465 PolarHBondContact OG-N 3.36Å; S463-T466 PolarHBondContact O-N 3.4Å; S463-T466 VanDerWaalsContact O-N 3.16Å; S463-T466 PolarHBondContact O-OG1 3.08Å; S463-T466 VanDerWaalsContact O-OG1 3.04Å
464	F	41.8	Very low	43.2	Very low	63 Å²	63	98 Å²	98	28%	0.276	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-57.6	-9.2	173.2	-90.1	-98	0	0	0	113.2	I247 V356 S462 T466 S467	I247-F464 HydrophobicContact CD1-CD2 4.43Å; V356-F464 HydrophobicContact CG1-CD1 3.99Å; V356-F464 HydrophobicContact CG1-CE1 4.17Å; S462-F464 PolarHBondContact O-N 3.1Å; F464-T466 PolarHBondContact O-N 3.42Å; F464-S467 PolarHBondContact O-N 2.87Å
465	A	43	Very low	44.2	Very low	22 Å²	22	97.7 Å²	97.7	18%	0.182	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-58.6	-16.4	169.6	0	0	0	0	0	114.8	S463 S467 Y468 Y469	S463-A465 PolarHBondContact O-N 2.88Å; S463-A465 VanDerWaalsContact OG-CB 3.29Å; S463-A465 WeakPolarHBondContact OG-CB 3.42Å; S463-A465 PolarHBondContact OG-N 3.36Å; A465-S467 PolarHBondContact O-N 3.26Å; A465-S467 VanDerWaalsContact O-N 3.13Å; A465-Y468 PolarHBondContact O-N 2.96Å; A465-Y469 HydrophobicContact CB-CD2 4.43Å
466	T	41.1	Very low	45.5	Very low	81 Å²	81	95.4 Å²	95.4	50%	0.497	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-56.9	-25.5	175.8	-49.2	0	0	0	0	112.8	S462 S463 F464	S462-T466 PolarHBondContact OG-OG1 3.19Å; S463-T466 PolarHBondContact O-N 3.4Å; S463-T466 VanDerWaalsContact O-N 3.16Å; S463-T466 PolarHBondContact O-OG1 3.08Å; S463-T466 VanDerWaalsContact O-OG1 3.04Å; F464-T466 PolarHBondContact O-N 3.42Å
467	S	47.4	Very low	47.1	Very low	101 Å²	101	93.3 Å²	93.3	71%	0.706	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-80.5	-11.4	178.1	-43.5	0	0	0	0	114.9	F464 A465	F464-S467 PolarHBondContact O-N 2.87Å; A465-S467 PolarHBondContact O-N 3.26Å; A465-S467 VanDerWaalsContact O-N 3.13Å
468	Y	44.1	Very low	48.8	Very low	185 Å²	185	91.3 Å²	91.3	73%	0.725	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-11.4	-166.6	-91.6	-85.9	0	0	0	115.4	A465	A465-Y468 PolarHBondContact O-N 2.96Å
469	Y	43.8	Very low	50.2	Low	173 Å²	173	93.4 Å²	93.4	68%	0.678	53%	0.531	S	S	*	.			trans	-135.7	100.5	-177.1	-61.6	-77.5	0	0	0	111	A465 D471	A465-Y469 HydrophobicContact CB-CD2 4.43Å; Y469-D471 VanDerWaalsContact C-N 3.3Å; Y469-D471 PolarHBondContact O-N 3.33Å
470	G	42.6	Very low	51.7	Low	89 Å²	89	92.3 Å²	92.3	92%	0.918	53%	0.529	S	S	*	.			trans	-81.2	50.1	-168.5	0	0	0	0	0	116.1
471	D	53.7	Low	53.1	Low	104 Å²	104	95.9 Å²	95.9	56%	0.556	54%	0.543	S	S	*	.			trans	-146.3	88.3	178.4	-136.3	17.9	0	0	0	111.4	Y469 S474	Y469-D471 VanDerWaalsContact C-N 3.3Å; Y469-D471 PolarHBondContact O-N 3.33Å; D471-S474 PolarHBondContact OD2-OG 2.87Å
472	E	50.4	Low	54.6	Low	162 Å²	162	97 Å²	97	76%	0.757	54%	0.543	S	S	*	.	H	α-helix	trans	-71	-39.8	-174.5	-71.1	-152.2	132.1	0	0	113.4	R475 A476	E472-R475 PolarHBondContact O-N 3.48Å; E472-A476 PolarHBondContact O-N 3.05Å
473	E	62.1	Low	55.8	Low	163 Å²	163	98.4 Å²	98.4	76%	0.762	54%	0.539	S	S	*	.	H	α-helix	trans	-72.4	-41	-166.4	-160.8	165	-147.8	0	0	112.3	R475 A476 T477	E473-R475 VanDerWaalsContact C-N 3.31Å; E473-R475 PolarHBondContact O-N 3.27Å; E473-A476 PolarHBondContact O-N 2.92Å; E473-T477 PolarHBondContact O-N 2.9Å; E473-T477 PolarHBondContact O-OG1 2.89Å; E473-T477 VanDerWaalsContact O-OG1 3.06Å
474	S	61.6	Low	57.2	Low	70 Å²	70	98.8 Å²	98.8	49%	0.49	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-33.3	172.7	-58.3	0	0	0	0	112.8	D471 T477 A478	D471-S474 PolarHBondContact OD2-OG 2.87Å; S474-T477 PolarHBondContact O-OG1 3.49Å; S474-A478 WeakPolarHBondContact O-CB 3.29Å; S474-A478 PolarHBondContact O-N 2.93Å
475	R	55.2	Low	58.3	Low	121 Å²	121	101.1 Å²	101.1	46%	0.457	56%	0.555	S	S	.	*	H	α-helix	trans	-78.5	-38.2	174.9	-90.6	175.9	56.8	94.2	-4.3	112.7	E472 E473 T477 A478 I479	E472-R475 PolarHBondContact O-N 3.48Å; E473-R475 VanDerWaalsContact C-N 3.31Å; E473-R475 PolarHBondContact O-N 3.27Å; R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.27Å; R475-A478 PolarHBondContact O-N 2.92Å; R475-I479 WeakPolarHBondContact O-CB 3.49Å; R475-I479 WeakPolarHBondContact O-CD1 3.28Å; R475-I479 VanDerWaalsContact O-CG1 3.23Å; R475-I479 WeakPolarHBondContact O-CG1 3.45Å; R475-I479 PolarHBondContact O-N 2.91Å
476	A	64.8	Low	59	Low	62 Å²	62	104.3 Å²	104.3	51%	0.512	57%	0.573	S	S	.	*	H	α-helix	trans	-60.1	-42.5	178.4	0	0	0	0	0	111.7	E472 E473 A480	E472-A476 PolarHBondContact O-N 3.05Å; E473-A476 PolarHBondContact O-N 2.92Å; A476-A480 WeakPolarHBondContact O-CB 3.46Å; A476-A480 PolarHBondContact O-N 2.63Å
477	T	71.4	Confident	59.7	Low	92 Å²	92	106.2 Å²	106.2	56%	0.564	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-48	175.2	47.6	0	0	0	0	112.3	E473 S474 R475 I479 A480 E481	E473-T477 PolarHBondContact O-N 2.9Å; E473-T477 PolarHBondContact O-OG1 2.89Å; E473-T477 VanDerWaalsContact O-OG1 3.06Å; S474-T477 PolarHBondContact O-OG1 3.49Å; R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.27Å; T477-I479 PolarHBondContact O-N 3.37Å; T477-A480 WeakPolarHBondContact O-CB 3.27Å; T477-A480 PolarHBondContact O-N 2.91Å; T477-E481 PolarHBondContact O-N 3.14Å
478	A	70.7	Confident	60	Low	50 Å²	50	104.9 Å²	104.9	41%	0.413	57%	0.57	S	S	.	*	H	α-helix	trans	-60.8	-39.4	176.1	0	0	0	0	0	113.4	S474 R475 E481 M482	S474-A478 WeakPolarHBondContact O-CB 3.29Å; S474-A478 PolarHBondContact O-N 2.93Å; R475-A478 PolarHBondContact O-N 2.92Å; A478-E481 PolarHBondContact O-N 3.19Å; A478-M482 WeakPolarHBondContact O-CB 3.38Å; A478-M482 PolarHBondContact O-N 3.5Å
479	I	67.8	Low	60.4	Low	74 Å²	74	102.2 Å²	102.2	38%	0.379	57%	0.568	S	S	.	*	H	α-helix	trans	-68.3	-37.1	176	-69.7	166.1	0	0	0	111.2	R475 T477 K483	R475-I479 WeakPolarHBondContact O-CB 3.49Å; R475-I479 WeakPolarHBondContact O-CD1 3.28Å; R475-I479 VanDerWaalsContact O-CG1 3.23Å; R475-I479 WeakPolarHBondContact O-CG1 3.45Å; R475-I479 PolarHBondContact O-N 2.91Å; T477-I479 PolarHBondContact O-N 3.37Å; I479-K483 HydrophobicContact CG2-CD 4.34Å; I479-K483 WeakPolarHBondContact O-CB 3.28Å; I479-K483 WeakPolarHBondContact O-CG 3.28Å; I479-K483 PolarHBondContact O-N 3.21Å
480	A	70.6	Confident	60.8	Low	59 Å²	59	97.3 Å²	97.3	49%	0.488	56%	0.558	S	S	.	*	H	α-helix	trans	-65.3	-40.8	174.1	0	0	0	0	0	111.7	A476 T477 K483 A484	A476-A480 WeakPolarHBondContact O-CB 3.46Å; A476-A480 PolarHBondContact O-N 2.63Å; T477-A480 WeakPolarHBondContact O-CB 3.27Å; T477-A480 PolarHBondContact O-N 2.91Å; A480-K483 PolarHBondContact O-N 3.15Å; A480-A484 PolarHBondContact O-N 3.39Å
481	E	71.8	Confident	61.1	Low	109 Å²	109	103.2 Å²	103.2	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-67.8	-44	176.9	-156.5	-160.6	154.3	0	0	112.1	T477 A478 K483 A484 K485	T477-E481 PolarHBondContact O-N 3.14Å; A478-E481 PolarHBondContact O-N 3.19Å; E481-K483 PolarHBondContact O-N 3.42Å; E481-A484 WeakPolarHBondContact O-CB 3.2Å; E481-A484 PolarHBondContact O-N 3.42Å; E481-K485 WeakPolarHBondContact O-CG 3.25Å; E481-K485 PolarHBondContact O-N 3.38Å; E481-K485 WeakPolarHBondContact OE1-CE 3.36Å; E481-K485 IonicContact OE1-NZ 3.77Å; E481-K485 PolarHBondContact OE1-NZ 3.35Å
482	M	66	Low	60.9	Low	136 Å²	136	100.6 Å²	100.6	67%	0.67	55%	0.546	S	S	*	.	H	α-helix	trans	-56.5	-49	170.9	-89.3	-109.5	-127.7	0	0	111.4	A478 A484 K485 T486	A478-M482 WeakPolarHBondContact O-CB 3.38Å; A478-M482 PolarHBondContact O-N 3.5Å; M482-A484 VanDerWaalsContact C-N 3.29Å; M482-A484 PolarHBondContact O-N 3.21Å; M482-K485 PolarHBondContact O-N 3.3Å; M482-K485 VanDerWaalsContact O-N 3.11Å; M482-T486 PolarHBondContact O-N 3.11Å; M482-T486 PolarHBondContact O-OG1 3.44Å
483	K	63.6	Low	61.1	Low	102 Å²	102	99.1 Å²	99.1	44%	0.443	54%	0.539	S	S	.	.	H	α-helix	trans	-59.7	-37.2	175.9	-82.9	174.3	177.6	165	0	112.6	I479 A480 E481 T486 L487	I479-K483 HydrophobicContact CG2-CD 4.34Å; I479-K483 WeakPolarHBondContact O-CB 3.28Å; I479-K483 WeakPolarHBondContact O-CG 3.28Å; I479-K483 PolarHBondContact O-N 3.21Å; A480-K483 PolarHBondContact O-N 3.15Å; E481-K483 PolarHBondContact O-N 3.42Å; K483-T486 PolarHBondContact O-N 3.19Å; K483-L487 VanDerWaalsContact O-CB 3.28Å; K483-L487 WeakPolarHBondContact O-CB 3.29Å; K483-L487 VanDerWaalsContact O-CG 3.31Å; K483-L487 WeakPolarHBondContact O-CG 3.41Å; K483-L487 PolarHBondContact O-N 2.93Å
484	A	67.5	Low	60.8	Low	57 Å²	57	98.4 Å²	98.4	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-43.5	174.7	0	0	0	0	0	111.5	A480 E481 M482 L487 S488	A480-A484 PolarHBondContact O-N 3.39Å; E481-A484 WeakPolarHBondContact O-CB 3.2Å; E481-A484 PolarHBondContact O-N 3.42Å; M482-A484 VanDerWaalsContact C-N 3.29Å; M482-A484 PolarHBondContact O-N 3.21Å; A484-L487 PolarHBondContact O-N 3.5Å; A484-S488 PolarHBondContact O-N 2.86Å; A484-S488 PolarHBondContact O-OG 3.14Å
485	K	66	Low	60.4	Low	112 Å²	112	99.5 Å²	99.5	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-43.5	175	-68.7	171.6	-174.8	168.4	0	112.2	E481 M482 S488 L489	E481-K485 WeakPolarHBondContact O-CG 3.25Å; E481-K485 PolarHBondContact O-N 3.38Å; E481-K485 WeakPolarHBondContact OE1-CE 3.36Å; E481-K485 IonicContact OE1-NZ 3.77Å; E481-K485 PolarHBondContact OE1-NZ 3.35Å; M482-K485 PolarHBondContact O-N 3.3Å; M482-K485 VanDerWaalsContact O-N 3.11Å; K485-S488 WeakPolarHBondContact CA-OG 3.48Å; K485-S488 PolarHBondContact O-N 2.95Å; K485-S488 PolarHBondContact O-OG 3.35Å; K485-L489 WeakPolarHBondContact O-CG 3.38Å; K485-L489 PolarHBondContact O-N 2.84Å
486	T	56.9	Low	60.2	Low	89 Å²	89	98 Å²	98	55%	0.546	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-39.7	175.3	-44	0	0	0	0	111.8	M482 K483 L489 S490	M482-T486 PolarHBondContact O-N 3.11Å; M482-T486 PolarHBondContact O-OG1 3.44Å; K483-T486 PolarHBondContact O-N 3.19Å; T486-L489 PolarHBondContact O-N 2.83Å; T486-S490 WeakPolarHBondContact O-CB 3.46Å; T486-S490 PolarHBondContact O-N 2.83Å
487	L	54.9	Low	59.4	Low	120 Å²	120	98.6 Å²	98.6	63%	0.628	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-39	174.9	-80.2	166.3	0	0	0	111.8	K483 A484 S490 R491	K483-L487 VanDerWaalsContact O-CB 3.28Å; K483-L487 WeakPolarHBondContact O-CB 3.29Å; K483-L487 VanDerWaalsContact O-CG 3.31Å; K483-L487 WeakPolarHBondContact O-CG 3.41Å; K483-L487 PolarHBondContact O-N 2.93Å; A484-L487 PolarHBondContact O-N 3.5Å; L487-S490 WeakPolarHBondContact CA-OG 3.38Å; L487-S490 PolarHBondContact O-N 3.05Å; L487-S490 PolarHBondContact O-OG 2.94Å; L487-R491 PolarHBondContact O-N 3.5Å
488	S	54.2	Low	58.5	Low	74 Å²	74	100.2 Å²	100.2	52%	0.517	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-38.3	173.7	61.9	0	0	0	0	112.6	A484 K485 R491	A484-S488 PolarHBondContact O-N 2.86Å; A484-S488 PolarHBondContact O-OG 3.14Å; K485-S488 WeakPolarHBondContact CA-OG 3.48Å; K485-S488 PolarHBondContact O-N 2.95Å; K485-S488 PolarHBondContact O-OG 3.35Å; S488-R491 VanDerWaalsContact O-CB 3.26Å; S488-R491 WeakPolarHBondContact O-CB 3.47Å; S488-R491 PolarHBondContact O-N 2.57Å
489	L	53.3	Low	57.8	Low	129 Å²	129	100.7 Å²	100.7	68%	0.675	54%	0.542	S	S	*	.	H	α-helix	trans	-67.4	-41.2	174.8	-72	168	0	0	0	112	K485 T486 R491 A492	K485-L489 WeakPolarHBondContact O-CG 3.38Å; K485-L489 PolarHBondContact O-N 2.84Å; T486-L489 PolarHBondContact O-N 2.83Å; L489-R491 PolarHBondContact O-N 3.32Å; L489-R491 VanDerWaalsContact O-N 3.11Å; L489-A492 PolarHBondContact O-N 2.91Å
490	S	52.5	Low	57.3	Low	69 Å²	69	100.5 Å²	100.5	48%	0.483	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-18.3	175.9	76.3	0	0	0	0	113.8	T486 L487 A492	T486-S490 WeakPolarHBondContact O-CB 3.46Å; T486-S490 PolarHBondContact O-N 2.83Å; L487-S490 WeakPolarHBondContact CA-OG 3.38Å; L487-S490 PolarHBondContact O-N 3.05Å; L487-S490 PolarHBondContact O-OG 2.94Å; S490-A492 VanDerWaalsContact C-N 3.33Å
491	R	48.4	Very low	56.6	Low	214 Å²	214	103.6 Å²	103.6	81%	0.808	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-21.3	175.5	-156.3	172.5	-178.2	147.8	-1.3	112.4	L487 S488 L489 H493	L487-R491 PolarHBondContact O-N 3.5Å; S488-R491 VanDerWaalsContact O-CB 3.26Å; S488-R491 WeakPolarHBondContact O-CB 3.47Å; S488-R491 PolarHBondContact O-N 2.57Å; L489-R491 PolarHBondContact O-N 3.32Å; L489-R491 VanDerWaalsContact O-N 3.11Å; R491-H493 VanDerWaalsContact C-N 3.34Å; R491-H493 PolarHBondContact O-N 2.67Å
492	A	50.2	Low	56.3	Low	48 Å²	48	103.1 Å²	103.1	40%	0.397	55%	0.552	S	S	.	*	S	Bend	trans	-94.9	59	170.2	0	0	0	0	0	110.2	L489 S490 W494	L489-A492 PolarHBondContact O-N 2.91Å; S490-A492 VanDerWaalsContact C-N 3.33Å; A492-W494 VanDerWaalsContact O-CD1 3.27Å; A492-W494 PolarHBondContact O-N 3.4Å
493	H	53.4	Low	56.6	Low	132 Å²	132	103.9 Å²	103.9	61%	0.611	55%	0.547	S	S	*	.			trans	-73.2	112.3	172.7	-135	-65.4	0	0	0	108.6	R491 L538	R491-H493 VanDerWaalsContact C-N 3.34Å; R491-H493 PolarHBondContact O-N 2.67Å; H493-L538 WeakPolarHBondContact O-CB 3.34Å; H493-L538 PolarHBondContact O-N 2.82Å
494	W	55.7	Low	57.2	Low	148 Å²	148	103 Å²	103	56%	0.561	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	138.1	173.9	-62.4	84.7	0	0	0	109.7	A492 A535 P537	A492-W494 VanDerWaalsContact O-CD1 3.27Å; A492-W494 PolarHBondContact O-N 3.4Å; W494-A535 HydrophobicContact CB-CB 4.36Å; W494-A535 HydrophobicContact CD2-CB 4.1Å; W494-A535 HydrophobicContact CE3-CB 3.41Å; W494-A535 VanDerWaalsContact CE3-CB 3.41Å; W494-A535 HydrophobicContact CZ3-CB 3.96Å; W494-A535 WeakPolarHBondContact CZ3-O 2.97Å; W494-P537 HydrophobicContact CD2-CB 4.4Å; W494-P537 HydrophobicContact CE3-CB 4.12Å; W494-P537 HydrophobicContact CE3-CG 4.49Å; W494-P537 HydrophobicContact CH2-CB 4.33Å; W494-P537 HydrophobicContact CH2-CG 4.39Å; W494-P537 HydrophobicContact CZ3-CB 4.11Å; W494-P537 HydrophobicContact CZ3-CG 4.1Å
495	L	53.2	Low	57.6	Low	93 Å²	93	105.6 Å²	105.6	49%	0.487	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.5	163.6	-76.7	159.6	0	0	0	107.7	A535 V536 L538 F544	L495-A535 WeakPolarHBondContact O-CA 3.47Å; L495-V536 PolarHBondContact N-O 3.44Å; L495-V536 VanDerWaalsContact N-O 3.08Å; L495-V536 PolarHBondContact O-N 3.12Å; L495-L538 HydrophobicContact CD1-CD1 4.21Å; L495-F544 HydrophobicContact CD1-CE2 4.04Å; L495-F544 HydrophobicContact CD1-CZ 4.46Å
496	S	50.6	Low	57.7	Low	89 Å²	89	104.4 Å²	104.4	62%	0.622	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.1	163.3	57.3	0	0	0	0	109.1
497	T	49	Very low	58.6	Low	74 Å²	74	105.3 Å²	105.3	45%	0.454	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-85.7	135.8	165	54.6	0	0	0	0	108.4	N499 G533	T497-N499 PolarHBondContact O-N 2.89Å; T497-N499 PolarHBondContact OG1-O 3.31Å; T497-N499 VanDerWaalsContact OG1-O 3.09Å; T497-G533 VanDerWaalsContact O-CA 3.3Å; T497-G533 WeakPolarHBondContact O-CA 3.18Å
498	P	51.7	Low	59.2	Low	126 Å²	126	103.5 Å²	103.5	82%	0.818	53%	0.532	S	S	*	.	S	Bend	trans	-67.2	-19.2	-179.1	25.7	-33.7	0	0	0	113.4
499	N	56.2	Low	59.9	Low	60 Å²	60	107.1 Å²	107.1	32%	0.321	55%	0.55	S	S	.	.	S	Bend	trans	-114.9	149.3	-177.7	-61	-3.1	0	0	0	111.1	T497 Y501	T497-N499 PolarHBondContact O-N 2.89Å; T497-N499 PolarHBondContact OG1-O 3.31Å; T497-N499 VanDerWaalsContact OG1-O 3.09Å; N499-Y501 HydrophobicContact CB-CD2 4.34Å; N499-Y501 HydrophobicContact CB-CE1 4.42Å; N499-Y501 HydrophobicContact CB-CE2 3.66Å; N499-Y501 PolarHBondContact ND2-OH 2.64Å
500	A	56.9	Low	60.6	Low	71 Å²	71	104.6 Å²	104.6	59%	0.587	56%	0.556	S	S	*	*			trans	-98.6	121.7	169.8	0	0	0	0	0	109.7	G523	A500-G523 PolarHBondContact O-N 3.4Å
501	Y	56.7	Low	61.3	Low	124 Å²	124	104.8 Å²	104.8	49%	0.486	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112	131.6	-179.1	-63.6	-78.4	0	0	0	111	N499 T521	N499-Y501 HydrophobicContact CB-CD2 4.34Å; N499-Y501 HydrophobicContact CB-CE1 4.42Å; N499-Y501 HydrophobicContact CB-CE2 3.66Å; N499-Y501 PolarHBondContact ND2-OH 2.64Å; Y501-T521 CarbonylContact C-O 3.59Å; Y501-T521 WeakPolarHBondContact CA-O 3.36Å
502	L	65.9	Low	62.4	Low	98 Å²	98	100.7 Å²	100.7	51%	0.513	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.1	139.8	169.6	-167.5	72.7	0	0	0	109.1	E504 W520 T521	L502-E504 HydrophobicContact CD2-CG 4.18Å; L502-W520 VanDerWaalsContact O-CA 3.31Å; L502-W520 WeakPolarHBondContact O-CA 3.08Å; L502-T521 PolarHBondContact N-O 3.33Å; L502-T521 PolarHBondContact O-N 3.24Å
503	R	72.1	Confident	63.3	Low	153 Å²	153	104.9 Å²	104.9	58%	0.577	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.3	117.6	172.3	-176.3	-173.5	-67.2	168.8	-2.1	109.3	T518 W520	R503-T518 HydrophobicContact CG-CG2 4.24Å; R503-W520 HydrophobicContact CB-CD2 4.39Å; R503-W520 HydrophobicContact CB-CE3 3.89Å; R503-W520 HydrophobicContact CB-CH2 4Å; R503-W520 HydrophobicContact CB-CZ2 4.44Å; R503-W520 HydrophobicContact CB-CZ3 3.69Å; R503-W520 HydrophobicContact CG-CH2 4.44Å; R503-W520 HydrophobicContact CG-CZ2 4.43Å; R503-W520 VanDerWaalsContact NE-CZ2 3.34Å
504	E	75	Confident	63.8	Low	82 Å²	82	102.2 Å²	102.2	38%	0.383	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.5	129.2	172.1	-67.8	175.7	137.1	0	0	109.3	L502 T518 H519 T521	L502-E504 HydrophobicContact CD2-CG 4.18Å; E504-T518 WeakPolarHBondContact O-CA 3.44Å; E504-H519 PolarHBondContact N-O 3.1Å; E504-H519 PolarHBondContact O-N 2.88Å; E504-T521 WeakPolarHBondContact OE2-CG2 3.36Å; E504-T521 PolarHBondContact OE2-OG1 3.36Å
505	E	75.9	Confident	64.4	Low	112 Å²	112	102 Å²	102	52%	0.523	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.1	108.7	169.5	-73	-173.9	-179.6	0	0	108.7	K516 T518	E505-K516 WeakPolarHBondContact OE2-CD 3.42Å; E505-K516 IonicContact OE2-NZ 2.62Å; E505-K516 PolarHBondContact OE2-NZ 3.29Å; E505-T518 HydrophobicContact CG-CG2 4.26Å
506	I	70	Confident	65.5	Low	87 Å²	87	103.6 Å²	103.6	45%	0.446	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101	127.2	176.6	-54.6	179.2	0	0	0	108	I517 H519	I506-I517 PolarHBondContact N-O 3.36Å; I506-I517 PolarHBondContact O-N 2.91Å; I506-H519 HydrophobicContact CD1-CB 3.7Å; I506-H519 HydrophobicContact CG1-CB 4.19Å
507	E	74.6	Confident	66.3	Low	108 Å²	108	103.3 Å²	103.3	51%	0.505	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.9	132.5	173.5	-74.1	-177.4	175.8	0	0	110.8	V509 K516	E507-V509 PolarHBondContact O-N 2.67Å; E507-K516 HydrophobicContact CG-CG 3.72Å; E507-K516 WeakPolarHBondContact OE1-CE 3.46Å
508	E	67.3	Low	67.7	Low	83 Å²	83	103.2 Å²	103.2	39%	0.388	56%	0.561	S	S	.	*			trans	-73.4	89.6	-174.2	-164.4	173.9	-141.1	0	0	111.6	G510 K515 I517	E508-G510 PolarHBondContact O-N 3.11Å; E508-K515 WeakPolarHBondContact CB-O 2.99Å; E508-K515 PolarHBondContact N-O 3.27Å; E508-I517 HydrophobicContact CB-CD1 4.17Å; E508-I517 HydrophobicContact CG-CD1 4.12Å
509	V	69	Low	68.6	Low	149 Å²	149	101.8 Å²	101.8	90%	0.903	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	126.1	-179.3	-175.1	0	0	0	0	111.1	E507	E507-V509 PolarHBondContact O-N 2.67Å
510	G	69	Low	69.1	Low	77 Å²	77	105.1 Å²	105.1	79%	0.794	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.9	-2.2	173.5	0	0	0	0	0	115.7	E508	E508-G510 PolarHBondContact O-N 3.11Å
511	T	67.7	Low	69.7	Low	72 Å²	72	103.6 Å²	103.6	44%	0.442	54%	0.535	S	S	.	.	S	Bend	trans	-116.3	150.7	169.4	64.7	0	0	0	0	111.2	N513	T511-N513 PolarHBondContact O-N 3.11Å; T511-N513 VanDerWaalsContact O-N 3.07Å
512	P	70.6	Confident	70	Confident	129 Å²	129	104.5 Å²	104.5	84%	0.838	54%	0.544	S	S	*	.	S	Bend	trans	-70.1	0.3	-178.9	27.7	-35.5	0	0	0	114.7
513	N	67.9	Low	69.6	Low	135 Å²	135	101.9 Å²	101.9	72%	0.722	54%	0.54	S	S	*	.	S	Bend	trans	-139.4	79.4	174.5	-80.3	-43.1	0	0	0	108.7	T511 K515	T511-N513 PolarHBondContact O-N 3.11Å; T511-N513 VanDerWaalsContact O-N 3.07Å; N513-K515 PolarHBondContact O-N 3.15Å
514	P	65.1	Low	68.9	Low	76 Å²	76	100 Å²	100	49%	0.494	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-62.7	131.8	-175.4	26	-34.5	0	0	0	110.9
515	K	68.4	Low	67.7	Low	144 Å²	144	102.8 Å²	102.8	63%	0.626	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-96.7	143.2	170.4	-71.1	177.1	-177.5	170.1	0	109.8	E508 N513	E508-K515 WeakPolarHBondContact CB-O 2.99Å; E508-K515 PolarHBondContact N-O 3.27Å; N513-K515 PolarHBondContact O-N 3.15Å
516	K	76.7	Confident	66.4	Low	127 Å²	127	103.8 Å²	103.8	55%	0.552	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.2	119.8	166.6	-73.5	179.6	157.8	-143	0	109.4	E505 E507	E505-K516 WeakPolarHBondContact OE2-CD 3.42Å; E505-K516 IonicContact OE2-NZ 2.62Å; E505-K516 PolarHBondContact OE2-NZ 3.29Å; E507-K516 HydrophobicContact CG-CG 3.72Å; E507-K516 WeakPolarHBondContact OE1-CE 3.46Å
517	I	67.4	Low	65.1	Low	82 Å²	82	106.5 Å²	106.5	42%	0.421	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	121.6	176.3	-58.5	176.9	0	0	0	107.5	I506 E508 H519	I506-I517 PolarHBondContact N-O 3.36Å; I506-I517 PolarHBondContact O-N 2.91Å; E508-I517 HydrophobicContact CB-CD1 4.17Å; E508-I517 HydrophobicContact CG-CD1 4.12Å; I517-H519 PolarHBondContact O-N 3.38Å
518	T	77.1	Confident	63.5	Low	73 Å²	73	111 Å²	111	45%	0.448	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76	109.5	172.9	51.8	0	0	0	0	109.9	R503 E504 E505	R503-T518 HydrophobicContact CG-CG2 4.24Å; E504-T518 WeakPolarHBondContact O-CA 3.44Å; E505-T518 HydrophobicContact CG-CG2 4.26Å
519	H	70.9	Confident	62.2	Low	95 Å²	95	113.4 Å²	113.4	44%	0.44	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	144.5	170.8	-168.1	-102.8	0	0	0	109.3	E504 I506 I517 T521	E504-H519 PolarHBondContact N-O 3.1Å; E504-H519 PolarHBondContact O-N 2.88Å; I506-H519 HydrophobicContact CD1-CB 3.7Å; I506-H519 HydrophobicContact CG1-CB 4.19Å; I517-H519 PolarHBondContact O-N 3.38Å; H519-T521 WeakPolarHBondContact ND1-CG2 3.36Å
520	W	66.9	Low	61	Low	131 Å²	131	117.8 Å²	117.8	50%	0.496	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.3	105.9	178.1	-68.4	96.7	0	0	0	109.4	L502 R503	L502-W520 VanDerWaalsContact O-CA 3.31Å; L502-W520 WeakPolarHBondContact O-CA 3.08Å; R503-W520 HydrophobicContact CB-CD2 4.39Å; R503-W520 HydrophobicContact CB-CE3 3.89Å; R503-W520 HydrophobicContact CB-CH2 4Å; R503-W520 HydrophobicContact CB-CZ2 4.44Å; R503-W520 HydrophobicContact CB-CZ3 3.69Å; R503-W520 HydrophobicContact CG-CH2 4.44Å; R503-W520 HydrophobicContact CG-CZ2 4.43Å; R503-W520 VanDerWaalsContact NE-CZ2 3.34Å
521	T	68.6	Low	59.7	Low	39 Å²	39	121.7 Å²	121.7	24%	0.239	65%	0.645	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.4	147.4	177.6	36.6	0	0	0	0	111.1	Y501 L502 E504 H519	Y501-T521 CarbonylContact C-O 3.59Å; Y501-T521 WeakPolarHBondContact CA-O 3.36Å; L502-T521 PolarHBondContact N-O 3.33Å; L502-T521 PolarHBondContact O-N 3.24Å; E504-T521 WeakPolarHBondContact OE2-CG2 3.36Å; E504-T521 PolarHBondContact OE2-OG1 3.36Å; H519-T521 WeakPolarHBondContact ND1-CG2 3.36Å
522	E	63.7	Low	58.5	Low	143 Å²	143	121.2 Å²	121.2	67%	0.668	65%	0.654	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73	125.1	169.5	-173.2	170.9	-166.9	0	0	108.5	S524	E522-S524 PolarHBondContact O-N 2.71Å
523	G	58.3	Low	57.5	Low	42 Å²	42	116.5 Å²	116.5	43%	0.433	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-63.1	122	-174	0	0	0	0	0	111.9	A500 D525	A500-G523 PolarHBondContact O-N 3.4Å; G523-D525 PolarHBondContact O-N 2.9Å
524	S	56.1	Low	56.9	Low	113 Å²	113	115.2 Å²	115.2	79%	0.79	63%	0.626	S	S	*	*			trans	-78.6	6.5	-172.9	54.8	0	0	0	0	115.2	E522 T526	E522-S524 PolarHBondContact O-N 2.71Å; S524-T526 PolarHBondContact O-N 3.33Å
525	D	50.7	Low	56.3	Low	141 Å²	141	114 Å²	114	75%	0.754	62%	0.622	S	S	*	*			trans	-67	123.9	-177	-74.9	-21.7	0	0	0	111.8	G523 N527	G523-D525 PolarHBondContact O-N 2.9Å; D525-N527 PolarHBondContact O-N 2.66Å
526	T	49.3	Very low	55.8	Low	134 Å²	134	109.7 Å²	109.7	82%	0.822	61%	0.608	S	S	*	*	S	Bend	trans	-71.9	9.8	-165.2	45.3	0	0	0	0	115.8	S524 K528	S524-T526 PolarHBondContact O-N 3.33Å; T526-K528 VanDerWaalsContact C-N 3.28Å; T526-K528 PolarHBondContact O-N 2.92Å
527	N	41.5	Very low	55	Low	144 Å²	144	106.1 Å²	106.1	77%	0.77	60%	0.597	S	S	*	*			trans	-83.7	60.1	179.2	-78.4	-33.8	0	0	0	113	D525 T529	D525-N527 PolarHBondContact O-N 2.66Å; N527-T529 VanDerWaalsContact C-N 3.32Å; N527-T529 PolarHBondContact O-N 3.15Å
528	K	41	Very low	54.6	Low	201 Å²	201	105.5 Å²	105.5	87%	0.874	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	79.8	171.3	-72.8	-176.3	175.3	179.4	0	111.7	T526	T526-K528 VanDerWaalsContact C-N 3.28Å; T526-K528 PolarHBondContact O-N 2.92Å
529	T	40.6	Very low	54	Low	135 Å²	135	107.8 Å²	107.8	83%	0.828	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.4	11	169.1	-0.3	0	0	0	0	116.4	N527	N527-T529 VanDerWaalsContact C-N 3.32Å; N527-T529 PolarHBondContact O-N 3.15Å
530	R	42.4	Very low	53.6	Low	241 Å²	241	106.4 Å²	106.4	91%	0.909	60%	0.604	S	S	*	*			trans	-124.1	104.5	177	-84.8	-175.7	149.5	-165.8	-7.2	113.2	G532	R530-G532 PolarHBondContact O-N 3.35Å
531	T	42.1	Very low	53.4	Low	158 Å²	158	105.9 Å²	105.9	97%	0.969	62%	0.618	S	S	*	*			trans	-69.5	68.9	162.3	38.9	0	0	0	0	110.6
532	G	43.7	Very low	53.1	Low	63 Å²	63	108.5 Å²	108.5	65%	0.649	63%	0.63	S	S	*	*			trans	-143	74.2	-175.6	0	0	0	0	0	111.7	R530	R530-G532 PolarHBondContact O-N 3.35Å
533	G	48.3	Very low	53.4	Low	30 Å²	30	105.2 Å²	105.2	31%	0.309	62%	0.615	S	S	.	*			trans	-61	146.9	174.5	0	0	0	0	0	112.2	T497 A535	T497-G533 VanDerWaalsContact O-CA 3.3Å; T497-G533 WeakPolarHBondContact O-CA 3.18Å; G533-A535 PolarHBondContact O-N 3.43Å; G533-A535 VanDerWaalsContact O-N 3.09Å
534	V	56	Low	53.5	Low	108 Å²	108	110.3 Å²	110.3	66%	0.655	63%	0.625	S	S	*	*			trans	-62.9	114.5	177.5	179.7	0	0	0	0	109	V536	V534-V536 PolarHBondContact O-N 3.07Å
535	A	53.3	Low	53.7	Low	49 Å²	49	107.5 Å²	107.5	41%	0.405	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.1	122.1	177.1	0	0	0	0	0	109.3	W494 L495 G533	W494-A535 HydrophobicContact CB-CB 4.36Å; W494-A535 HydrophobicContact CD2-CB 4.1Å; W494-A535 HydrophobicContact CE3-CB 3.41Å; W494-A535 VanDerWaalsContact CE3-CB 3.41Å; W494-A535 HydrophobicContact CZ3-CB 3.96Å; W494-A535 WeakPolarHBondContact CZ3-O 2.97Å; L495-A535 WeakPolarHBondContact O-CA 3.47Å; G533-A535 PolarHBondContact O-N 3.43Å; G533-A535 VanDerWaalsContact O-N 3.09Å
536	V	58.2	Low	54.1	Low	55 Å²	55	109.4 Å²	109.4	33%	0.333	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	127.3	172.9	-178.1	0	0	0	0	108.9	L495 V534	L495-V536 PolarHBondContact N-O 3.44Å; L495-V536 VanDerWaalsContact N-O 3.08Å; L495-V536 PolarHBondContact O-N 3.12Å; V534-V536 PolarHBondContact O-N 3.07Å
537	P	59	Low	54.5	Low	51 Å²	51	111.1 Å²	111.1	33%	0.331	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75	133.7	176.8	31.1	-31.7	0	0	0	109.4	W494 V539 Q543	W494-P537 HydrophobicContact CD2-CB 4.4Å; W494-P537 HydrophobicContact CE3-CB 4.12Å; W494-P537 HydrophobicContact CE3-CG 4.49Å; W494-P537 HydrophobicContact CH2-CB 4.33Å; W494-P537 HydrophobicContact CH2-CG 4.39Å; W494-P537 HydrophobicContact CZ3-CB 4.11Å; W494-P537 HydrophobicContact CZ3-CG 4.1Å; P537-V539 HydrophobicContact CG-CG2 4.41Å; P537-V539 PolarHBondContact O-N 3.03Å; P537-Q543 PolarHBondContact O-NE2 3.4Å; P537-Q543 PolarHBondContact O-OE1 2.98Å
538	L	59.2	Low	55.5	Low	69 Å²	69	106.1 Å²	106.1	36%	0.361	60%	0.599	S	S	.	*			trans	-78.6	98	175	-166.8	74.5	0	0	0	110	H493 L495 F544	H493-L538 WeakPolarHBondContact O-CB 3.34Å; H493-L538 PolarHBondContact O-N 2.82Å; L495-L538 HydrophobicContact CD1-CD1 4.21Å; L538-F544 HydrophobicContact CD1-CE2 4.04Å
539	V	64.5	Low	56.8	Low	121 Å²	121	103 Å²	103	73%	0.733	60%	0.603	S	S	*	*			trans	-86	-36.4	-175.4	-176.3	0	0	0	0	112.1	P537	P537-V539 HydrophobicContact CG-CG2 4.41Å; P537-V539 PolarHBondContact O-N 3.03Å
540	D	61.8	Low	58.2	Low	67 Å²	67	100.9 Å²	100.9	36%	0.358	59%	0.586	S	S	.	*			trans	-142.3	139.6	178.1	-180	59.1	0	0	0	110.5	N542 Q543	D540-N542 PolarHBondContact O-N 3.18Å; D540-N542 WeakPolarHBondContact OD2-CA 3.4Å; D540-N542 VanDerWaalsContact OD2-CB 3.24Å; D540-N542 WeakPolarHBondContact OD2-CB 3.47Å; D540-N542 PolarHBondContact OD2-N 3.45Å; D540-N542 PolarHBondContact OD2-ND2 2.82Å; D540-Q543 WeakPolarHBondContact O-CB 3.17Å; D540-Q543 PolarHBondContact O-N 3.44Å
541	P	62.8	Low	59.6	Low	120 Å²	120	95.3 Å²	95.3	78%	0.779	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-16.5	172.3	17.5	-33.3	0	0	0	115.8
542	N	63.5	Low	61	Low	93 Å²	93	92.9 Å²	92.9	50%	0.497	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.2	16	174.5	-43.5	-73.3	0	0	0	113.6	D540 F544 A545	D540-N542 PolarHBondContact O-N 3.18Å; D540-N542 WeakPolarHBondContact OD2-CA 3.4Å; D540-N542 VanDerWaalsContact OD2-CB 3.24Å; D540-N542 WeakPolarHBondContact OD2-CB 3.47Å; D540-N542 PolarHBondContact OD2-N 3.45Å; D540-N542 PolarHBondContact OD2-ND2 2.82Å; N542-F544 PolarHBondContact O-N 3.43Å; N542-A545 HydrophobicContact CB-CB 4.11Å; N542-A545 WeakPolarHBondContact O-CB 3.44Å; N542-A545 PolarHBondContact O-N 3.35Å
543	Q	69.3	Low	62.6	Low	74 Å²	74	93.4 Å²	93.4	35%	0.346	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-24.6	-179.1	179.9	174.3	-3	0	0	114.3	P537 D540	P537-Q543 PolarHBondContact O-NE2 3.4Å; P537-Q543 PolarHBondContact O-OE1 2.98Å; D540-Q543 WeakPolarHBondContact O-CB 3.17Å; D540-Q543 PolarHBondContact O-N 3.44Å
544	F	61.2	Low	63.6	Low	150 Å²	150	99.3 Å²	99.3	66%	0.658	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	6.5	176.4	-59.1	-73.8	0	0	0	113.9	L495 L538 N542	L495-F544 HydrophobicContact CD1-CE2 4.04Å; L495-F544 HydrophobicContact CD1-CZ 4.46Å; L538-F544 HydrophobicContact CD1-CE2 4.04Å; N542-F544 PolarHBondContact O-N 3.43Å
545	A	59.6	Low	64.6	Low	54 Å²	54	100.5 Å²	100.5	45%	0.446	56%	0.558	S	S	.	*	S	Bend	trans	-83.8	124.4	170.9	0	0	0	0	0	109.7	N542 Q547	N542-A545 HydrophobicContact CB-CB 4.11Å; N542-A545 WeakPolarHBondContact O-CB 3.44Å; N542-A545 PolarHBondContact O-N 3.35Å; A545-Q547 PolarHBondContact O-N 2.93Å
546	L	59.1	Low	66	Low	181 Å²	181	101.8 Å²	101.8	95%	0.948	56%	0.559	S	S	*	*			trans	-61.5	101.9	173.9	-71.6	164.8	0	0	0	109.8	G548	L546-G548 PolarHBondContact O-N 3.3Å
547	Q	57.9	Low	67	Low	169 Å²	169	104.3 Å²	104.3	79%	0.79	57%	0.567	S	S	*	*			trans	-78.3	105.4	171.4	-64.5	-173.5	11	0	0	108.5	A545	A545-Q547 PolarHBondContact O-N 2.93Å
548	G	61.2	Low	67.9	Low	39 Å²	39	106.8 Å²	106.8	40%	0.402	57%	0.574	S	S	.	*			trans	-60.4	158.5	168.4	0	0	0	0	0	111.3	L546 D550	L546-G548 PolarHBondContact O-N 3.3Å; G548-D550 PolarHBondContact O-N 2.92Å
549	S	69.7	Low	69.1	Low	136 Å²	136	110 Å²	110	95%	0.951	59%	0.585	S	S	*	*	S	Bend	trans	-66.1	-2.7	-174.7	44.5	0	0	0	0	115.4
550	D	69.2	Low	70	Confident	90 Å²	90	111 Å²	111	48%	0.481	58%	0.579	S	S	.	*			trans	-121.9	110.1	-175.4	-170.2	7.2	0	0	0	111.3	G548 Q552 E553	G548-D550 PolarHBondContact O-N 2.92Å; D550-Q552 PolarHBondContact O-N 3.48Å; D550-E553 HydrophobicContact CB-CB 4.41Å; D550-E553 VanDerWaalsContact O-CB 3.23Å; D550-E553 WeakPolarHBondContact O-CB 3.27Å; D550-E553 PolarHBondContact O-N 2.85Å
551	P	71.2	Confident	70.8	Confident	124 Å²	124	110.6 Å²	110.6	81%	0.805	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-8.4	-172.5	25.8	-34.5	0	0	0	114.8
552	Q	71.7	Confident	71.6	Confident	107 Å²	107	110.8 Å²	110.8	50%	0.5	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	-14.5	169.8	-75.6	-90	1.7	0	0	113.1	D550 F554 K555 N556	D550-Q552 PolarHBondContact O-N 3.48Å; Q552-F554 PolarHBondContact O-N 3.26Å; Q552-K555 PolarHBondContact O-N 2.99Å; Q552-K555 VanDerWaalsContact O-N 3.13Å; Q552-N556 PolarHBondContact O-N 2.9Å
553	E	77	Confident	72.5	Confident	75 Å²	75	109.9 Å²	109.9	35%	0.35	56%	0.563	S	S	.	*	H	α-helix	trans	-59.3	-46.6	-169.2	-157.8	-155	150.8	0	0	112.1	D550 K555 N556 Q557	D550-E553 HydrophobicContact CB-CB 4.41Å; D550-E553 VanDerWaalsContact O-CB 3.23Å; D550-E553 WeakPolarHBondContact O-CB 3.27Å; D550-E553 PolarHBondContact O-N 2.85Å; E553-K555 VanDerWaalsContact C-N 3.34Å; E553-K555 PolarHBondContact O-N 3.12Å; E553-N556 CarbonylContact O-C 3.58Å; E553-N556 PolarHBondContact O-N 3.41Å; E553-N556 VanDerWaalsContact O-N 3.12Å; E553-Q557 HydrophobicContact CG-CG 4.39Å; E553-Q557 WeakPolarHBondContact O-CG 3.44Å; E553-Q557 PolarHBondContact O-N 3.2Å; E553-Q557 PolarHBondContact OE1-NE2 3.24Å
554	F	71	Confident	72.8	Confident	153 Å²	153	111.9 Å²	111.9	67%	0.671	57%	0.571	S	S	*	*	H	α-helix	trans	-58.5	-42.2	178.1	179.1	-96.7	0	0	0	112.6	Q552 Q557 Q558	Q552-F554 PolarHBondContact O-N 3.26Å; F554-Q557 PolarHBondContact O-N 3.28Å; F554-Q558 VanDerWaalsContact O-CB 3.25Å; F554-Q558 WeakPolarHBondContact O-CB 3.21Å; F554-Q558 PolarHBondContact O-N 2.87Å
555	K	76.9	Confident	73.1	Confident	133 Å²	133	112.9 Å²	112.9	58%	0.578	57%	0.571	S	S	*	*	H	α-helix	trans	-66.2	-40.4	176.6	-73.4	-179.4	179.9	171.6	0	111.2	Q552 E553 Q558 K559	Q552-K555 PolarHBondContact O-N 2.99Å; Q552-K555 VanDerWaalsContact O-N 3.13Å; E553-K555 VanDerWaalsContact C-N 3.34Å; E553-K555 PolarHBondContact O-N 3.12Å; K555-Q558 PolarHBondContact O-N 3.47Å; K555-K559 WeakPolarHBondContact O-CB 3.29Å; K555-K559 PolarHBondContact O-N 3.32Å
556	N	81	Confident	73.8	Confident	77 Å²	77	119.6 Å²	119.6	41%	0.412	59%	0.586	S	S	.	*	H	α-helix	trans	-67.6	-40.2	177.1	-74.6	-27.5	0	0	0	112.2	Q552 E553 K559 K560	Q552-N556 PolarHBondContact O-N 2.9Å; E553-N556 CarbonylContact O-C 3.58Å; E553-N556 PolarHBondContact O-N 3.41Å; E553-N556 VanDerWaalsContact O-N 3.12Å; N556-K559 PolarHBondContact O-N 2.84Å; N556-K560 WeakPolarHBondContact O-CB 3.42Å; N556-K560 WeakPolarHBondContact O-CG 3.36Å; N556-K560 PolarHBondContact O-N 2.66Å
557	Q	80	Confident	74.6	Confident	107 Å²	107	118.5 Å²	118.5	50%	0.5	57%	0.574	S	S	.	*	H	α-helix	trans	-65.5	-45.6	172.3	-71.1	-144.1	24	0	0	111.5	E553 F554 K559 K560 V561	E553-Q557 HydrophobicContact CG-CG 4.39Å; E553-Q557 WeakPolarHBondContact O-CG 3.44Å; E553-Q557 PolarHBondContact O-N 3.2Å; E553-Q557 PolarHBondContact OE1-NE2 3.24Å; F554-Q557 PolarHBondContact O-N 3.28Å; Q557-K559 VanDerWaalsContact C-N 3.3Å; Q557-K559 PolarHBondContact O-N 3.21Å; Q557-K560 CarbonylContact O-C 3.5Å; Q557-K560 PolarHBondContact O-N 3.12Å; Q557-V561 WeakPolarHBondContact O-CG2 3.28Å; Q557-V561 PolarHBondContact O-N 2.99Å
558	Q	78.6	Confident	74.6	Confident	103 Å²	103	117.7 Å²	117.7	48%	0.481	58%	0.575	S	S	.	*	H	α-helix	trans	-60.6	-39.7	176.7	-168.8	-176.6	49.2	0	0	111.7	F554 K555 V561 K562	F554-Q558 VanDerWaalsContact O-CB 3.25Å; F554-Q558 WeakPolarHBondContact O-CB 3.21Å; F554-Q558 PolarHBondContact O-N 2.87Å; K555-Q558 PolarHBondContact O-N 3.47Å; Q558-V561 PolarHBondContact O-N 3.3Å; Q558-K562 PolarHBondContact O-N 3.47Å
559	K	84.5	Confident	74.8	Confident	138 Å²	138	120.6 Å²	120.6	60%	0.6	59%	0.585	S	S	*	*	H	α-helix	trans	-65.1	-47.5	173.2	-165.1	179.2	-177.2	-175	0	111.4	K555 N556 Q557 V561 K562 D563	K555-K559 WeakPolarHBondContact O-CB 3.29Å; K555-K559 PolarHBondContact O-N 3.32Å; N556-K559 PolarHBondContact O-N 2.84Å; Q557-K559 VanDerWaalsContact C-N 3.3Å; Q557-K559 PolarHBondContact O-N 3.21Å; K559-V561 VanDerWaalsContact C-N 3.3Å; K559-V561 PolarHBondContact O-N 3.16Å; K559-K562 PolarHBondContact O-N 3.09Å; K559-D563 PolarHBondContact O-N 3.28Å
560	K	83.3	Confident	74.1	Confident	141 Å²	141	121.5 Å²	121.5	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-58.4	-36.8	173.9	-77	174.1	178	176	0	112.9	N556 Q557 K564	N556-K560 WeakPolarHBondContact O-CB 3.42Å; N556-K560 WeakPolarHBondContact O-CG 3.36Å; N556-K560 PolarHBondContact O-N 2.66Å; Q557-K560 CarbonylContact O-C 3.5Å; Q557-K560 PolarHBondContact O-N 3.12Å; K560-K564 WeakPolarHBondContact O-CB 3.27Å; K560-K564 WeakPolarHBondContact O-CG 3.36Å; K560-K564 PolarHBondContact O-N 2.64Å
561	V	78	Confident	73.6	Confident	58 Å²	58	120.6 Å²	120.6	35%	0.352	57%	0.568	S	S	.	*	H	α-helix	trans	-70.5	-42.4	176.1	171	0	0	0	0	111.1	Q557 Q558 K559 K564 Y565	Q557-V561 WeakPolarHBondContact O-CG2 3.28Å; Q557-V561 PolarHBondContact O-N 2.99Å; Q558-V561 PolarHBondContact O-N 3.3Å; K559-V561 VanDerWaalsContact C-N 3.3Å; K559-V561 PolarHBondContact O-N 3.16Å; V561-K564 PolarHBondContact O-N 2.86Å; V561-Y565 PolarHBondContact O-N 2.95Å
562	K	80.1	Confident	72.7	Confident	125 Å²	125	119.7 Å²	119.7	54%	0.543	57%	0.571	S	S	.	*	H	α-helix	trans	-61.6	-46.6	172.3	-83.7	-172.7	170.1	-175.3	0	112.1	Q558 K559 K564 Y565 Y566	Q558-K562 PolarHBondContact O-N 3.47Å; K559-K562 PolarHBondContact O-N 3.09Å; K562-K564 VanDerWaalsContact C-N 3.3Å; K562-K564 PolarHBondContact O-N 2.68Å; K562-Y565 CarbonylContact O-C 3.57Å; K562-Y565 WeakPolarHBondContact O-CA 3.44Å; K562-Y565 WeakPolarHBondContact O-CB 3.43Å; K562-Y565 PolarHBondContact O-N 3.12Å; K562-Y566 VanDerWaalsContact O-CD2 3.31Å; K562-Y566 WeakPolarHBondContact O-CD2 3.25Å; K562-Y566 PolarHBondContact O-N 3.18Å
563	D	81.2	Confident	71.8	Confident	74 Å²	74	117 Å²	117	40%	0.396	57%	0.572	S	S	.	*	H	α-helix	trans	-63.4	-35.8	178.8	-69.5	-12.2	0	0	0	111.8	K559 Y565 K567	K559-D563 PolarHBondContact O-N 3.28Å; D563-Y565 VanDerWaalsContact C-N 3.32Å; D563-K567 WeakPolarHBondContact O-CB 3.44Å; D563-K567 VanDerWaalsContact O-CG 3.28Å; D563-K567 WeakPolarHBondContact O-CG 3.38Å; D563-K567 PolarHBondContact O-N 3.29Å; D563-K567 VanDerWaalsContact O-N 3.12Å
564	K	77.5	Confident	70.4	Confident	116 Å²	116	119.9 Å²	119.9	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-67.3	-29.8	171.3	-79	179.7	177.8	-173.5	0	113.3	K560 V561 K562 V569	K560-K564 WeakPolarHBondContact O-CB 3.27Å; K560-K564 WeakPolarHBondContact O-CG 3.36Å; K560-K564 PolarHBondContact O-N 2.64Å; V561-K564 PolarHBondContact O-N 2.86Å; K562-K564 VanDerWaalsContact C-N 3.3Å; K562-K564 PolarHBondContact O-N 2.68Å; K564-V569 PolarHBondContact O-N 2.72Å
565	Y	66.6	Low	69.2	Low	170 Å²	170	121 Å²	121	67%	0.667	60%	0.602	S	S	*	*	H	α-helix	trans	-76.6	-41.7	175.6	-154.8	-87.4	0	0	0	111.3	V561 K562 D563 K567 D568	V561-Y565 PolarHBondContact O-N 2.95Å; K562-Y565 CarbonylContact O-C 3.57Å; K562-Y565 WeakPolarHBondContact O-CA 3.44Å; K562-Y565 WeakPolarHBondContact O-CB 3.43Å; K562-Y565 PolarHBondContact O-N 3.12Å; D563-Y565 VanDerWaalsContact C-N 3.32Å; Y565-K567 VanDerWaalsContact C-N 3.28Å; Y565-K567 PolarHBondContact O-N 3.47Å; Y565-D568 PolarHBondContact O-N 3.09Å
566	Y	73.2	Confident	67.7	Low	195 Å²	195	119.2 Å²	119.2	77%	0.765	61%	0.606	S	S	*	*	H	α-helix	trans	-69.3	-21.7	175.9	-82.1	-67.2	0	0	0	114.4	K562	K562-Y566 VanDerWaalsContact O-CD2 3.31Å; K562-Y566 WeakPolarHBondContact O-CD2 3.25Å; K562-Y566 PolarHBondContact O-N 3.18Å
567	K	77	Confident	66.1	Low	158 Å²	158	126 Å²	126	69%	0.687	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	6.2	177.6	-66.8	178	178	-175.3	0	113.8	D563 Y565 V569	D563-K567 WeakPolarHBondContact O-CB 3.44Å; D563-K567 VanDerWaalsContact O-CG 3.28Å; D563-K567 WeakPolarHBondContact O-CG 3.38Å; D563-K567 PolarHBondContact O-N 3.29Å; D563-K567 VanDerWaalsContact O-N 3.12Å; Y565-K567 VanDerWaalsContact C-N 3.28Å; Y565-K567 PolarHBondContact O-N 3.47Å; K567-V569 HydrophobicContact CB-CG2 3.72Å; K567-V569 WeakPolarHBondContact O-CG2 3.4Å; K567-V569 PolarHBondContact O-N 2.84Å
568	D	58.8	Low	64.8	Low	152 Å²	152	127.9 Å²	127.9	81%	0.813	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.4	24.5	-176.6	-93.1	-24	0	0	0	115.6	Y565 R570	Y565-D568 PolarHBondContact O-N 3.09Å; D568-R570 PolarHBondContact O-N 3.08Å
569	V	63.5	Low	63.2	Low	100 Å²	100	130 Å²	130	61%	0.606	65%	0.652	S	S	*	*			trans	-77	-5.5	-176.5	-175.4	0	0	0	0	112.3	K564 K567 S571	K564-V569 PolarHBondContact O-N 2.72Å; K567-V569 HydrophobicContact CB-CG2 3.72Å; K567-V569 WeakPolarHBondContact O-CG2 3.4Å; K567-V569 PolarHBondContact O-N 2.84Å; V569-S571 PolarHBondContact O-N 2.98Å
570	R	56.5	Low	61.1	Low	155 Å²	155	131.2 Å²	131.2	59%	0.585	66%	0.66	S	S	*	*			trans	-88.6	85	178.8	-83.7	-173	159	-163.5	-5.2	112.1	D568	D568-R570 PolarHBondContact O-N 3.08Å
571	S	57.7	Low	59.2	Low	72 Å²	72	127.8 Å²	127.8	50%	0.503	66%	0.664	S	S	.	*			trans	-57.2	136.9	161	-176.2	0	0	0	0	110.7	V569 G573 K575	V569-S571 PolarHBondContact O-N 2.98Å; S571-G573 PolarHBondContact O-N 2.92Å; S571-G573 VanDerWaalsContact O-N 3.1Å; S571-K575 WeakPolarHBondContact OG-CE 3.35Å
572	A	53.4	Low	57.5	Low	105 Å²	105	131.8 Å²	131.8	87%	0.868	68%	0.682	S	S	*	*	S	Bend	trans	-74.3	98.1	175.5	0	0	0	0	0	110.8
573	G	52.6	Low	55.5	Low	50 Å²	50	133.7 Å²	133.7	52%	0.515	70%	0.698	S	S	.	*	S	Bend	trans	78.1	175.7	173.2	0	0	0	0	0	115.5	S571 K575	S571-G573 PolarHBondContact O-N 2.92Å; S571-G573 VanDerWaalsContact O-N 3.1Å; G573-K575 PolarHBondContact O-N 2.81Å
574	P	46.7	Very low	53.2	Low	135 Å²	135	138.1 Å²	138.1	88%	0.877	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-67.5	119.8	178	-14.1	29.2	0	0	0	110	S576	P574-S576 PolarHBondContact O-N 3.02Å
575	K	47.1	Very low	51.3	Low	177 Å²	177	141 Å²	141	77%	0.77	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-67.4	121.8	167.7	-68.6	-174.8	176.7	-175.9	0	108.2	S571 G573 R577	S571-K575 WeakPolarHBondContact OG-CE 3.35Å; G573-K575 PolarHBondContact O-N 2.81Å; K575-R577 PolarHBondContact O-N 3.48Å
576	S	45.6	Very low	49.9	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.2	177	45.6	0	0	0	0	110.3	P574 I578	P574-S576 PolarHBondContact O-N 3.02Å; S576-I578 PolarHBondContact O-N 3.15Å
577	R	47.4	Very low	48	Very low	218 Å²	218	140.1 Å²	140.1	82%	0.823	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	26.5	-173.4	-149.3	175.7	-169.1	158.8	0.2	113.2	K575	K575-R577 PolarHBondContact O-N 3.48Å
578	I	52.1	Low	45.9	Very low	148 Å²	148	137.3 Å²	137.3	76%	0.759	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-8.3	-162.5	-61.4	175.3	0	0	0	112.3	S576	S576-I578 PolarHBondContact O-N 3.15Å
579	L	45.5	Very low	44.8	Very low	148 Å²	148	136.6 Å²	136.6	78%	0.775	75%	0.746	S	S	*	*			trans	-130.7	43.2	179.4	-68.9	171.6	0	0	0	112.2
580	Q	39.6	Very low	43.5	Very low	163 Å²	163	140.4 Å²	140.4	76%	0.762	76%	0.758	S	S	*	*	S	Bend	trans	-99	90.6	170.8	-172.5	171.5	11.8	0	0	108.6
581	G	44	Very low	42.5	Very low	68 Å²	68	140 Å²	140	70%	0.701	77%	0.772	S	S	*	*	S	Bend	trans	143.5	28.2	176.4	0	0	0	0	0	117.5
582	I	41.2	Very low	41.3	Very low	143 Å²	143	144.4 Å²	144.4	73%	0.733	79%	0.79	S	S	*	*			trans	-134.7	96.4	170.7	-52.4	177.5	0	0	0	107.9
583	D	37.8	Very low	40.3	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	79%	0.79	S	S	*	*			trans	-81.2	159.7	172.1	-65.8	-55.6	0	0	0	110.6
584	L	33.5	Very low	39.3	Very low	167 Å²	167	144.9 Å²	144.9	87%	0.874	81%	0.806	S	S	*	*			trans	-110.1	103.4	-169	-79.4	158.7	0	0	0	111.2
585	E	37.4	Very low	38.6	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	81%	0.806	S	S	*	*			trans	-140.4	138.6	161.4	-64.5	-169.7	152.1	0	0	109.6
586	D	37.7	Very low	38	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	80%	0.804	S	S	*	*			trans	63.4	150.6	164.2	-43.8	-31.9	0	0	0	118.5
587	E	33.5	Very low	37.4	Very low	194 Å²	194	143.6 Å²	143.6	91%	0.907	81%	0.812	S	S	*	*			cis	-130.1	177.9	6.4	-73.2	180	119.3	0	0	112.5
588	S	31.8	Very low	36.8	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	81%	0.809	S	S	*	*			trans	-99.2	-162.5	-178.6	56.6	0	0	0	0	114.1
589	D	36.5	Very low	35.7	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	82%	0.815	S	S	*	*			trans	81.4	101	164.6	-49.7	-0.8	0	0	0	115.3
590	E	35.4	Very low	35.1	Very low	181 Å²	181	140.5 Å²	140.5	85%	0.846	82%	0.815	S	S	*	*				71.8	111.8	78.2	-73.1	-158	171.9	0	0	114.7
591	T	37	Very low	34.6	Very low	145 Å²	145	139.5 Å²	139.5	89%	0.89	82%	0.82	S	S	*	*				-177.9	150.4	121.6	24.3	0	0	0	0	113.5
592	D	32.6	Very low	34.1	Very low	166 Å²	166	141.4 Å²	141.4	89%	0.888	82%	0.822	S	S	*	*			trans	-61.1	162.4	-171.1	-68.6	-56.7	0	0	0	119.5
593	G	31.6	Very low	33.8	Very low	83 Å²	83	139.7 Å²	139.7	86%	0.856	82%	0.82	S	S	*	*				112	113	122.6	0	0	0	0	0	118.4
594	G	31.7	Very low	33.8	Very low	82 Å²	82	141.4 Å²	141.4	85%	0.845	82%	0.82	S	S	*	*			trans	165.7	107	166.8	0	0	0	0	0	115.1
595	I	31.4	Very low	33.8	Very low	174 Å²	174	137.6 Å²	137.6	89%	0.892	82%	0.821	S	S	*	*			trans	-98.7	137.6	-176.5	-62.9	162.1	0	0	0	110.6
596	A	34.4	Very low	33.9	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	82%	0.815	S	S	*	*				154.6	100.7	129.7	0	0	0	0	0	116.3
597	S	34	Very low	33.8	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	82%	0.815	S	S	*	*				62.9	153.7	127.2	-64.7	0	0	0	0	123.5
598	P	33.5	Very low	34.1	Very low	119 Å²	119	132.2 Å²	132.2	77%	0.773	81%	0.807	S	S	*	*			trans	-113.6	165	-146.8	41.2	-33.3	0	0	0	115.3
599	K	30.7	Very low	34.5	Very low	201 Å²	201	137.6 Å²	137.6	87%	0.874	81%	0.812	S	S	*	*			trans	-156	127.3	164.1	-110.8	171.2	-172.9	174.1	0	116
600	V	31.6	Very low	34.6	Very low	129 Å²	129	138 Å²	138	78%	0.782	81%	0.813	S	S	*	*			trans	67	115.7	152.1	-164.7	0	0	0	0	120.3
601	V	29.4	Very low	34.9	Very low	142 Å²	142	133.8 Å²	133.8	86%	0.861	80%	0.797	S	S	*	*			trans	-97	143.3	158	171	0	0	0	0	109.3
602	S	33.6	Very low	35.5	Very low	107 Å²	107	133.1 Å²	133.1	75%	0.748	80%	0.795	S	S	*	*			trans	-139.7	141.6	165.6	-176.4	0	0	0	0	110
603	P	34.3	Very low	36.2	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	78%	0.784	S	S	*	*			trans	-101.3	132.6	-163.9	36.3	-31.8	0	0	0	114.2
604	K	38.3	Very low	37.1	Very low	201 Å²	201	131.9 Å²	131.9	87%	0.874	78%	0.776	S	S	*	*			trans	-178.1	104.1	147	-102.9	153.7	-175	179	0	111.3	T606	K604-T606 PolarHBondContact O-N 3.28Å
605	G	34.7	Very low	38	Very low	87 Å²	87	133.3 Å²	133.3	90%	0.897	77%	0.771	S	S	*	*			trans	-94.5	82.3	171.8	0	0	0	0	0	111.5
606	T	39.4	Very low	38.8	Very low	112 Å²	112	129.2 Å²	129.2	69%	0.687	76%	0.755	S	S	*	*			trans	-86.5	115.7	172	-57.1	0	0	0	0	109.5	K604 L608	K604-T606 PolarHBondContact O-N 3.28Å; T606-L608 PolarHBondContact O-N 2.94Å; T606-L608 VanDerWaalsContact O-N 3.09Å
607	L	35.2	Very low	39.4	Very low	159 Å²	159	131 Å²	131	83%	0.832	76%	0.762	S	S	*	*			trans	-81.8	89.4	-177.5	-149.7	172.7	0	0	0	110.1	R609	L607-R609 PolarHBondContact O-N 2.8Å
608	L	38.4	Very low	40	Very low	140 Å²	140	130.6 Å²	130.6	73%	0.733	75%	0.75	S	S	*	*			trans	-67.3	115.2	176.7	-71.1	169	0	0	0	110.7	T606	T606-L608 PolarHBondContact O-N 2.94Å; T606-L608 VanDerWaalsContact O-N 3.09Å
609	R	40.5	Very low	40.4	Very low	212 Å²	212	132.5 Å²	132.5	80%	0.8	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-78.1	120	161.4	-77.8	-174.4	169	94.6	-2.6	108.2	L607	L607-R609 PolarHBondContact O-N 2.8Å
610	L	40.1	Very low	40.8	Very low	143 Å²	143	129.3 Å²	129.3	75%	0.749	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-75.8	129.1	173	-64.6	169	0	0	0	109.5
611	D	41.6	Very low	41.6	Very low	93 Å²	93	126.7 Å²	126.7	50%	0.497	75%	0.747	S	S	.	*	P	Polyproline II helix	trans	-76.2	122.9	168.2	-176.7	-15.5	0	0	0	108.5	S613 N614	D611-S613 PolarHBondContact O-N 2.85Å; D611-S613 VanDerWaalsContact O-N 3.08Å; D611-S613 WeakPolarHBondContact OD1-CB 3.16Å; D611-S613 PolarHBondContact OD1-N 3.17Å; D611-S613 PolarHBondContact OD1-OG 3.04Å; D611-N614 PolarHBondContact O-N 3.06Å
612	P	49.3	Very low	42.2	Very low	131 Å²	131	126.9 Å²	126.9	85%	0.851	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-9.8	178.1	28.3	-36.3	0	0	0	113.9
613	S	47.3	Very low	42.7	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-16.5	-175.8	-34.4	0	0	0	0	113.9	D611	D611-S613 PolarHBondContact O-N 2.85Å; D611-S613 VanDerWaalsContact O-N 3.08Å; D611-S613 WeakPolarHBondContact OD1-CB 3.16Å; D611-S613 PolarHBondContact OD1-N 3.17Å; D611-S613 PolarHBondContact OD1-OG 3.04Å
614	N	49.6	Very low	43.1	Very low	130 Å²	130	127.8 Å²	127.8	70%	0.695	74%	0.737	S	S	*	*			trans	-155.9	85.9	-170.9	-133.1	-7.6	0	0	0	112.9	D611	D611-N614 PolarHBondContact O-N 3.06Å
615	P	50.7	Low	43.4	Very low	112 Å²	112	123 Å²	123	73%	0.727	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-77.3	129.4	178.7	30.4	-33.1	0	0	0	111.9
616	P	47.6	Very low	43.8	Very low	88 Å²	88	124.5 Å²	124.5	57%	0.571	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.8	175.1	29.4	-33.6	0	0	0	111.7	L618	P616-L618 PolarHBondContact O-N 2.83Å
617	S	46.8	Very low	44.2	Very low	123 Å²	123	122.4 Å²	122.4	86%	0.86	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-68.7	123	170.5	52.1	0	0	0	0	110.7
618	L	46.6	Very low	44.7	Very low	112 Å²	112	117.1 Å²	117.1	59%	0.586	70%	0.696	S	S	*	*			trans	-110.2	127.2	-177.9	-83.4	141.5	0	0	0	111.5	P616 H622	P616-L618 PolarHBondContact O-N 2.83Å; L618-H622 HydrophobicContact CD2-CB 3.78Å
619	E	43.3	Very low	45.1	Very low	160 Å²	160	115.8 Å²	115.8	75%	0.748	71%	0.705	S	S	*	*			trans	-63.9	153.8	176.2	-71.1	-65.1	148.5	0	0	112.9	G621	E619-G621 PolarHBondContact O-N 2.87Å
620	P	38.9	Very low	45.6	Very low	133 Å²	133	108.1 Å²	108.1	86%	0.864	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	102.4	-179.3	-16.5	30.6	0	0	0	112
621	G	48.9	Very low	46.2	Very low	74 Å²	74	109.8 Å²	109.8	76%	0.763	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	150	-9.7	176.2	0	0	0	0	0	116	E619 V623	E619-G621 PolarHBondContact O-N 2.87Å; G621-V623 PolarHBondContact O-N 3.15Å
622	H	41.7	Very low	47.1	Very low	147 Å²	147	108.4 Å²	108.4	68%	0.681	69%	0.693	S	S	*	*			trans	-81.9	117.6	-178.6	-132.7	91.9	0	0	0	112.6	L618	L618-H622 HydrophobicContact CD2-CB 3.78Å
623	V	44	Very low	47.6	Very low	123 Å²	123	108.8 Å²	108.8	75%	0.745	69%	0.687	S	S	*	*			trans	-85.1	114.1	179	-179.7	0	0	0	0	110.5	G621	G621-V623 PolarHBondContact O-N 3.15Å
624	V	42	Very low	48.1	Very low	109 Å²	109	105.8 Å²	105.8	66%	0.661	66%	0.663	S	S	*	*			trans	-87.1	112.5	177.8	-177.2	0	0	0	0	110.5	V626	V624-V626 HydrophobicContact CG1-CG2 4.05Å; V624-V626 PolarHBondContact O-N 3.05Å
625	V	45.6	Very low	49	Very low	100 Å²	100	104.8 Å²	104.8	61%	0.606	66%	0.657	S	S	*	*			trans	-85.3	98.4	179.9	-176.5	0	0	0	0	110.7	Y645	V625-Y645 HydrophobicContact CG1-CE2 4.09Å
626	V	42.6	Very low	49.9	Very low	120 Å²	120	109 Å²	109	73%	0.727	66%	0.659	S	S	*	*			trans	-91.5	107.3	177.1	-176.1	0	0	0	0	110.6	V624 A628	V624-V626 HydrophobicContact CG1-CG2 4.05Å; V624-V626 PolarHBondContact O-N 3.05Å; V626-A628 PolarHBondContact O-N 3.18Å
627	G	47.8	Very low	51	Low	67 Å²	67	110.7 Å²	110.7	69%	0.691	66%	0.663	S	S	*	*			trans	-74.1	83.3	-179.4	0	0	0	0	0	114.1
628	A	46	Very low	51.9	Low	49 Å²	49	110.5 Å²	110.5	41%	0.405	65%	0.649	S	S	.	*			trans	-87	118.1	175.1	0	0	0	0	0	112.3	V626 S630 I634	V626-A628 PolarHBondContact O-N 3.18Å; A628-S630 PolarHBondContact O-N 2.7Å; A628-I634 HydrophobicContact CB-CD1 4.37Å; A628-I634 HydrophobicContact CB-CG1 4.39Å
629	A	46.1	Very low	52.7	Low	112 Å²	112	110.7 Å²	110.7	93%	0.926	64%	0.642	S	S	*	*	S	Bend	trans	-77.1	28.5	-171.5	0	0	0	0	0	116.2
630	S	51.4	Low	53.7	Low	51 Å²	51	110 Å²	110	36%	0.357	64%	0.638	S	S	.	*			trans	-159.7	140.3	165.5	70.1	0	0	0	0	114.1	A628 G632 I633	A628-S630 PolarHBondContact O-N 2.7Å; S630-G632 PolarHBondContact O-N 3.01Å; S630-G632 VanDerWaalsContact O-N 3.12Å; S630-I633 PolarHBondContact O-N 2.95Å; S630-I633 VanDerWaalsContact OG-CD1 3.28Å; S630-I633 WeakPolarHBondContact OG-CD1 3.47Å; S630-I633 WeakPolarHBondContact OG-CG1 3.27Å
631	K	53.4	Low	54.7	Low	177 Å²	177	109.5 Å²	109.5	77%	0.77	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-14.8	178.1	-164	173.5	-177.3	177.5	0	113.7
632	G	60.4	Low	54.8	Low	65 Å²	65	108.9 Å²	108.9	67%	0.67	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-20.7	-178.2	0	0	0	0	0	115.4	S630	S630-G632 PolarHBondContact O-N 3.01Å; S630-G632 VanDerWaalsContact O-N 3.12Å
633	I	58	Low	55.5	Low	139 Å²	139	104.6 Å²	104.6	71%	0.713	61%	0.605	S	S	*	*	S	Bend	trans	-92.2	-14.9	-174	-63.9	173.3	0	0	0	112.2	S630	S630-I633 PolarHBondContact O-N 2.95Å; S630-I633 VanDerWaalsContact OG-CD1 3.28Å; S630-I633 WeakPolarHBondContact OG-CD1 3.47Å; S630-I633 WeakPolarHBondContact OG-CG1 3.27Å
634	I	59.5	Low	55.7	Low	30 Å²	30	105.1 Å²	105.1	15%	0.154	61%	0.608	C	S	.	*	S	Bend	trans	-89.4	128.1	-172.4	-51.8	178.3	0	0	0	111.1	A628 Q638 R639 V642	A628-I634 HydrophobicContact CB-CD1 4.37Å; A628-I634 HydrophobicContact CB-CG1 4.39Å; I634-Q638 HydrophobicContact CG2-CB 4.23Å; I634-R639 HydrophobicContact CB-CG 4.34Å; I634-R639 HydrophobicContact CG2-CG 4.13Å; I634-R639 PolarHBondContact O-NE 3.06Å; I634-R639 PolarHBondContact O-NH2 2.89Å; I634-V642 HydrophobicContact CD1-CB 4.37Å; I634-V642 HydrophobicContact CD1-CG1 3.87Å; I634-V642 HydrophobicContact CD1-CG2 3.57Å; I634-V642 HydrophobicContact CG2-CG2 3.92Å
635	N	68.6	Low	55.8	Low	109 Å²	109	107.9 Å²	107.9	58%	0.583	61%	0.608	S	S	*	*			trans	-56.7	137.6	-179.9	-157.4	-10.3	0	0	0	111	N637 Q638 R639	N635-N637 PolarHBondContact O-N 2.89Å; N635-N637 VanDerWaalsContact O-N 3.08Å; N635-Q638 PolarHBondContact O-N 2.82Å; N635-R639 PolarHBondContact O-N 2.87Å
636	R	67.8	Low	55.6	Low	200 Å²	200	111.8 Å²	111.8	76%	0.755	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-54.2	-39.9	-166.5	-170	172.3	179.3	168.6	-4.1	111.7	Q638 R639	R636-Q638 VanDerWaalsContact C-N 3.27Å; R636-Q638 PolarHBondContact O-N 2.88Å; R636-R639 PolarHBondContact O-N 2.89Å
637	N	72.6	Confident	55.7	Low	125 Å²	125	109.4 Å²	109.4	67%	0.668	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-71.3	-14.3	-177.1	-49.4	13.8	0	0	0	113.8	N635 H640	N635-N637 PolarHBondContact O-N 2.89Å; N635-N637 VanDerWaalsContact O-N 3.08Å; N637-H640 PolarHBondContact O-CE1 3.39Å; N637-H640 PolarHBondContact O-ND1 3.16Å
638	Q	63.9	Low	55.5	Low	119 Å²	119	113 Å²	113	56%	0.556	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-108.1	-7	-178.9	-70.4	-179.5	-15.6	0	0	113.3	I634 N635 R636 H640 N641	I634-Q638 HydrophobicContact CG2-CB 4.23Å; N635-Q638 PolarHBondContact O-N 2.82Å; R636-Q638 VanDerWaalsContact C-N 3.27Å; R636-Q638 PolarHBondContact O-N 2.88Å; Q638-H640 PolarHBondContact O-N 3.32Å; Q638-N641 PolarHBondContact O-N 3.42Å
639	R	65	Low	55.3	Low	115 Å²	115	120 Å²	120	43%	0.434	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-61.4	-27	-176.1	-69.2	179.4	-179.7	-176.8	-2.7	114.2	I634 N635 R636 N641 V642	I634-R639 HydrophobicContact CB-CG 4.34Å; I634-R639 HydrophobicContact CG2-CG 4.13Å; I634-R639 PolarHBondContact O-NE 3.06Å; I634-R639 PolarHBondContact O-NH2 2.89Å; N635-R639 PolarHBondContact O-N 2.87Å; R636-R639 PolarHBondContact O-N 2.89Å; R639-N641 VanDerWaalsContact C-N 3.29Å; R639-N641 PolarHBondContact O-N 2.85Å; R639-V642 PolarHBondContact O-N 3.27Å
640	H	63.6	Low	55.8	Low	145 Å²	145	119.2 Å²	119.2	67%	0.671	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-72.9	-20	177.6	64	-97.1	0	0	0	113.3	N637 Q638	N637-H640 PolarHBondContact O-CE1 3.39Å; N637-H640 PolarHBondContact O-ND1 3.16Å; Q638-H640 PolarHBondContact O-N 3.32Å
641	N	60.1	Low	56.1	Low	124 Å²	124	121.9 Å²	121.9	66%	0.663	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-92.1	2.6	176.8	-64.4	-35.8	0	0	0	113	Q638 R639 G643	Q638-N641 PolarHBondContact O-N 3.42Å; R639-N641 VanDerWaalsContact C-N 3.29Å; R639-N641 PolarHBondContact O-N 2.85Å; N641-G643 PolarHBondContact O-N 2.78Å
642	V	51.5	Low	56.4	Low	61 Å²	61	117.2 Å²	117.2	37%	0.37	62%	0.621	S	S	.	*			trans	-88.6	100.2	-177.4	-175.7	0	0	0	0	109.6	I634 R639 V644	I634-V642 HydrophobicContact CD1-CB 4.37Å; I634-V642 HydrophobicContact CD1-CG1 3.87Å; I634-V642 HydrophobicContact CD1-CG2 3.57Å; I634-V642 HydrophobicContact CG2-CG2 3.92Å; R639-V642 PolarHBondContact O-N 3.27Å; V642-V644 PolarHBondContact O-N 3.34Å; V642-V644 VanDerWaalsContact O-N 3.15Å
643	G	55.2	Low	56.5	Low	57 Å²	57	119 Å²	119	59%	0.588	62%	0.621	S	S	*	*			trans	-59.8	115.3	162.3	0	0	0	0	0	109.7	N641 Y645	N641-G643 PolarHBondContact O-N 2.78Å; G643-Y645 PolarHBondContact O-N 3.29Å
644	V	48.8	Very low	56.6	Low	134 Å²	134	119.1 Å²	119.1	81%	0.812	62%	0.617	S	S	*	*			trans	-68.4	100.7	169.4	177.9	0	0	0	0	107	V642 Q646	V642-V644 PolarHBondContact O-N 3.34Å; V642-V644 VanDerWaalsContact O-N 3.15Å; V644-Q646 PolarHBondContact O-N 3.2Å
645	Y	43.4	Very low	57	Low	167 Å²	167	123.1 Å²	123.1	66%	0.655	64%	0.638	S	S	*	*			trans	-58.6	114.1	164.8	-78.1	-85.9	0	0	0	107.6	V625 G643 S647	V625-Y645 HydrophobicContact CG1-CE2 4.09Å; G643-Y645 PolarHBondContact O-N 3.29Å; Y645-S647 PolarHBondContact O-N 3.2Å
646	Q	42.7	Very low	57	Low	182 Å²	182	129.1 Å²	129.1	85%	0.85	65%	0.653	S	S	*	*			trans	-71.2	71.9	165.7	-160.2	161.5	7.1	0	0	107	V644 V648	V644-Q646 PolarHBondContact O-N 3.2Å; Q646-V648 PolarHBondContact O-N 2.88Å
647	S	44	Very low	57.5	Low	69 Å²	69	123.5 Å²	123.5	48%	0.483	64%	0.636	S	S	.	*			trans	-46.1	133.1	169	54.1	0	0	0	0	107.3	Y645 Y649	Y645-S647 PolarHBondContact O-N 3.2Å; S647-Y649 WeakPolarHBondContact O-CD2 3.3Å; S647-Y649 PolarHBondContact O-N 3.39Å
648	V	44.1	Very low	58	Low	144 Å²	144	120.9 Å²	120.9	87%	0.873	63%	0.625	S	S	*	*			trans	-64.3	83.8	-176.3	-174.9	0	0	0	0	108.9	Q646 S650	Q646-V648 PolarHBondContact O-N 2.88Å; V648-S650 PolarHBondContact O-N 3.44Å
649	Y	41.7	Very low	58.9	Low	194 Å²	194	121.6 Å²	121.6	76%	0.761	63%	0.632	S	S	*	*			trans	-54.9	124.8	159.3	-72.6	-82.7	0	0	0	104.8	S647	S647-Y649 WeakPolarHBondContact O-CD2 3.3Å; S647-Y649 PolarHBondContact O-N 3.39Å
650	S	56.2	Low	59.7	Low	96 Å²	96	123.1 Å²	123.1	67%	0.671	65%	0.645	S	S	*	*			trans	-49	130.6	168.9	47.4	0	0	0	0	107.6	V648 N652	V648-S650 PolarHBondContact O-N 3.44Å; S650-N652 PolarHBondContact O-N 2.92Å
651	P	56.7	Low	60.6	Low	107 Å²	107	119.2 Å²	119.2	70%	0.695	63%	0.628	S	S	*	*			trans	-45.6	137.2	177.7	-28.8	34.6	0	0	0	109.7	P653	P651-P653 VanDerWaalsContact O-N 3.08Å
652	N	61.7	Low	61.6	Low	79 Å²	79	117 Å²	117	42%	0.422	62%	0.616	S	S	.	*			trans	-51.9	122.6	-176	160.6	37.1	0	0	0	107.8	S650 F654 D655	S650-N652 PolarHBondContact O-N 2.92Å; N652-F654 PolarHBondContact O-N 3.18Å; N652-F654 WeakPolarHBondContact OD1-CD2 3.12Å; N652-F654 PolarHBondContact OD1-N 3.38Å; N652-D655 WeakPolarHBondContact CB-OD1 3.39Å; N652-D655 PolarHBondContact ND2-OD1 3.43Å; N652-D655 WeakPolarHBondContact O-CB 3.3Å; N652-D655 PolarHBondContact O-N 2.79Å
653	P	61.1	Low	63.1	Low	102 Å²	102	120.3 Å²	120.3	66%	0.662	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-12.8	-171.8	23.8	-34.1	0	0	0	112.7	P651	P651-P653 VanDerWaalsContact O-N 3.08Å
654	F	60.1	Low	64.5	Low	142 Å²	142	122.7 Å²	122.7	62%	0.623	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-4.3	175.9	-50	-65.7	0	0	0	114.6	N652 R656 M657	N652-F654 PolarHBondContact O-N 3.18Å; N652-F654 WeakPolarHBondContact OD1-CD2 3.12Å; N652-F654 PolarHBondContact OD1-N 3.38Å; F654-R656 PolarHBondContact O-N 2.84Å; F654-M657 HydrophobicContact CB-CG 4.39Å; F654-M657 HydrophobicContact CD1-CG 4.15Å; F654-M657 PolarHBondContact O-N 2.89Å
655	D	69.2	Low	66	Low	114 Å²	114	123.6 Å²	123.6	61%	0.61	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-6.4	177.5	-77.4	-3.6	0	0	0	114	N652	N652-D655 WeakPolarHBondContact CB-OD1 3.39Å; N652-D655 PolarHBondContact ND2-OD1 3.43Å; N652-D655 WeakPolarHBondContact O-CB 3.3Å; N652-D655 PolarHBondContact O-N 2.79Å
656	R	68.1	Low	68	Low	236 Å²	236	122.1 Å²	122.1	89%	0.891	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	5.7	176.7	-64.1	-174.2	-179.3	173.7	0.7	113.9	F654 T658	F654-R656 PolarHBondContact O-N 2.84Å; R656-T658 PolarHBondContact O-N 2.83Å
657	M	77	Confident	70.1	Confident	82 Å²	82	117.6 Å²	117.6	40%	0.404	59%	0.585	S	S	.	*			trans	-76.4	119.4	170.8	-73.3	-72	-65	0	0	108.5	F654 D661 L662	F654-M657 HydrophobicContact CB-CG 4.39Å; F654-M657 HydrophobicContact CD1-CG 4.15Å; F654-M657 PolarHBondContact O-N 2.89Å; M657-D661 HydrophobicContact CE-CB 3.57Å; M657-D661 HydrophobicContact SD-CB 3.99Å; M657-L662 HydrophobicContact CE-CD2 4.18Å; M657-L662 HydrophobicContact CE-CG 4.28Å
658	T	83.1	Confident	72	Confident	70 Å²	70	115.2 Å²	115.2	43%	0.429	57%	0.567	S	S	.	*			trans	-81.8	163.6	170.8	64.4	0	0	0	0	110.8	R656 E660 D661 L662	R656-T658 PolarHBondContact O-N 2.83Å; T658-E660 PolarHBondContact O-N 2.83Å; T658-D661 WeakPolarHBondContact CB-OD2 3.49Å; T658-D661 PolarHBondContact N-OD2 2.93Å; T658-D661 WeakPolarHBondContact O-CB 3.45Å; T658-D661 PolarHBondContact O-N 3.2Å; T658-D661 VanDerWaalsContact O-N 3.12Å; T658-D661 VanDerWaalsContact OG1-CG 3.24Å; T658-D661 PolarHBondContact OG1-N 3.15Å; T658-D661 PolarHBondContact OG1-OD2 3.38Å; T658-L662 PolarHBondContact O-N 3.29Å; T658-L662 VanDerWaalsContact O-N 3.15Å
659	D	83.3	Confident	73.8	Confident	133 Å²	133	111.8 Å²	111.8	71%	0.711	55%	0.546	S	S	*	.	H	α-helix	trans	-59	-32.3	171.6	-72.7	-39.9	0	0	0	111.6	L662 E663	D659-L662 WeakPolarHBondContact O-CB 3.22Å; D659-L662 PolarHBondContact O-N 2.97Å; D659-E663 WeakPolarHBondContact O-CG 3.21Å; D659-E663 PolarHBondContact O-N 2.83Å
660	E	82.9	Confident	75.8	Confident	148 Å²	148	107.8 Å²	107.8	69%	0.692	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-39.1	174.9	-168.6	173.9	-172.2	0	0	111.9	T658 L662 E663 R664	T658-E660 PolarHBondContact O-N 2.83Å; E660-L662 VanDerWaalsContact C-N 3.33Å; E660-L662 PolarHBondContact O-N 3.34Å; E660-E663 PolarHBondContact O-N 3.01Å; E660-R664 WeakPolarHBondContact O-CB 3.5Å; E660-R664 PolarHBondContact O-N 2.98Å
661	D	82	Confident	77.2	Confident	62 Å²	62	105.6 Å²	105.6	33%	0.332	51%	0.511	S	S	.	.	H	α-helix	trans	-65.2	-36.6	172.8	-61.9	-59.9	0	0	0	111.9	M657 T658 Y665	M657-D661 HydrophobicContact CE-CB 3.57Å; M657-D661 HydrophobicContact SD-CB 3.99Å; T658-D661 WeakPolarHBondContact CB-OD2 3.49Å; T658-D661 PolarHBondContact N-OD2 2.93Å; T658-D661 WeakPolarHBondContact O-CB 3.45Å; T658-D661 PolarHBondContact O-N 3.2Å; T658-D661 VanDerWaalsContact O-N 3.12Å; T658-D661 VanDerWaalsContact OG1-CG 3.24Å; T658-D661 PolarHBondContact OG1-N 3.15Å; T658-D661 PolarHBondContact OG1-OD2 3.38Å; D661-Y665 WeakPolarHBondContact O-CB 3.49Å; D661-Y665 PolarHBondContact O-N 3.15Å
662	L	80.7	Confident	78.3	Confident	78 Å²	78	107.2 Å²	107.2	41%	0.408	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-37	176	-75	167.6	0	0	0	112.3	M657 T658 D659 E660 Y665 K666	M657-L662 HydrophobicContact CE-CD2 4.18Å; M657-L662 HydrophobicContact CE-CG 4.28Å; T658-L662 PolarHBondContact O-N 3.29Å; T658-L662 VanDerWaalsContact O-N 3.15Å; D659-L662 WeakPolarHBondContact O-CB 3.22Å; D659-L662 PolarHBondContact O-N 2.97Å; E660-L662 VanDerWaalsContact C-N 3.33Å; E660-L662 PolarHBondContact O-N 3.34Å; L662-Y665 PolarHBondContact O-N 2.76Å; L662-K666 WeakPolarHBondContact O-CG 3.44Å; L662-K666 PolarHBondContact O-N 3.49Å
663	E	84.1	Confident	79.2	Confident	131 Å²	131	107.7 Å²	107.7	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-68.2	-48	173.4	-72.7	-172.2	166	0	0	111.7	D659 E660 Y665 K666 E667	D659-E663 WeakPolarHBondContact O-CG 3.21Å; D659-E663 PolarHBondContact O-N 2.83Å; E660-E663 PolarHBondContact O-N 3.01Å; E663-Y665 PolarHBondContact O-N 2.97Å; E663-K666 WeakPolarHBondContact O-CB 3.45Å; E663-K666 PolarHBondContact O-N 3.41Å; E663-K666 VanDerWaalsContact O-N 3.1Å; E663-E667 PolarHBondContact O-N 3.49Å
664	R	84.5	Confident	80.3	Confident	107 Å²	107	109.4 Å²	109.4	40%	0.404	52%	0.519	S	S	.	.	H	α-helix	trans	-54.9	-39.8	171.6	-103.4	176.7	156.3	-160.1	-6.2	112.3	E660 N668 L679 E683	E660-R664 WeakPolarHBondContact O-CB 3.5Å; E660-R664 PolarHBondContact O-N 2.98Å; R664-N668 VanDerWaalsContact O-CB 3.31Å; R664-N668 WeakPolarHBondContact O-CB 3.44Å; R664-N668 PolarHBondContact O-N 3.44Å; R664-N668 PolarHBondContact O-ND2 3.08Å; R664-L679 HydrophobicContact CG-CD1 4.1Å; R664-E683 IonicContact CZ-OE1 3.98Å; R664-E683 IonicContact NH2-OE1 2.97Å; R664-E683 PolarHBondContact NH2-OE1 3.45Å; R664-E683 IonicContact NH2-OE2 2.63Å; R664-E683 PolarHBondContact NH2-OE2 3Å
665	Y	79.9	Confident	81	Confident	153 Å²	153	106 Å²	106	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-65.4	-45.6	175.9	-176.6	-99	0	0	0	112.1	D661 L662 E663 E667 N668 V669	D661-Y665 WeakPolarHBondContact O-CB 3.49Å; D661-Y665 PolarHBondContact O-N 3.15Å; L662-Y665 PolarHBondContact O-N 2.76Å; E663-Y665 PolarHBondContact O-N 2.97Å; Y665-E667 PolarHBondContact O-N 3.3Å; Y665-N668 PolarHBondContact O-N 3.47Å; Y665-V669 HydrophobicContact CD1-CG2 4.16Å; Y665-V669 HydrophobicContact CE1-CG2 3.72Å; Y665-V669 HydrophobicContact CE2-CG2 4.34Å; Y665-V669 WeakPolarHBondContact O-CG2 3.21Å; Y665-V669 PolarHBondContact O-N 2.93Å
666	K	84.9	Confident	81.5	Confident	135 Å²	135	105 Å²	105	59%	0.587	52%	0.518	S	S	*	.	H	α-helix	trans	-58.8	-46.9	174.7	-73.8	169.1	-175.9	165.8	0	111.7	L662 E663 N668 V669 E670	L662-K666 WeakPolarHBondContact O-CG 3.44Å; L662-K666 PolarHBondContact O-N 3.49Å; E663-K666 WeakPolarHBondContact O-CB 3.45Å; E663-K666 PolarHBondContact O-N 3.41Å; E663-K666 VanDerWaalsContact O-N 3.1Å; K666-N668 VanDerWaalsContact C-N 3.32Å; K666-N668 PolarHBondContact O-N 3.3Å; K666-V669 PolarHBondContact O-N 3.05Å; K666-V669 VanDerWaalsContact O-N 3.16Å; K666-E670 PolarHBondContact O-N 3.19Å
667	E	86.9	Confident	82	Confident	87 Å²	87	95.7 Å²	95.7	41%	0.407	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-36.7	-179.8	-148.1	-166.8	146.8	0	0	111.8	E663 Y665 E670 R671 L679	E663-E667 PolarHBondContact O-N 3.49Å; Y665-E667 PolarHBondContact O-N 3.3Å; E667-E670 PolarHBondContact O-N 3.45Å; E667-R671 VanDerWaalsContact CG-NH1 3.35Å; E667-R671 PolarHBondContact O-N 3.43Å; E667-R671 IonicContact OE1-CZ 2.76Å; E667-R671 VanDerWaalsContact OE1-CZ 3.22Å; E667-R671 IonicContact OE1-NH1 2.71Å; E667-R671 PolarHBondContact OE1-NH1 2.99Å; E667-R671 IonicContact OE1-NH2 3.31Å; E667-R671 PolarHBondContact OE1-NH2 3.08Å; E667-L679 HydrophobicContact CB-CD1 4.3Å
668	N	83.6	Confident	82	Confident	20 Å²	20	92 Å²	92	11%	0.107	47%	0.471	C	S	.	.	H	α-helix	trans	-67.9	-36.5	172.5	-85.5	-31.3	0	0	0	113.3	R664 Y665 K666 K672 S678 L679	R664-N668 VanDerWaalsContact O-CB 3.31Å; R664-N668 WeakPolarHBondContact O-CB 3.44Å; R664-N668 PolarHBondContact O-N 3.44Å; R664-N668 PolarHBondContact O-ND2 3.08Å; Y665-N668 PolarHBondContact O-N 3.47Å; K666-N668 VanDerWaalsContact C-N 3.32Å; K666-N668 PolarHBondContact O-N 3.3Å; N668-K672 WeakPolarHBondContact O-CB 3.23Å; N668-K672 WeakPolarHBondContact O-CG 3.18Å; N668-K672 PolarHBondContact O-N 3.48Å; N668-S678 WeakPolarHBondContact OD1-CA 3.23Å; N668-S678 WeakPolarHBondContact OD1-CB 3.38Å; N668-L679 WeakPolarHBondContact OD1-CB 3.29Å; N668-L679 PolarHBondContact OD1-N 2.94Å
669	V	82.2	Confident	81.9	Confident	72 Å²	72	89.8 Å²	89.8	44%	0.436	46%	0.456	S	S	.	.	H	α-helix	trans	-66.8	-42	173.2	169.4	0	0	0	0	110.5	Y665 K666 K672 A673	Y665-V669 HydrophobicContact CD1-CG2 4.16Å; Y665-V669 HydrophobicContact CE1-CG2 3.72Å; Y665-V669 HydrophobicContact CE2-CG2 4.34Å; Y665-V669 WeakPolarHBondContact O-CG2 3.21Å; Y665-V669 PolarHBondContact O-N 2.93Å; K666-V669 PolarHBondContact O-N 3.05Å; K666-V669 VanDerWaalsContact O-N 3.16Å; V669-K672 PolarHBondContact O-N 2.97Å; V669-A673 WeakPolarHBondContact O-CB 3.48Å; V669-A673 PolarHBondContact O-N 2.76Å
670	E	83.7	Confident	81.6	Confident	109 Å²	109	89.9 Å²	89.9	51%	0.509	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-43.6	174.7	-77.7	-161.2	-158.3	0	0	113.4	K666 E667 A673 K674	K666-E670 PolarHBondContact O-N 3.19Å; E667-E670 PolarHBondContact O-N 3.45Å; E670-A673 PolarHBondContact O-N 3.38Å; E670-K674 WeakPolarHBondContact O-CB 3.49Å; E670-K674 WeakPolarHBondContact O-CD 3.49Å; E670-K674 WeakPolarHBondContact O-CG 3.41Å; E670-K674 PolarHBondContact O-N 2.8Å; E670-K674 IonicContact OE2-NZ 3.18Å; E670-K674 PolarHBondContact OE2-NZ 2.84Å
671	R	84.8	Confident	81.4	Confident	50 Å²	50	87.4 Å²	87.4	19%	0.189	44%	0.441	C	S	.	.	H	α-helix	trans	-60.2	-45.1	174.1	-82.4	-163.2	-173.9	63.7	2.6	111.1	E667 A673 K674 G675 L676 P677 E682	E667-R671 VanDerWaalsContact CG-NH1 3.35Å; E667-R671 PolarHBondContact O-N 3.43Å; E667-R671 IonicContact OE1-CZ 2.76Å; E667-R671 VanDerWaalsContact OE1-CZ 3.22Å; E667-R671 IonicContact OE1-NH1 2.71Å; E667-R671 PolarHBondContact OE1-NH1 2.99Å; E667-R671 IonicContact OE1-NH2 3.31Å; E667-R671 PolarHBondContact OE1-NH2 3.08Å; R671-A673 VanDerWaalsContact C-N 3.35Å; R671-A673 PolarHBondContact O-N 3.2Å; R671-K674 CarbonylContact O-C 3.59Å; R671-K674 WeakPolarHBondContact O-CA 3.25Å; R671-K674 PolarHBondContact O-N 3.46Å; R671-G675 PolarHBondContact O-N 3.4Å; R671-L676 HydrophobicContact CB-CB 4.04Å; R671-L676 HydrophobicContact CG-CB 4.17Å; R671-L676 HydrophobicContact CG-CD1 4.48Å; R671-L676 PolarHBondContact O-N 3.16Å; R671-P677 WeakPolarHBondContact CD-O 3.38Å; R671-E682 IonicContact NE-OE2 3.5Å
672	K	79.4	Confident	81.3	Confident	142 Å²	142	89.6 Å²	89.6	62%	0.617	45%	0.449	S	S	*	.	H	α-helix	trans	-62.2	-38.4	175.6	-78.4	179.9	176.1	173.7	0	112.8	N668 V669 K674 G675	N668-K672 WeakPolarHBondContact O-CB 3.23Å; N668-K672 WeakPolarHBondContact O-CG 3.18Å; N668-K672 PolarHBondContact O-N 3.48Å; V669-K672 PolarHBondContact O-N 2.97Å; K672-K674 VanDerWaalsContact C-N 3.28Å; K672-K674 PolarHBondContact O-N 2.76Å; K672-G675 PolarHBondContact O-N 2.78Å
673	A	81.7	Confident	81.3	Confident	89 Å²	89	89 Å²	89	74%	0.736	44%	0.444	S	S	*	.	H	α-helix	trans	-65.7	-30.4	173.5	0	0	0	0	0	113	V669 E670 R671	V669-A673 WeakPolarHBondContact O-CB 3.48Å; V669-A673 PolarHBondContact O-N 2.76Å; E670-A673 PolarHBondContact O-N 3.38Å; R671-A673 VanDerWaalsContact C-N 3.35Å; R671-A673 PolarHBondContact O-N 3.2Å
674	K	84.4	Confident	81	Confident	137 Å²	137	85 Å²	85	60%	0.596	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.3	174.7	-68.5	162	-177.6	158.1	0	113.6	E670 R671 K672 L676	E670-K674 WeakPolarHBondContact O-CB 3.49Å; E670-K674 WeakPolarHBondContact O-CD 3.49Å; E670-K674 WeakPolarHBondContact O-CG 3.41Å; E670-K674 PolarHBondContact O-N 2.8Å; E670-K674 IonicContact OE2-NZ 3.18Å; E670-K674 PolarHBondContact OE2-NZ 2.84Å; R671-K674 CarbonylContact O-C 3.59Å; R671-K674 WeakPolarHBondContact O-CA 3.25Å; R671-K674 PolarHBondContact O-N 3.46Å; K672-K674 VanDerWaalsContact C-N 3.28Å; K672-K674 PolarHBondContact O-N 2.76Å; K674-L676 VanDerWaalsContact C-N 3.26Å; K674-L676 HydrophobicContact CB-CD1 4.03Å; K674-L676 HydrophobicContact CB-CG 4.29Å; K674-L676 PolarHBondContact O-N 3.15Å
675	G	75.4	Confident	80.9	Confident	71 Å²	71	87.6 Å²	87.6	73%	0.732	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	15.3	-176.5	0	0	0	0	0	114.9	R671 K672	R671-G675 PolarHBondContact O-N 3.4Å; K672-G675 PolarHBondContact O-N 2.78Å
676	L	79.2	Confident	81.1	Confident	93 Å²	93	83.1 Å²	83.1	49%	0.487	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-87.6	154.5	177.8	-68.3	165.4	0	0	0	111	R671 K674	R671-L676 HydrophobicContact CB-CB 4.04Å; R671-L676 HydrophobicContact CG-CB 4.17Å; R671-L676 HydrophobicContact CG-CD1 4.48Å; R671-L676 PolarHBondContact O-N 3.16Å; K674-L676 VanDerWaalsContact C-N 3.26Å; K674-L676 HydrophobicContact CB-CD1 4.03Å; K674-L676 HydrophobicContact CB-CG 4.29Å; K674-L676 PolarHBondContact O-N 3.15Å
677	P	78	Confident	81	Confident	41 Å²	41	84.7 Å²	84.7	27%	0.266	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-53.2	153.8	170.7	-24.2	34.5	0	0	0	112	R671 E681	R671-P677 WeakPolarHBondContact CD-O 3.38Å; P677-E681 WeakPolarHBondContact CA-OE2 3.38Å; P677-E681 HydrophobicContact CB-CB 4.1Å; P677-E681 WeakPolarHBondContact CB-OE2 3.43Å
678	S	78.1	Confident	80.8	Confident	4 Å²	4	85.3 Å²	85.3	3%	0.028	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-71.4	159.2	169.3	64.1	0	0	0	0	111.1	N668 E680 E681 E682	N668-S678 WeakPolarHBondContact OD1-CA 3.23Å; N668-S678 WeakPolarHBondContact OD1-CB 3.38Å; S678-E680 PolarHBondContact O-N 3.22Å; S678-E681 WeakPolarHBondContact O-CB 3.33Å; S678-E681 PolarHBondContact O-N 3.21Å; S678-E681 WeakPolarHBondContact OG-CG 3.27Å; S678-E681 PolarHBondContact OG-N 3.5Å; S678-E681 VanDerWaalsContact OG-N 3.14Å; S678-E682 PolarHBondContact O-N 3.01Å
679	L	79.1	Confident	80.7	Confident	23 Å²	23	88.5 Å²	88.5	12%	0.12	46%	0.459	C	S	.	.	H	α-helix	trans	-53.2	-37.8	168.8	-74.1	167.4	0	0	0	111.4	R664 E667 N668 E681 E682 E683	R664-L679 HydrophobicContact CG-CD1 4.1Å; E667-L679 HydrophobicContact CB-CD1 4.3Å; N668-L679 WeakPolarHBondContact OD1-CB 3.29Å; N668-L679 PolarHBondContact OD1-N 2.94Å; L679-E681 PolarHBondContact O-N 3.32Å; L679-E682 PolarHBondContact O-N 2.63Å; L679-E683 VanDerWaalsContact O-CB 3.28Å; L679-E683 WeakPolarHBondContact O-CB 3.47Å; L679-E683 VanDerWaalsContact O-CG 3.31Å; L679-E683 WeakPolarHBondContact O-CG 3.35Å; L679-E683 PolarHBondContact O-N 3.01Å
680	E	77.9	Confident	80.7	Confident	135 Å²	135	91.4 Å²	91.4	63%	0.631	47%	0.468	S	S	*	.	H	α-helix	trans	-65.6	-36.8	176.9	-60.3	176.4	142.1	0	0	112.5	S678 A684	S678-E680 PolarHBondContact O-N 3.22Å; E680-A684 WeakPolarHBondContact O-CB 3.34Å; E680-A684 PolarHBondContact O-N 3.5Å
681	E	78.9	Confident	80.7	Confident	97 Å²	97	88.9 Å²	88.9	45%	0.453	47%	0.465	S	S	.	.	H	α-helix	trans	-71.7	-36.3	174	-75.3	175.3	-176.2	0	0	111.8	P677 S678 L679 R685	P677-E681 WeakPolarHBondContact CA-OE2 3.38Å; P677-E681 HydrophobicContact CB-CB 4.1Å; P677-E681 WeakPolarHBondContact CB-OE2 3.43Å; S678-E681 WeakPolarHBondContact O-CB 3.33Å; S678-E681 PolarHBondContact O-N 3.21Å; S678-E681 WeakPolarHBondContact OG-CG 3.27Å; S678-E681 PolarHBondContact OG-N 3.5Å; S678-E681 VanDerWaalsContact OG-N 3.14Å; L679-E681 PolarHBondContact O-N 3.32Å; E681-R685 WeakPolarHBondContact O-CB 3.44Å; E681-R685 WeakPolarHBondContact O-CG 3.43Å; E681-R685 PolarHBondContact O-N 3.42Å
682	E	80.6	Confident	80.6	Confident	107 Å²	107	93.8 Å²	93.8	50%	0.5	48%	0.484	S	S	.	.	H	α-helix	trans	-70.4	-44	177.3	-162.8	159.5	-142.7	0	0	111.1	R671 S678 L679 R685 A686	R671-E682 IonicContact NE-OE2 3.5Å; S678-E682 PolarHBondContact O-N 3.01Å; L679-E682 PolarHBondContact O-N 2.63Å; E682-R685 PolarHBondContact O-N 2.92Å; E682-A686 WeakPolarHBondContact O-CB 3.26Å; E682-A686 PolarHBondContact O-N 3.47Å
683	E	80.2	Confident	80.8	Confident	67 Å²	67	92.7 Å²	92.7	31%	0.313	48%	0.481	S	S	.	.	H	α-helix	trans	-64.8	-37.6	171.5	-75	172.5	-151.5	0	0	112.4	R664 L679 A686 R687	R664-E683 IonicContact CZ-OE1 3.98Å; R664-E683 IonicContact NH2-OE1 2.97Å; R664-E683 PolarHBondContact NH2-OE1 3.45Å; R664-E683 IonicContact NH2-OE2 2.63Å; R664-E683 PolarHBondContact NH2-OE2 3Å; L679-E683 VanDerWaalsContact O-CB 3.28Å; L679-E683 WeakPolarHBondContact O-CB 3.47Å; L679-E683 VanDerWaalsContact O-CG 3.31Å; L679-E683 WeakPolarHBondContact O-CG 3.35Å; L679-E683 PolarHBondContact O-N 3.01Å; E683-A686 PolarHBondContact O-N 2.97Å; E683-R687 WeakPolarHBondContact O-CB 3.46Å; E683-R687 WeakPolarHBondContact O-CG 3.47Å; E683-R687 PolarHBondContact O-N 3.02Å
684	A	78	Confident	80.8	Confident	45 Å²	45	91.2 Å²	91.2	37%	0.372	47%	0.469	S	S	.	.	H	α-helix	trans	-66.6	-41.3	173.9	0	0	0	0	0	111.8	E680 R687 I688	E680-A684 WeakPolarHBondContact O-CB 3.34Å; E680-A684 PolarHBondContact O-N 3.5Å; A684-R687 PolarHBondContact O-N 3.01Å; A684-I688 WeakPolarHBondContact O-CD1 3.48Å; A684-I688 VanDerWaalsContact O-CG1 3.27Å; A684-I688 WeakPolarHBondContact O-CG1 3.3Å; A684-I688 PolarHBondContact O-N 3.41Å
685	R	82.2	Confident	80.8	Confident	163 Å²	163	89.7 Å²	89.7	62%	0.615	47%	0.471	S	S	*	.	H	α-helix	trans	-63.5	-44.2	173.3	-74.2	169.6	-170.9	-154.8	5.9	111.3	E681 E682 R687 I688 E689	E681-R685 WeakPolarHBondContact O-CB 3.44Å; E681-R685 WeakPolarHBondContact O-CG 3.43Å; E681-R685 PolarHBondContact O-N 3.42Å; E682-R685 PolarHBondContact O-N 2.92Å; R685-R687 PolarHBondContact O-N 3.49Å; R685-I688 PolarHBondContact O-N 3.35Å; R685-E689 PolarHBondContact O-N 3.34Å
686	A	84.6	Confident	81.2	Confident	58 Å²	58	90 Å²	90	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-59.7	-45.6	175.9	0	0	0	0	0	111.8	E682 E683 I688 E689 E690	E682-A686 WeakPolarHBondContact O-CB 3.26Å; E682-A686 PolarHBondContact O-N 3.47Å; E683-A686 PolarHBondContact O-N 2.97Å; A686-I688 PolarHBondContact O-N 2.64Å; A686-E689 PolarHBondContact O-N 3.15Å; A686-E690 WeakPolarHBondContact O-CB 3.47Å; A686-E690 PolarHBondContact O-N 2.98Å
687	R	82	Confident	81.5	Confident	169 Å²	169	89.8 Å²	89.8	64%	0.638	46%	0.461	S	S	*	.	H	α-helix	trans	-64.5	-35.5	175.4	-77	-178.8	-179.1	150.7	6.6	113.7	E683 A684 R685 A691	E683-R687 WeakPolarHBondContact O-CB 3.46Å; E683-R687 WeakPolarHBondContact O-CG 3.47Å; E683-R687 PolarHBondContact O-N 3.02Å; A684-R687 PolarHBondContact O-N 3.01Å; R685-R687 PolarHBondContact O-N 3.49Å; R687-A691 WeakPolarHBondContact O-CB 3.35Å; R687-A691 PolarHBondContact O-N 2.69Å
688	I	82.4	Confident	81.5	Confident	100 Å²	100	90.1 Å²	90.1	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-67.6	-39.5	175.2	-71.6	164.6	0	0	0	110.4	A684 R685 A686 R692	A684-I688 WeakPolarHBondContact O-CD1 3.48Å; A684-I688 VanDerWaalsContact O-CG1 3.27Å; A684-I688 WeakPolarHBondContact O-CG1 3.3Å; A684-I688 PolarHBondContact O-N 3.41Å; R685-I688 PolarHBondContact O-N 3.35Å; A686-I688 PolarHBondContact O-N 2.64Å; I688-R692 WeakPolarHBondContact O-CG 3.27Å; I688-R692 PolarHBondContact O-N 2.92Å
689	E	82.8	Confident	81.7	Confident	86 Å²	86	97.5 Å²	97.5	40%	0.402	49%	0.494	S	S	.	.	H	α-helix	trans	-74.5	-38.9	179	-162.6	55.5	-149.1	0	0	112.1	R685 A686 A691 R692 Q693	R685-E689 PolarHBondContact O-N 3.34Å; A686-E689 PolarHBondContact O-N 3.15Å; E689-A691 VanDerWaalsContact C-N 3.35Å; E689-A691 PolarHBondContact O-N 3.28Å; E689-R692 WeakPolarHBondContact O-CB 3.39Å; E689-R692 PolarHBondContact O-N 3.15Å; E689-R692 WeakPolarHBondContact OE2-CD 3.48Å; E689-R692 IonicContact OE2-NH1 3.4Å; E689-R692 PolarHBondContact OE2-NH1 3.02Å; E689-Q693 WeakPolarHBondContact O-CG 3.44Å; E689-Q693 PolarHBondContact O-N 2.87Å
690	E	82.3	Confident	81.8	Confident	133 Å²	133	102.1 Å²	102.1	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-59.3	-44.2	169.4	-174.6	-176.5	-167.6	0	0	111.1	A686 R692 Q693 A694	A686-E690 WeakPolarHBondContact O-CB 3.47Å; A686-E690 PolarHBondContact O-N 2.98Å; E690-R692 VanDerWaalsContact C-N 3.33Å; E690-R692 PolarHBondContact O-N 2.71Å; E690-Q693 PolarHBondContact O-N 3.33Å; E690-A694 WeakPolarHBondContact O-CB 3.42Å; E690-A694 PolarHBondContact O-N 3.48Å
691	A	82.2	Confident	81.9	Confident	56 Å²	56	98.4 Å²	98.4	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-35.8	175.3	0	0	0	0	0	112.6	R687 E689 V695	R687-A691 WeakPolarHBondContact O-CB 3.35Å; R687-A691 PolarHBondContact O-N 2.69Å; E689-A691 VanDerWaalsContact C-N 3.35Å; E689-A691 PolarHBondContact O-N 3.28Å; A691-V695 VanDerWaalsContact O-CG2 3.32Å; A691-V695 WeakPolarHBondContact O-CG2 3.3Å; A691-V695 PolarHBondContact O-N 3.42Å
692	R	83.9	Confident	81.7	Confident	154 Å²	154	100 Å²	100	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-65.9	-47.4	172.8	-78.8	169.3	166.8	-178.4	-4.2	111.9	I688 E689 E690 A694 V695 V696	I688-R692 WeakPolarHBondContact O-CG 3.27Å; I688-R692 PolarHBondContact O-N 2.92Å; E689-R692 WeakPolarHBondContact O-CB 3.39Å; E689-R692 PolarHBondContact O-N 3.15Å; E689-R692 WeakPolarHBondContact OE2-CD 3.48Å; E689-R692 IonicContact OE2-NH1 3.4Å; E689-R692 PolarHBondContact OE2-NH1 3.02Å; E690-R692 VanDerWaalsContact C-N 3.33Å; E690-R692 PolarHBondContact O-N 2.71Å; R692-A694 VanDerWaalsContact C-N 3.33Å; R692-A694 PolarHBondContact O-N 2.98Å; R692-V695 PolarHBondContact O-N 3.38Å; R692-V695 VanDerWaalsContact O-N 3.16Å; R692-V696 WeakPolarHBondContact O-CG2 3.31Å; R692-V696 PolarHBondContact O-N 3.39Å
693	Q	83.9	Confident	81.5	Confident	118 Å²	118	98.7 Å²	98.7	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-61	-42.5	176.6	-70.3	175.8	14.9	0	0	111.1	E689 E690 V695 V696 V697	E689-Q693 WeakPolarHBondContact O-CG 3.44Å; E689-Q693 PolarHBondContact O-N 2.87Å; E690-Q693 PolarHBondContact O-N 3.33Å; Q693-V695 VanDerWaalsContact C-N 3.32Å; Q693-V695 PolarHBondContact O-N 3.24Å; Q693-V696 PolarHBondContact O-N 2.94Å; Q693-V697 WeakPolarHBondContact O-CG2 3.44Å; Q693-V697 PolarHBondContact O-N 3.49Å
694	A	81.6	Confident	81.4	Confident	59 Å²	59	98 Å²	98	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-37	174.5	0	0	0	0	0	112.9	E690 R692 A698	E690-A694 WeakPolarHBondContact O-CB 3.42Å; E690-A694 PolarHBondContact O-N 3.48Å; R692-A694 VanDerWaalsContact C-N 3.33Å; R692-A694 PolarHBondContact O-N 2.98Å; A694-A698 WeakPolarHBondContact O-CB 3.25Å; A694-A698 PolarHBondContact O-N 3.49Å
695	V	83.1	Confident	81.2	Confident	104 Å²	104	98.9 Å²	98.9	63%	0.63	52%	0.523	S	S	*	.	H	α-helix	trans	-68.9	-39.3	173.9	167.6	0	0	0	0	112	A691 R692 Q693 A698 R699	A691-V695 VanDerWaalsContact O-CG2 3.32Å; A691-V695 WeakPolarHBondContact O-CG2 3.3Å; A691-V695 PolarHBondContact O-N 3.42Å; R692-V695 PolarHBondContact O-N 3.38Å; R692-V695 VanDerWaalsContact O-N 3.16Å; Q693-V695 VanDerWaalsContact C-N 3.32Å; Q693-V695 PolarHBondContact O-N 3.24Å; V695-A698 PolarHBondContact O-N 3.15Å; V695-R699 WeakPolarHBondContact O-CB 2.72Å; V695-R699 PolarHBondContact O-N 3.15Å
696	V	85	Confident	80.6	Confident	79 Å²	79	95.2 Å²	95.2	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-50.1	174.7	173.9	0	0	0	0	110.6	R692 Q693 A698 R699 E700	R692-V696 WeakPolarHBondContact O-CG2 3.31Å; R692-V696 PolarHBondContact O-N 3.39Å; Q693-V696 PolarHBondContact O-N 2.94Å; V696-A698 VanDerWaalsContact C-N 3.33Å; V696-A698 PolarHBondContact O-N 3.2Å; V696-R699 WeakPolarHBondContact O-CB 3.37Å; V696-R699 PolarHBondContact O-N 3.12Å; V696-R699 VanDerWaalsContact O-N 3.09Å; V696-E700 WeakPolarHBondContact O-CG 3.36Å; V696-E700 PolarHBondContact O-N 3.26Å
697	V	84.4	Confident	79.7	Confident	88 Å²	88	100.6 Å²	100.6	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-39.1	177.5	173.4	0	0	0	0	111.6	Q693 R699 E700 A701	Q693-V697 WeakPolarHBondContact O-CG2 3.44Å; Q693-V697 PolarHBondContact O-N 3.49Å; V697-R699 VanDerWaalsContact C-N 3.34Å; V697-R699 PolarHBondContact O-N 3.17Å; V697-E700 PolarHBondContact O-N 3.06Å; V697-A701 VanDerWaalsContact O-CB 3.25Å; V697-A701 WeakPolarHBondContact O-CB 3.45Å; V697-A701 PolarHBondContact O-N 3Å
698	A	78.4	Confident	78.6	Confident	48 Å²	48	98.9 Å²	98.9	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-36.6	174.8	0	0	0	0	0	112.3	A694 V695 V696 M702	A694-A698 WeakPolarHBondContact O-CB 3.25Å; A694-A698 PolarHBondContact O-N 3.49Å; V695-A698 PolarHBondContact O-N 3.15Å; V696-A698 VanDerWaalsContact C-N 3.33Å; V696-A698 PolarHBondContact O-N 3.2Å; A698-M702 WeakPolarHBondContact O-CG 3.32Å; A698-M702 PolarHBondContact O-N 3.02Å
699	R	81.4	Confident	77.1	Confident	158 Å²	158	97.4 Å²	97.4	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-67.6	-47.5	174.3	179.9	180	168.1	177.5	-5.1	111.4	V695 V696 V697 A701 M702 E703	V695-R699 WeakPolarHBondContact O-CB 2.72Å; V695-R699 PolarHBondContact O-N 3.15Å; V696-R699 WeakPolarHBondContact O-CB 3.37Å; V696-R699 PolarHBondContact O-N 3.12Å; V696-R699 VanDerWaalsContact O-N 3.09Å; V697-R699 VanDerWaalsContact C-N 3.34Å; V697-R699 PolarHBondContact O-N 3.17Å; R699-A701 VanDerWaalsContact C-N 3.29Å; R699-A701 PolarHBondContact O-N 3.37Å; R699-M702 PolarHBondContact O-N 3.08Å; R699-M702 VanDerWaalsContact O-N 3.13Å; R699-E703 IonicContact CZ-OE1 2.83Å; R699-E703 VanDerWaalsContact CZ-OE1 3.28Å; R699-E703 IonicContact NE-OE1 3.76Å; R699-E703 PolarHBondContact NE-OE1 2.85Å; R699-E703 IonicContact NH2-OE1 3.73Å; R699-E703 PolarHBondContact NH2-OE1 2.77Å; R699-E703 PolarHBondContact O-N 2.84Å
700	E	82.2	Confident	75.3	Confident	121 Å²	121	97.7 Å²	97.7	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-60.2	-40.1	175.7	-71.5	179	167.1	0	0	111.5	V696 V697 E703 A704	V696-E700 WeakPolarHBondContact O-CG 3.36Å; V696-E700 PolarHBondContact O-N 3.26Å; V697-E700 PolarHBondContact O-N 3.06Å; E700-E703 PolarHBondContact O-N 3.05Å; E700-A704 WeakPolarHBondContact O-CB 3.3Å; E700-A704 PolarHBondContact O-N 3.25Å
701	A	78.9	Confident	73.3	Confident	57 Å²	57	98.8 Å²	98.8	47%	0.471	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-36.4	174.2	0	0	0	0	0	112.9	V697 R699 A705	V697-A701 VanDerWaalsContact O-CB 3.25Å; V697-A701 WeakPolarHBondContact O-CB 3.45Å; V697-A701 PolarHBondContact O-N 3Å; R699-A701 VanDerWaalsContact C-N 3.29Å; R699-A701 PolarHBondContact O-N 3.37Å; A701-A705 WeakPolarHBondContact O-CB 3.32Å; A701-A705 PolarHBondContact O-N 3.38Å
702	M	74.6	Confident	71.1	Confident	130 Å²	130	103.6 Å²	103.6	64%	0.64	57%	0.571	S	S	*	*	H	α-helix	trans	-71.2	-40.8	173.7	-75.4	-172.7	-67.8	0	0	112.4	A698 R699 A705 S706	A698-M702 WeakPolarHBondContact O-CG 3.32Å; A698-M702 PolarHBondContact O-N 3.02Å; R699-M702 PolarHBondContact O-N 3.08Å; R699-M702 VanDerWaalsContact O-N 3.13Å; M702-A705 PolarHBondContact O-N 3.22Å; M702-S706 WeakPolarHBondContact O-CB 3.2Å; M702-S706 PolarHBondContact O-N 3.49Å
703	E	77.4	Confident	68.6	Low	80 Å²	80	102.9 Å²	102.9	37%	0.374	58%	0.578	S	S	.	*	H	α-helix	trans	-66.1	-40.1	174.7	-71.4	-176.3	-163.2	0	0	111.2	R699 E700 S706 R707	R699-E703 IonicContact CZ-OE1 2.83Å; R699-E703 VanDerWaalsContact CZ-OE1 3.28Å; R699-E703 IonicContact NE-OE1 3.76Å; R699-E703 PolarHBondContact NE-OE1 2.85Å; R699-E703 IonicContact NH2-OE1 3.73Å; R699-E703 PolarHBondContact NH2-OE1 2.77Å; R699-E703 PolarHBondContact O-N 2.84Å; E700-E703 PolarHBondContact O-N 3.05Å; E703-S706 PolarHBondContact O-N 3.47Å; E703-R707 WeakPolarHBondContact O-CG 3.3Å; E703-R707 PolarHBondContact O-N 3.24Å
704	A	77	Confident	66.2	Low	51 Å²	51	106.7 Å²	106.7	42%	0.421	59%	0.589	S	S	.	*	H	α-helix	trans	-66.4	-42.1	173.9	0	0	0	0	0	112.4	E700 S706 R707 M708	E700-A704 WeakPolarHBondContact O-CB 3.3Å; E700-A704 PolarHBondContact O-N 3.25Å; A704-S706 VanDerWaalsContact C-N 3.29Å; A704-S706 PolarHBondContact O-N 2.82Å; A704-R707 PolarHBondContact O-N 3.04Å; A704-M708 WeakPolarHBondContact O-CB 3.39Å; A704-M708 VanDerWaalsContact O-CG 3.29Å; A704-M708 WeakPolarHBondContact O-CG 3.36Å; A704-M708 PolarHBondContact O-N 3.04Å
705	A	73.9	Confident	63.9	Low	64 Å²	64	113.5 Å²	113.5	53%	0.529	61%	0.61	S	S	.	*	H	α-helix	trans	-63	-35.6	173.5	0	0	0	0	0	112	A701 M702 G709	A701-A705 WeakPolarHBondContact O-CB 3.32Å; A701-A705 PolarHBondContact O-N 3.38Å; M702-A705 PolarHBondContact O-N 3.22Å; A705-G709 PolarHBondContact O-N 3.15Å
706	S	70.4	Confident	61.7	Low	86 Å²	86	111.4 Å²	111.4	60%	0.601	61%	0.61	S	S	*	*	H	α-helix	trans	-70.4	-33.5	174.9	-163.7	0	0	0	0	113	M702 E703 A704 S710	M702-S706 WeakPolarHBondContact O-CB 3.2Å; M702-S706 PolarHBondContact O-N 3.49Å; E703-S706 PolarHBondContact O-N 3.47Å; A704-S706 VanDerWaalsContact C-N 3.29Å; A704-S706 PolarHBondContact O-N 2.82Å; S706-S710 PolarHBondContact O-OG 2.78Å
707	R	66.7	Low	59.3	Low	172 Å²	172	116.8 Å²	116.8	65%	0.649	63%	0.63	S	S	*	*	H	α-helix	trans	-72.3	-47.5	174	-71.1	178.8	-172.8	175.6	5.7	111.9	E703 A704 G709 S710 E711	E703-R707 WeakPolarHBondContact O-CG 3.3Å; E703-R707 PolarHBondContact O-N 3.24Å; A704-R707 PolarHBondContact O-N 3.04Å; R707-G709 PolarHBondContact O-N 3.3Å; R707-S710 PolarHBondContact O-N 3.08Å; R707-S710 PolarHBondContact O-OG 3.31Å; R707-E711 PolarHBondContact O-N 3.48Å
708	M	57	Low	57	Low	132 Å²	132	118.2 Å²	118.2	65%	0.65	64%	0.64	S	S	*	*	H	α-helix	trans	-61.9	-28.8	174.8	-68.9	-86.1	-75.8	0	0	112.2	A704 S710	A704-M708 WeakPolarHBondContact O-CB 3.39Å; A704-M708 VanDerWaalsContact O-CG 3.29Å; A704-M708 WeakPolarHBondContact O-CG 3.36Å; A704-M708 PolarHBondContact O-N 3.04Å; M708-S710 VanDerWaalsContact C-N 3.3Å; M708-S710 PolarHBondContact O-N 2.93Å
709	G	51	Low	55	Low	69 Å²	69	121.1 Å²	121.1	71%	0.711	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-14.2	174.5	0	0	0	0	0	115.3	A705 R707	A705-G709 PolarHBondContact O-N 3.15Å; R707-G709 PolarHBondContact O-N 3.3Å
710	S	45.9	Very low	53	Low	93 Å²	93	121.2 Å²	121.2	65%	0.65	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-12.5	176.3	45.6	0	0	0	0	114.4	S706 R707 M708	S706-S710 PolarHBondContact O-OG 2.78Å; R707-S710 PolarHBondContact O-N 3.08Å; R707-S710 PolarHBondContact O-OG 3.31Å; M708-S710 VanDerWaalsContact C-N 3.3Å; M708-S710 PolarHBondContact O-N 2.93Å
711	E	40	Very low	50.8	Low	155 Å²	155	122 Å²	122	72%	0.724	68%	0.678	S	S	*	*	S	Bend	trans	-113.5	49	-176.1	-66.6	-172.8	159.8	0	0	113	R707	R707-E711 PolarHBondContact O-N 3.48Å
712	Q	36.7	Very low	48.9	Very low	158 Å²	158	124.6 Å²	124.6	74%	0.738	69%	0.687	S	S	*	*			trans	-162.7	73.8	169.8	-121.9	158.8	79.5	0	0	114.4
713	N	31.9	Very low	47.3	Very low	138 Å²	138	122.7 Å²	122.7	74%	0.738	69%	0.687	S	S	*	*	S	Bend	trans	-175.7	144.5	131.3	-104.3	-37.6	0	0	0	114.8
714	Y	32.9	Very low	45.5	Very low	199 Å²	199	129.7 Å²	129.7	78%	0.78	71%	0.71	S	S	*	*			trans	60	83.2	167.5	-58.1	-67.2	0	0	0	118.6
715	H	33.6	Very low	43.8	Very low	202 Å²	202	133.7 Å²	133.7	94%	0.935	72%	0.723	S	S	*	*				-111.5	104	129.8	-96.8	-65.8	0	0	0	109.9
716	G	36.3	Very low	42.2	Very low	60 Å²	60	138.6 Å²	138.6	62%	0.619	73%	0.734	S	S	*	*			trans	-85.7	-175.5	150.4	0	0	0	0	0	110.4
717	E	33.9	Very low	40.6	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	74%	0.739	S	S	*	*			trans	-47.8	156.6	-168.8	-62.2	-172.4	147.5	0	0	117.8
718	P	36	Very low	39.3	Very low	117 Å²	117	136.4 Å²	136.4	76%	0.76	75%	0.745	S	S	*	*			trans	-91.9	-176.8	-173.2	39.3	-38.3	0	0	0	114.3
719	S	37.5	Very low	38.3	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	76%	0.756	S	S	*	*			trans	78.7	139.5	173.7	83.8	0	0	0	0	114.6
720	L	38.3	Very low	37.7	Very low	160 Å²	160	142 Å²	142	84%	0.838	75%	0.751	S	S	*	*			cis	-159.7	162.9	-8.3	-89.8	148.6	0	0	0	105.2
721	D	37.1	Very low	37.3	Very low	138 Å²	138	144 Å²	144	74%	0.738	75%	0.754	S	S	*	*			cis	-173.8	-161.9	-15.9	-179.3	27.4	0	0	0	107.7
722	V	39.4	Very low	37.3	Very low	111 Å²	111	142.5 Å²	142.5	67%	0.673	76%	0.756	S	S	*	*			trans	85.7	65.1	157.2	-159.7	0	0	0	0	117.9
723	S	39.4	Very low	37.4	Very low	89 Å²	89	140.6 Å²	140.6	62%	0.622	76%	0.76	S	S	*	*				73.2	135.7	113.9	83.4	0	0	0	0	124.7
724	R	40.5	Very low	37.6	Very low	228 Å²	228	137.8 Å²	137.8	86%	0.86	76%	0.764	S	S	*	*			trans	73.8	144.7	138.7	-74.5	174.3	178.6	-178.6	0.8	118.3
725	I	42.3	Very low	37.9	Very low	135 Å²	135	132.5 Å²	132.5	69%	0.692	76%	0.761	S	S	*	*			cis	-156.3	150	14.4	-114.1	151.6	0	0	0	110.9
726	H	39.5	Very low	38	Very low	166 Å²	166	131.9 Å²	131.9	77%	0.769	76%	0.758	S	S	*	*			trans	28.6	137.4	157.4	-64.2	-119.9	0	0	0	122.3
727	A	37.3	Very low	38.1	Very low	86 Å²	86	133.2 Å²	133.2	71%	0.711	76%	0.764	S	S	*	*			cis	95.3	149.2	25.1	0	0	0	0	0	117
728	V	39.6	Very low	38.4	Very low	127 Å²	127	129.4 Å²	129.4	77%	0.77	76%	0.759	S	S	*	*			trans	87.5	107.1	177.8	-168.3	0	0	0	0	113.5
729	R	35.4	Very low	38.8	Very low	231 Å²	231	132 Å²	132	87%	0.872	76%	0.76	S	S	*	*				58.8	142.6	80.5	-69.3	-177.7	176.4	174.5	-2.4	113.8
730	S	38.6	Very low	38.9	Very low	88 Å²	88	132.5 Å²	132.5	62%	0.615	75%	0.754	S	S	*	*			cis	-166.6	175.9	-12.6	44.3	0	0	0	0	109.1
731	D	37.9	Very low	39	Very low	134 Å²	134	130.4 Å²	130.4	72%	0.717	74%	0.744	S	S	*	*			trans	87.1	118.1	151.8	-52.5	-44.2	0	0	0	123.3
732	T	40.1	Very low	39.2	Very low	124 Å²	124	129.1 Å²	129.1	76%	0.761	74%	0.741	S	S	*	*			trans	78.5	116	133.9	55	0	0	0	0	124.3
733	S	37.8	Very low	39.3	Very low	118 Å²	118	131.9 Å²	131.9	83%	0.825	75%	0.747	S	S	*	*				86.5	139.9	125.4	74.3	0	0	0	0	122.2
734	G	36.8	Very low	39.2	Very low	79 Å²	79	136.6 Å²	136.6	81%	0.814	76%	0.756	S	S	*	*			trans	76.1	151	167	0	0	0	0	0	115.6
735	A	37.8	Very low	39	Very low	88 Å²	88	133.5 Å²	133.5	73%	0.727	75%	0.751	S	S	*	*			cis	177.1	150	-17.1	0	0	0	0	0	105.5
736	E	36.4	Very low	38.8	Very low	188 Å²	188	133.9 Å²	133.9	88%	0.879	76%	0.76	S	S	*	*			trans	66.6	114.2	150.4	-70.7	175	-162.3	0	0	122.6
737	A	38.9	Very low	38.5	Very low	89 Å²	89	137.1 Å²	137.1	74%	0.736	77%	0.766	S	S	*	*				93.6	156	115.4	0	0	0	0	0	122.7
738	S	40.6	Very low	38.5	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	77%	0.77	S	S	*	*			trans	76.5	121.2	175.3	64.2	0	0	0	0	117.8
739	H	42.9	Very low	38.1	Very low	171 Å²	171	142.1 Å²	142.1	79%	0.792	77%	0.767	S	S	*	*				74.4	132.6	72.4	-129.2	-85	0	0	0	110.6
740	D	39.7	Very low	38.2	Very low	121 Å²	121	139 Å²	139	65%	0.647	77%	0.768	S	S	*	*			cis	-172.8	-168.7	-15.3	-170.1	4.1	0	0	0	106.5
741	D	41.9	Very low	37.9	Very low	115 Å²	115	140.1 Å²	140.1	62%	0.615	78%	0.775	S	S	*	*			trans	84.3	116.3	149.4	-71.3	-50.4	0	0	0	121.8
742	T	40.3	Very low	38	Very low	112 Å²	112	141.6 Å²	141.6	69%	0.687	78%	0.782	S	S	*	*			trans	83.3	109.8	133.2	57.6	0	0	0	0	122.8
743	E	41.1	Very low	37.7	Very low	168 Å²	168	143.7 Å²	143.7	79%	0.785	79%	0.788	S	S	*	*				39.9	121.2	120.3	-55.4	-176.4	177.1	0	0	120.7
744	K	37.9	Very low	37.7	Very low	188 Å²	188	146 Å²	146	82%	0.817	79%	0.785	S	S	*	*				-170.5	160.1	96.9	-113.3	171.2	-178.3	163.9	0	116.3
745	E	35.6	Very low	37.6	Very low	163 Å²	163	152.5 Å²	152.5	76%	0.762	79%	0.785	S	S	*	*			trans	-59.7	155.3	174.2	-48.7	166.1	105.9	0	0	113.3
746	T	38.6	Very low	37.7	Very low	143 Å²	143	158.6 Å²	158.6	88%	0.877	80%	0.795	S	S	*	*				-177.6	161	104.4	27.9	0	0	0	0	113.1
747	R	33.2	Very low	37.8	Very low	235 Å²	235	159.2 Å²	159.2	89%	0.887	80%	0.795	S	S	*	*			trans	-89	145.6	-174.9	-56	158.6	171.4	159.6	-5.5	111.5
748	K	36.7	Very low	37.7	Very low	184 Å²	184	164.9 Å²	164.9	80%	0.8	80%	0.803	S	S	*	*				163.4	138.5	111.8	-90.2	-179.9	175.2	-177.7	0	113.2
749	D	32.7	Very low	37.7	Very low	133 Å²	133	170.5 Å²	170.5	71%	0.711	81%	0.807	S	S	*	*			trans	22.9	120.3	134.6	-41.2	-37.7	0	0	0	118.8
750	D	37.5	Very low	37.5	Very low	167 Å²	167	173.8 Å²	173.8	89%	0.893	81%	0.813	S	S	*	*				-166.3	152.8	109.5	-106.4	-25.7	0	0	0	113.4
751	S	32.6	Very low	37.5	Very low	110 Å²	110	178 Å²	178	77%	0.769	83%	0.825	S	S	*	*			trans	-95.8	124.9	-171.2	58.7	0	0	0	0	113.8
752	I	38.1	Very low	37.3	Very low	165 Å²	165	181.7 Å²	181.7	85%	0.846	84%	0.836	S	S	*	*			trans	-131.9	126.8	162.6	-63	-175.9	0	0	0	111
753	L	35.7	Very low	37.5	Very low	169 Å²	169	184.7 Å²	184.7	89%	0.885	84%	0.844	S	S	*	*			trans	-75.2	135.3	171.4	-65.1	115.1	0	0	0	110.9
754	E	36.4	Very low	37.7	Very low	166 Å²	166	182.1 Å²	182.1	78%	0.776	84%	0.842	S	S	*	*			trans	-152.8	135.3	154.4	-114.4	-68.3	95	0	0	112.8
755	R	35.3	Very low	37.9	Very low	216 Å²	216	178.5 Å²	178.5	82%	0.815	84%	0.841	S	S	*	*			trans	-77.4	132.5	-162.4	-61.3	141.5	151.2	173.8	-6.3	113.6
756	K	39.3	Very low	38.2	Very low	215 Å²	215	180.7 Å²	180.7	94%	0.935	85%	0.848	S	S	*	*			trans	-130.6	143.7	149.6	-74.9	-170.3	179.1	168.6	0	113.9
757	K	38.5	Very low	38.3	Very low	201 Å²	201	178.2 Å²	178.2	87%	0.874	84%	0.842	S	S	*	*			trans	-81.7	140.3	-154.2	-69.8	167.9	176	169.5	0	114.2	R759	K757-R759 PolarHBondContact O-N 3.29Å
758	K	36.6	Very low	38.7	Very low	208 Å²	208	178.8 Å²	178.8	90%	0.904	84%	0.844	S	S	*	*			trans	-59.3	122.6	161.8	-65	175.7	178.9	175.9	0	110.2
759	R	40	Very low	38.8	Very low	231 Å²	231	180.2 Å²	180.2	87%	0.872	85%	0.851	S	S	*	*			trans	-103.4	97.3	159.8	-70.5	-173.8	82.5	177.1	4.7	109.4	K757 F761	K757-R759 PolarHBondContact O-N 3.29Å; R759-F761 PolarHBondContact O-N 3.07Å
760	R	39.2	Very low	39.4	Very low	240 Å²	240	179 Å²	179	91%	0.906	85%	0.852	S	S	*	*			trans	-66.9	120.4	165.1	-87.3	175.5	149.8	-178.6	-7.5	108.6
761	F	40.2	Very low	39.6	Very low	209 Å²	209	181 Å²	181	92%	0.917	85%	0.853	S	S	*	*			trans	-76.1	121.6	157.8	-101.8	-90.2	0	0	0	108.7	R759	R759-F761 PolarHBondContact O-N 3.07Å
762	K	38.4	Very low	40.2	Very low	192 Å²	192	183.3 Å²	183.3	84%	0.835	86%	0.855	S	S	*	*			trans	-113	118.7	178.5	-167.1	178.1	-176.9	-175	0	106.9
763	M	44.5	Very low	40.6	Very low	175 Å²	175	185.2 Å²	185.2	86%	0.862	86%	0.857	S	S	*	*			trans	-63.3	139.8	177.8	-76.3	175.2	62.6	0	0	110.7
764	P	44.5	Very low	41	Very low	114 Å²	114	185.2 Å²	185.2	74%	0.74	85%	0.853	S	S	*	*			trans	-70.7	128.8	172	-15	29.9	0	0	0	111.1
765	S	43.1	Very low	41.1	Very low	113 Å²	113	182.8 Å²	182.8	79%	0.79	85%	0.854	S	S	*	*			trans	-84.4	112.1	171.7	52.5	0	0	0	0	110.9	A767	S765-A767 PolarHBondContact O-N 2.93Å
766	F	40.2	Very low	41.6	Very low	208 Å²	208	182 Å²	182	91%	0.912	86%	0.857	S	S	*	*			trans	-82.7	98.4	165.2	-91	-85.5	0	0	0	110.2
767	A	41.7	Very low	41.8	Very low	91 Å²	91	180.9 Å²	180.9	75%	0.752	86%	0.855	S	S	*	*			trans	-89	126.6	175.2	0	0	0	0	0	111.6	S765	S765-A767 PolarHBondContact O-N 2.93Å
768	R	40.8	Very low	42.1	Very low	247 Å²	247	180.9 Å²	180.9	93%	0.932	86%	0.855	S	S	*	*			trans	-7.7	120.6	160.7	-61.1	171.8	177.4	177.4	-3	116.7
769	K	40.3	Very low	42.5	Very low	215 Å²	215	184.6 Å²	184.6	94%	0.935	87%	0.871	S	S	*	*			trans	-89.6	108.5	147.4	-96.9	-179.6	175.3	173.9	0	108.7
770	S	44.5	Very low	42.6	Very low	107 Å²	107	182.3 Å²	182.3	75%	0.748	87%	0.871	S	S	*	*			trans	-74.4	140.6	164.3	41.9	0	0	0	0	109.9
771	K	42	Very low	42.8	Very low	208 Å²	208	179.2 Å²	179.2	90%	0.904	87%	0.869	S	S	*	*			trans	-121.9	110.9	162.6	-116.5	-175.5	179.1	-178.4	0	107.7
772	I	43.7	Very low	42.9	Very low	159 Å²	159	177.6 Å²	177.6	82%	0.815	87%	0.866	S	S	*	*			trans	-68.9	141.1	170.3	-65.6	161.6	0	0	0	107.6
773	K	46.7	Very low	43.2	Very low	206 Å²	206	176.7 Å²	176.7	90%	0.896	87%	0.868	S	S	*	*			trans	-137.5	129.7	162.7	-138.4	-179.7	-176.5	-172.4	0	108.3
774	E	46	Very low	43.1	Very low	169 Å²	169	176.8 Å²	176.8	79%	0.79	87%	0.868	S	S	*	*			trans	-68	152.3	-167.6	-65.6	163.1	106	0	0	113.7
775	S	37.6	Very low	43	Very low	115 Å²	115	181 Å²	181	80%	0.804	88%	0.877	S	S	*	*			trans	-64.9	131.5	158.4	42.3	0	0	0	0	111.1
776	K	46.1	Very low	43	Very low	200 Å²	200	185.9 Å²	185.9	87%	0.87	88%	0.883	S	S	*	*			trans	-135.9	97.7	152.8	-90.9	-174.6	178.9	165.2	0	110
777	E	42.1	Very low	43.2	Very low	191 Å²	191	184.2 Å²	184.2	89%	0.893	88%	0.881	S	S	*	*			trans	-61.7	134	159.9	179.8	177.6	-142.5	0	0	109.8
778	K	46.3	Very low	43.3	Very low	200 Å²	200	191.9 Å²	191.9	87%	0.87	89%	0.892	S	S	*	*			trans	-169.1	113.2	161.2	-115.3	174.7	-173.2	-174.4	0	112.3
779	K	44	Very low	43.6	Very low	286 Å²	286	186.9 Å²	186.9	100%	1.243	89%	0.888	S	S	*	*			trans	71.6	0	177.5	-67.7	-169.7	171.7	-172	0	116.4

Retrieved 779 of 779 residues in 243.5 ms (Link to these results)

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