X6RHV1_HUMAN Loading...

SET domain bifurcated histone lysine methyltransferase 1

AlphaFold DB , UniProt , Accession X6RHV1, Species HUMAN (Homo sapiens, Human), Gene SETDB1, Length 150 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	50	Low	55.6	Low	211 Å²	211	119.1 Å²	119.1	100%	1.039	60%	0.601	S	S	*	*				0	-39.4	0	-135.6	166.7	-137.3	0	0	111.2	V4	M1-V4 PolarHBondContact O-N 3.27Å
2	C	52.7	Low	55.5	Low	55 Å²	55	116.9 Å²	116.9	37%	0.372	59%	0.592	S	S	.	*	H	α-helix	trans	-61.2	-40.2	176.3	-59	0	0	0	0	114.8	V4 F5 G6	C2-V4 PolarHBondContact O-N 3.01Å; C2-F5 PolarHBondContact O-N 3.11Å; C2-G6 PolarHBondContact O-N 2.78Å
3	E	52.8	Low	55.5	Low	172 Å²	172	121.3 Å²	121.3	80%	0.804	61%	0.605	S	S	*	*	H	α-helix	trans	-65.5	-26.4	179.2	-68	-175	143.6	0	0	113.8	L7	E3-L7 PolarHBondContact O-N 3.41Å
4	V	59.9	Low	55	Low	102 Å²	102	119.9 Å²	119.9	62%	0.618	61%	0.612	S	S	*	*	H	α-helix	trans	-74.8	-33.7	-175.9	-177.9	0	0	0	0	111.2	M1 C2 W8	M1-V4 PolarHBondContact O-N 3.27Å; C2-V4 PolarHBondContact O-N 3.01Å; V4-W8 PolarHBondContact O-N 3.01Å
5	F	59.3	Low	54.1	Low	134 Å²	134	120.5 Å²	120.5	59%	0.588	61%	0.614	S	S	*	*	H	α-helix	trans	-77.2	-39.5	178	-111.2	-92.4	0	0	0	112.2	C2 L7 W8 I9	C2-F5 PolarHBondContact O-N 3.11Å; F5-L7 VanDerWaalsContact C-N 3.28Å; F5-L7 PolarHBondContact O-N 3.31Å; F5-W8 WeakPolarHBondContact O-CB 3.46Å; F5-W8 PolarHBondContact O-N 3.09Å; F5-W8 VanDerWaalsContact O-N 3.14Å; F5-I9 PolarHBondContact O-N 3.36Å; F5-I9 VanDerWaalsContact O-N 3.14Å
6	G	59.2	Low	53.6	Low	37 Å²	37	120.1 Å²	120.1	38%	0.381	63%	0.625	S	S	.	*	H	α-helix	trans	-61	-35	172.7	0	0	0	0	0	113.4	C2 L10	C2-G6 PolarHBondContact O-N 2.78Å; G6-L10 PolarHBondContact O-N 3.3Å
7	L	59.4	Low	53.1	Low	113 Å²	113	118.8 Å²	118.8	59%	0.592	63%	0.629	S	S	*	*	H	α-helix	trans	-67.6	-39.9	173.3	-135.3	77.4	0	0	0	112	E3 F5 I9 L10 E11	E3-L7 PolarHBondContact O-N 3.41Å; F5-L7 VanDerWaalsContact C-N 3.28Å; F5-L7 PolarHBondContact O-N 3.31Å; L7-I9 PolarHBondContact O-N 3.4Å; L7-L10 PolarHBondContact O-N 3.33Å; L7-E11 WeakPolarHBondContact O-CB 3.45Å; L7-E11 PolarHBondContact O-N 3.45Å
8	W	56.6	Low	52.8	Low	176 Å²	176	120.9 Å²	120.9	67%	0.667	64%	0.64	S	S	*	*	H	α-helix	trans	-63.9	-40.7	179.7	-140.7	80.1	0	0	0	112.4	V4 F5 E11 D12	V4-W8 PolarHBondContact O-N 3.01Å; F5-W8 WeakPolarHBondContact O-CB 3.46Å; F5-W8 PolarHBondContact O-N 3.09Å; F5-W8 VanDerWaalsContact O-N 3.14Å; W8-E11 PolarHBondContact O-N 2.94Å; W8-D12 WeakPolarHBondContact CZ3-OD2 3.41Å; W8-D12 PolarHBondContact O-N 3.02Å
9	I	56.5	Low	52.6	Low	65 Å²	65	121.7 Å²	121.7	33%	0.333	65%	0.653	S	S	.	*	H	α-helix	trans	-67.1	-36.9	176.5	-68.1	-172.4	0	0	0	112	F5 L7 E11 D12 K13 V82	F5-I9 PolarHBondContact O-N 3.36Å; F5-I9 VanDerWaalsContact O-N 3.14Å; L7-I9 PolarHBondContact O-N 3.4Å; I9-E11 VanDerWaalsContact C-N 3.33Å; I9-D12 PolarHBondContact O-N 3.19Å; I9-K13 PolarHBondContact O-N 3.28Å; I9-V82 HydrophobicContact CD1-CG1 4.09Å
10	L	52	Low	52.2	Low	127 Å²	127	118.6 Å²	118.6	67%	0.665	65%	0.65	S	S	*	*	H	α-helix	trans	-69.9	-34.4	176.5	-157.5	72.2	0	0	0	111.6	G6 L7 K13 S14	G6-L10 PolarHBondContact O-N 3.3Å; L7-L10 PolarHBondContact O-N 3.33Å; L10-K13 PolarHBondContact O-N 3.46Å; L10-S14 PolarHBondContact O-N 3.34Å
11	E	52.9	Low	51.5	Low	118 Å²	118	119.4 Å²	119.4	55%	0.551	66%	0.663	S	S	*	*	H	α-helix	trans	-69.3	-38.3	174.6	-147.3	124.6	138.1	0	0	111.7	L7 W8 I9 K13 S14 M15	L7-E11 WeakPolarHBondContact O-CB 3.45Å; L7-E11 PolarHBondContact O-N 3.45Å; W8-E11 PolarHBondContact O-N 2.94Å; I9-E11 VanDerWaalsContact C-N 3.33Å; E11-K13 VanDerWaalsContact C-N 3.28Å; E11-K13 PolarHBondContact O-N 2.96Å; E11-S14 CarbonylContact O-C 3.38Å; E11-S14 WeakPolarHBondContact O-CA 3.45Å; E11-S14 WeakPolarHBondContact O-CB 3.29Å; E11-S14 PolarHBondContact O-N 3.5Å; E11-M15 HydrophobicContact CG-SD 4.46Å; E11-M15 WeakPolarHBondContact O-CG 3.49Å; E11-M15 PolarHBondContact O-N 2.92Å
12	D	54.9	Low	51.5	Low	93 Å²	93	117.9 Å²	117.9	50%	0.497	66%	0.657	S	S	.	*	H	α-helix	trans	-60.4	-36.4	174.3	-122.5	-73.6	0	0	0	112	W8 I9 S14 M15	W8-D12 WeakPolarHBondContact CZ3-OD2 3.41Å; W8-D12 PolarHBondContact O-N 3.02Å; I9-D12 PolarHBondContact O-N 3.19Å; D12-S14 PolarHBondContact O-N 3.47Å; D12-M15 PolarHBondContact O-N 3.45Å; D12-M15 VanDerWaalsContact O-N 3.13Å
13	K	55.9	Low	51.4	Low	174 Å²	174	118.5 Å²	118.5	76%	0.757	67%	0.673	S	S	*	*	H	α-helix	trans	-68.2	-21.9	174.8	-158.6	156	-171	152.8	0	113.2	I9 L10 E11	I9-K13 PolarHBondContact O-N 3.28Å; L10-K13 PolarHBondContact O-N 3.46Å; E11-K13 VanDerWaalsContact C-N 3.28Å; E11-K13 PolarHBondContact O-N 2.96Å
14	S	47.5	Very low	51.1	Low	101 Å²	101	115.6 Å²	115.6	71%	0.706	66%	0.662	S	S	*	*	H	α-helix	trans	-91	-13.6	173.2	-168.6	0	0	0	0	113.2	L10 E11 D12	L10-S14 PolarHBondContact O-N 3.34Å; E11-S14 CarbonylContact O-C 3.38Å; E11-S14 WeakPolarHBondContact O-CA 3.45Å; E11-S14 WeakPolarHBondContact O-CB 3.29Å; E11-S14 PolarHBondContact O-N 3.5Å; D12-S14 PolarHBondContact O-N 3.47Å
15	M	41.6	Very low	50.7	Low	129 Å²	129	117.1 Å²	117.1	64%	0.635	67%	0.667	S	S	*	*			trans	-109.5	37.1	-173.7	-70.3	-169.1	71.8	0	0	113.8	E11 D12 S17	E11-M15 HydrophobicContact CG-SD 4.46Å; E11-M15 WeakPolarHBondContact O-CG 3.49Å; E11-M15 PolarHBondContact O-N 2.92Å; D12-M15 PolarHBondContact O-N 3.45Å; D12-M15 VanDerWaalsContact O-N 3.13Å; M15-S17 PolarHBondContact O-N 3.02Å
16	S	46.5	Very low	50.4	Low	114 Å²	114	114.9 Å²	114.9	80%	0.797	67%	0.673	S	S	*	*			trans	-66.7	11.6	164.8	59.6	0	0	0	0	114.2	L18	S16-L18 PolarHBondContact O-N 2.92Å
17	S	45.3	Very low	49.9	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	69%	0.685	S	S	*	*	S	Bend	trans	-87	107.3	169.8	-159.4	0	0	0	0	109.6	M15	M15-S17 PolarHBondContact O-N 3.02Å
18	L	47.2	Very low	49.7	Very low	157 Å²	157	114.1 Å²	114.1	82%	0.822	67%	0.674	S	S	*	*			trans	-45.5	124.8	176	-73.5	144.4	0	0	0	112.4	S16 G20	S16-L18 PolarHBondContact O-N 2.92Å; L18-G20 PolarHBondContact O-N 3.4Å; L18-G20 VanDerWaalsContact O-N 3.16Å
19	P	49.2	Very low	49.6	Very low	136 Å²	136	108 Å²	108	88%	0.883	66%	0.66	S	S	*	*			trans	-82.9	90.3	164.1	28.9	-23.1	0	0	0	108.5
20	G	44.4	Very low	49.7	Very low	59 Å²	59	109.4 Å²	109.4	61%	0.608	67%	0.672	S	S	*	*			trans	-104.8	129	171.5	0	0	0	0	0	111.4	L18	L18-G20 PolarHBondContact O-N 3.4Å; L18-G20 VanDerWaalsContact O-N 3.16Å
21	C	38.5	Very low	50.1	Low	135 Å²	135	107.8 Å²	107.8	91%	0.912	67%	0.667	S	S	*	*			trans	83.1	89.2	160.6	-49.8	0	0	0	0	117
22	I	48.6	Very low	50.8	Low	180 Å²	180	106 Å²	106	92%	0.923	66%	0.659	S	S	*	*			trans	-76.3	117	156.4	43.6	164.4	0	0	0	110.1
23	G	52	Low	51.9	Low	67 Å²	67	105.2 Å²	105.2	69%	0.691	66%	0.661	S	S	*	*			trans	92.8	94	153.8	0	0	0	0	0	115.9
24	L	46.2	Very low	53.3	Low	112 Å²	112	103.4 Å²	103.4	59%	0.586	66%	0.655	S	S	*	*			trans	-147.2	136.4	153.4	-130.4	74.2	0	0	0	109.6	T28 E32	L24-T28 HydrophobicContact CD2-CG2 4.27Å; L24-E32 WeakPolarHBondContact CD2-OE1 3.46Å
25	D	50.7	Low	55.3	Low	134 Å²	134	104.1 Å²	104.1	72%	0.717	65%	0.647	S	S	*	*			trans	-57.6	151.1	-172	-70.4	-48.7	0	0	0	112.7	A27 T28 A29	D25-A27 PolarHBondContact O-N 2.99Å; D25-T28 PolarHBondContact N-OG1 3.11Å; D25-T28 PolarHBondContact O-N 3.47Å; D25-T28 PolarHBondContact O-OG1 2.91Å; D25-A29 PolarHBondContact O-N 3.42Å; D25-A29 VanDerWaalsContact O-N 3.09Å
26	A	54.1	Low	57.6	Low	87 Å²	87	102.1 Å²	102.1	72%	0.719	64%	0.638	S	S	*	*	H	α-helix	trans	-60.3	-22.6	-172	0	0	0	0	0	114.6
27	A	48.2	Very low	59.7	Low	76 Å²	76	99.1 Å²	99.1	63%	0.628	62%	0.62	S	S	*	*	H	α-helix	trans	-81.7	-29.1	175	0	0	0	0	0	113.4	D25 T30	D25-A27 PolarHBondContact O-N 2.99Å; A27-T30 PolarHBondContact O-OG1 3.33Å; A27-T30 VanDerWaalsContact O-OG1 3.11Å
28	T	53.8	Low	62	Low	58 Å²	58	100.7 Å²	100.7	36%	0.356	62%	0.617	S	S	.	*	H	α-helix	trans	-73.2	-36.7	170.8	22.6	0	0	0	0	111.2	L24 D25 T30 V31 E32	L24-T28 HydrophobicContact CD2-CG2 4.27Å; D25-T28 PolarHBondContact N-OG1 3.11Å; D25-T28 PolarHBondContact O-N 3.47Å; D25-T28 PolarHBondContact O-OG1 2.91Å; T28-T30 VanDerWaalsContact C-N 3.32Å; T28-T30 PolarHBondContact O-N 3.23Å; T28-V31 PolarHBondContact O-N 2.68Å; T28-E32 WeakPolarHBondContact O-CB 3.48Å; T28-E32 VanDerWaalsContact O-CG 3.32Å; T28-E32 WeakPolarHBondContact O-CG 3.28Å; T28-E32 PolarHBondContact O-N 3.03Å
29	A	55.6	Low	64.1	Low	47 Å²	47	98.2 Å²	98.2	39%	0.388	60%	0.604	S	S	.	*	H	α-helix	trans	-62.5	-33	178.6	0	0	0	0	0	113.8	D25 S33	D25-A29 PolarHBondContact O-N 3.42Å; D25-A29 VanDerWaalsContact O-N 3.09Å; A29-S33 VanDerWaalsContact O-CB 3.3Å; A29-S33 WeakPolarHBondContact O-CB 3.39Å; A29-S33 PolarHBondContact O-N 3.4Å
30	T	58.5	Low	66.1	Low	95 Å²	95	96.3 Å²	96.3	58%	0.583	58%	0.583	S	S	*	*	H	α-helix	trans	-74.6	-35.7	178.7	52.4	0	0	0	0	113	A27 T28 E34	A27-T30 PolarHBondContact O-OG1 3.33Å; A27-T30 VanDerWaalsContact O-OG1 3.11Å; T28-T30 VanDerWaalsContact C-N 3.32Å; T28-T30 PolarHBondContact O-N 3.23Å; T30-E34 PolarHBondContact O-N 2.97Å
31	V	61.2	Low	68.5	Low	92 Å²	92	98.4 Å²	98.4	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-73.2	-41.5	177.1	179	0	0	0	0	110.3	T28 S33 E34 E35	T28-V31 PolarHBondContact O-N 2.68Å; V31-S33 VanDerWaalsContact C-N 3.29Å; V31-S33 PolarHBondContact O-N 2.81Å; V31-E34 PolarHBondContact O-N 3.22Å; V31-E35 WeakPolarHBondContact O-CB 3.28Å; V31-E35 PolarHBondContact O-N 3.17Å; V31-E35 VanDerWaalsContact O-N 3.09Å
32	E	66.1	Low	71.1	Confident	82 Å²	82	94.3 Å²	94.3	38%	0.383	55%	0.552	S	S	.	*	H	α-helix	trans	-62	-37.2	173.9	-72.4	176.4	160.7	0	0	111.8	L24 T28 I36	L24-E32 WeakPolarHBondContact CD2-OE1 3.46Å; T28-E32 WeakPolarHBondContact O-CB 3.48Å; T28-E32 VanDerWaalsContact O-CG 3.32Å; T28-E32 WeakPolarHBondContact O-CG 3.28Å; T28-E32 PolarHBondContact O-N 3.03Å; E32-I36 VanDerWaalsContact O-CB 3.32Å; E32-I36 WeakPolarHBondContact O-CB 3.39Å; E32-I36 VanDerWaalsContact O-CD1 3.25Å; E32-I36 WeakPolarHBondContact O-CD1 3.3Å; E32-I36 WeakPolarHBondContact O-CG1 3.27Å; E32-I36 PolarHBondContact O-N 2.95Å
33	S	79.1	Confident	73.2	Confident	76 Å²	76	88.1 Å²	88.1	53%	0.531	52%	0.523	S	S	.	.	H	α-helix	trans	-68.2	-35.6	179.6	-172.8	0	0	0	0	113.4	A29 V31 A37	A29-S33 VanDerWaalsContact O-CB 3.3Å; A29-S33 WeakPolarHBondContact O-CB 3.39Å; A29-S33 PolarHBondContact O-N 3.4Å; V31-S33 VanDerWaalsContact C-N 3.29Å; V31-S33 PolarHBondContact O-N 2.81Å; S33-A37 PolarHBondContact O-N 3.24Å
34	E	85.6	Confident	75.2	Confident	135 Å²	135	87 Å²	87	63%	0.631	50%	0.503	S	S	*	.	H	α-helix	trans	-75	-42	178.4	-163.1	164.5	-159	0	0	110.4	T30 V31 I36 A37 E38	T30-E34 PolarHBondContact O-N 2.97Å; V31-E34 PolarHBondContact O-N 3.22Å; E34-I36 PolarHBondContact O-N 3.04Å; E34-A37 PolarHBondContact O-N 2.68Å; E34-E38 PolarHBondContact O-N 3.24Å
35	E	88.5	Confident	77.5	Confident	116 Å²	116	88.4 Å²	88.4	54%	0.542	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-41	174.7	-171.5	174.6	-172.7	0	0	112.3	V31 A37 E38 L39	V31-E35 WeakPolarHBondContact O-CB 3.28Å; V31-E35 PolarHBondContact O-N 3.17Å; V31-E35 VanDerWaalsContact O-N 3.09Å; E35-A37 VanDerWaalsContact C-N 3.34Å; E35-A37 PolarHBondContact O-N 2.99Å; E35-E38 PolarHBondContact O-N 3.47Å; E35-L39 HydrophobicContact CG-CD1 4.41Å; E35-L39 WeakPolarHBondContact O-CB 3.25Å; E35-L39 VanDerWaalsContact O-CG 3.28Å; E35-L39 WeakPolarHBondContact O-CG 3.33Å; E35-L39 PolarHBondContact O-N 2.99Å
36	I	89.5	Confident	79.7	Confident	88 Å²	88	90.3 Å²	90.3	45%	0.451	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-38.1	175.7	-70.7	163.6	0	0	0	111.4	E32 E34 L39 Q40	E32-I36 VanDerWaalsContact O-CB 3.32Å; E32-I36 WeakPolarHBondContact O-CB 3.39Å; E32-I36 VanDerWaalsContact O-CD1 3.25Å; E32-I36 WeakPolarHBondContact O-CD1 3.3Å; E32-I36 WeakPolarHBondContact O-CG1 3.27Å; E32-I36 PolarHBondContact O-N 2.95Å; E34-I36 PolarHBondContact O-N 3.04Å; I36-L39 PolarHBondContact O-N 3.09Å; I36-Q40 HydrophobicContact CG2-CG 4.43Å; I36-Q40 WeakPolarHBondContact O-CB 3.33Å; I36-Q40 VanDerWaalsContact O-CG 3.29Å; I36-Q40 WeakPolarHBondContact O-CG 3.31Å; I36-Q40 PolarHBondContact O-N 3.05Å
37	A	91.1	Very high	81.5	Confident	51 Å²	51	90.9 Å²	90.9	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-69.2	-41.6	179.2	0	0	0	0	0	111.8	S33 E34 E35 L39 Q40 Q41	S33-A37 PolarHBondContact O-N 3.24Å; E34-A37 PolarHBondContact O-N 2.68Å; E35-A37 VanDerWaalsContact C-N 3.34Å; E35-A37 PolarHBondContact O-N 2.99Å; A37-L39 VanDerWaalsContact C-N 3.33Å; A37-L39 PolarHBondContact O-N 3.03Å; A37-Q40 PolarHBondContact O-N 2.9Å; A37-Q41 WeakPolarHBondContact O-CB 3.32Å; A37-Q41 PolarHBondContact O-N 3.2Å
38	E	93.3	Very high	83.7	Confident	132 Å²	132	90.5 Å²	90.5	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-60.8	-42.8	173.4	-71.3	-176.7	179	0	0	111.4	E34 E35 Q41 A42	E34-E38 PolarHBondContact O-N 3.24Å; E35-E38 PolarHBondContact O-N 3.47Å; E38-Q41 PolarHBondContact O-N 3.3Å; E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.46Å
39	L	92.1	Very high	85.6	Confident	105 Å²	105	89.8 Å²	89.8	55%	0.55	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-44.7	175.1	-73.5	169.4	0	0	0	112.4	E35 I36 A37 Q41 A42 V43	E35-L39 HydrophobicContact CG-CD1 4.41Å; E35-L39 WeakPolarHBondContact O-CB 3.25Å; E35-L39 VanDerWaalsContact O-CG 3.28Å; E35-L39 WeakPolarHBondContact O-CG 3.33Å; E35-L39 PolarHBondContact O-N 2.99Å; I36-L39 PolarHBondContact O-N 3.09Å; A37-L39 VanDerWaalsContact C-N 3.33Å; A37-L39 PolarHBondContact O-N 3.03Å; L39-Q41 VanDerWaalsContact C-N 3.33Å; L39-Q41 PolarHBondContact O-N 2.96Å; L39-A42 PolarHBondContact O-N 2.9Å; L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.07Å; L39-V43 PolarHBondContact O-N 2.84Å
40	Q	91.6	Very high	87.5	Confident	95 Å²	95	89.8 Å²	89.8	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-42.8	176.9	-76.6	175.8	-6	0	0	111.7	I36 A37 V43 V44 M51	I36-Q40 HydrophobicContact CG2-CG 4.43Å; I36-Q40 WeakPolarHBondContact O-CB 3.33Å; I36-Q40 VanDerWaalsContact O-CG 3.29Å; I36-Q40 WeakPolarHBondContact O-CG 3.31Å; I36-Q40 PolarHBondContact O-N 3.05Å; A37-Q40 PolarHBondContact O-N 2.9Å; Q40-V43 PolarHBondContact O-N 3.16Å; Q40-V44 WeakPolarHBondContact O-CG2 3.32Å; Q40-V44 PolarHBondContact O-N 3.33Å; Q40-V44 VanDerWaalsContact O-N 3.11Å; Q40-M51 HydrophobicContact CB-CG 4.46Å; Q40-M51 HydrophobicContact CG-SD 4.45Å
41	Q	93.4	Very high	89.2	Confident	104 Å²	104	88.3 Å²	88.3	49%	0.486	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-45.1	176.9	-174.5	63	29.8	0	0	111.3	A37 E38 L39 V43 V44 E45	A37-Q41 WeakPolarHBondContact O-CB 3.32Å; A37-Q41 PolarHBondContact O-N 3.2Å; E38-Q41 PolarHBondContact O-N 3.3Å; L39-Q41 VanDerWaalsContact C-N 3.33Å; L39-Q41 PolarHBondContact O-N 2.96Å; Q41-V43 VanDerWaalsContact C-N 3.32Å; Q41-V43 PolarHBondContact O-N 3.34Å; Q41-V44 PolarHBondContact O-N 2.88Å; Q41-E45 PolarHBondContact NE2-OE1 2.97Å; Q41-E45 WeakPolarHBondContact O-CG 3.03Å; Q41-E45 PolarHBondContact O-N 3.24Å
42	A	93.5	Very high	90.8	Very high	48 Å²	48	90.7 Å²	90.7	40%	0.397	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-42.5	177.2	0	0	0	0	0	112.1	E38 L39 E45 E46	E38-A42 WeakPolarHBondContact O-CB 3.45Å; E38-A42 PolarHBondContact O-N 3.46Å; L39-A42 PolarHBondContact O-N 2.9Å; A42-E45 PolarHBondContact O-N 3.48Å; A42-E46 VanDerWaalsContact O-CB 3.28Å; A42-E46 WeakPolarHBondContact O-CB 3.45Å; A42-E46 PolarHBondContact O-N 3.46Å
43	V	92.8	Very high	92.2	Very high	50 Å²	50	91.3 Å²	91.3	30%	0.303	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-43.4	177.5	169.5	0	0	0	0	111.9	L39 Q40 Q41 L47 M51 L54	L39-V43 VanDerWaalsContact O-CG2 3.27Å; L39-V43 WeakPolarHBondContact O-CG2 3.07Å; L39-V43 PolarHBondContact O-N 2.84Å; Q40-V43 PolarHBondContact O-N 3.16Å; Q41-V43 VanDerWaalsContact C-N 3.32Å; Q41-V43 PolarHBondContact O-N 3.34Å; V43-L47 HydrophobicContact CG1-CD1 3.73Å; V43-L47 HydrophobicContact CG1-CG 4.42Å; V43-L47 WeakPolarHBondContact O-CB 3.46Å; V43-L47 WeakPolarHBondContact O-CG 3.39Å; V43-L47 PolarHBondContact O-N 2.93Å; V43-M51 HydrophobicContact CG1-SD 4.25Å; V43-L54 HydrophobicContact CG1-CD2 3.5Å; V43-L54 VanDerWaalsContact CG1-CD2 3.5Å
44	V	94.7	Very high	93	Very high	45 Å²	45	89.5 Å²	89.5	27%	0.273	48%	0.475	S	S	.	.	H	α-helix	trans	-63.6	-44	177.7	169.2	0	0	0	0	111.2	Q40 Q41 G48 M51	Q40-V44 WeakPolarHBondContact O-CG2 3.32Å; Q40-V44 PolarHBondContact O-N 3.33Å; Q40-V44 VanDerWaalsContact O-N 3.11Å; Q41-V44 PolarHBondContact O-N 2.88Å; V44-G48 WeakPolarHBondContact O-CA 3.07Å; V44-G48 PolarHBondContact O-N 3.48Å; V44-M51 HydrophobicContact CG2-CB 4.47Å; V44-M51 HydrophobicContact CG2-CG 3.75Å; V44-M51 HydrophobicContact CG2-SD 4.43Å
45	E	95.2	Very high	93.4	Very high	141 Å²	141	90.5 Å²	90.5	66%	0.659	47%	0.473	S	S	*	.	H	α-helix	trans	-67.6	-40.7	179.4	-72.7	179.2	-168.9	0	0	112.5	Q41 A42	Q41-E45 PolarHBondContact NE2-OE1 2.97Å; Q41-E45 WeakPolarHBondContact O-CG 3.03Å; Q41-E45 PolarHBondContact O-N 3.24Å; A42-E45 PolarHBondContact O-N 3.48Å
46	E	95.7	Very high	93.9	Very high	173 Å²	173	90.3 Å²	90.3	81%	0.808	47%	0.472	S	S	*	.	H	α-helix	trans	-76.9	-40.6	-176.6	-174.7	158.4	-149.3	0	0	112.9	A42	A42-E46 VanDerWaalsContact O-CB 3.28Å; A42-E46 WeakPolarHBondContact O-CB 3.45Å; A42-E46 PolarHBondContact O-N 3.46Å
47	L	91.9	Very high	94.2	Very high	99 Å²	99	90.9 Å²	90.9	52%	0.518	47%	0.471	S	S	.	.	H	α-helix	trans	-86.3	-16.5	-179.7	-61.1	179	0	0	0	113.2	V43 I49 L54	V43-L47 HydrophobicContact CG1-CD1 3.73Å; V43-L47 HydrophobicContact CG1-CG 4.42Å; V43-L47 WeakPolarHBondContact O-CB 3.46Å; V43-L47 WeakPolarHBondContact O-CG 3.39Å; V43-L47 PolarHBondContact O-N 2.93Å; L47-I49 HydrophobicContact CB-CD1 4.3Å; L47-I49 HydrophobicContact CB-CG1 3.81Å; L47-I49 HydrophobicContact CD1-CD1 4.39Å; L47-I49 PolarHBondContact O-N 3.32Å; L47-L54 HydrophobicContact CD1-CD1 4.32Å; L47-L54 HydrophobicContact CD1-CD2 4.33Å
48	G	94.5	Very high	94.4	Very high	68 Å²	68	92.5 Å²	92.5	70%	0.701	47%	0.472	S	S	*	.			trans	65	19.7	-179.4	0	0	0	0	0	114.1	V44	V44-G48 WeakPolarHBondContact O-CA 3.07Å; V44-G48 PolarHBondContact O-N 3.48Å
49	I	93.9	Very high	94.6	Very high	43 Å²	43	90.7 Å²	90.7	22%	0.221	47%	0.467	C	S	.	.	S	Bend	trans	-122.2	154.1	176.2	62.8	176.7	0	0	0	109.3	L47 E53 L54 F57	L47-I49 HydrophobicContact CB-CD1 4.3Å; L47-I49 HydrophobicContact CB-CG1 3.81Å; L47-I49 HydrophobicContact CD1-CD1 4.39Å; L47-I49 PolarHBondContact O-N 3.32Å; I49-E53 HydrophobicContact CB-CB 4.18Å; I49-L54 HydrophobicContact CD1-CB 3.94Å; I49-L54 HydrophobicContact CD1-CD1 4.29Å; I49-F57 HydrophobicContact CD1-CD2 4.03Å; I49-F57 HydrophobicContact CD1-CE2 4.03Å
50	S	95.4	Very high	94.8	Very high	47 Å²	47	90 Å²	90	33%	0.329	46%	0.46	S	S	.	.			trans	-70	157.9	173.7	65.9	0	0	0	0	111.8	E52 E53 L54	S50-E52 PolarHBondContact O-N 2.97Å; S50-E53 WeakPolarHBondContact CB-OE2 3.46Å; S50-E53 PolarHBondContact N-OE2 3.43Å; S50-E53 PolarHBondContact O-N 3.45Å; S50-E53 VanDerWaalsContact OG-CG 3.31Å; S50-E53 WeakPolarHBondContact OG-CG 3.31Å; S50-E53 PolarHBondContact OG-N 3.28Å; S50-E53 PolarHBondContact OG-OE2 3.4Å; S50-L54 PolarHBondContact O-N 3.04Å
51	M	94.6	Very high	95.1	Very high	64 Å²	64	90.8 Å²	90.8	32%	0.315	46%	0.464	S	S	.	.	H	α-helix	trans	-59.1	-29.4	172.7	-87.4	-53.9	-52.5	0	0	112.9	Q40 V43 V44 L54 R55	Q40-M51 HydrophobicContact CB-CG 4.46Å; Q40-M51 HydrophobicContact CG-SD 4.45Å; V43-M51 HydrophobicContact CG1-SD 4.25Å; V44-M51 HydrophobicContact CG2-CB 4.47Å; V44-M51 HydrophobicContact CG2-CG 3.75Å; V44-M51 HydrophobicContact CG2-SD 4.43Å; M51-L54 HydrophobicContact CE-CD2 4.28Å; M51-L54 HydrophobicContact SD-CD2 4.09Å; M51-R55 WeakPolarHBondContact O-CB 3.4Å; M51-R55 PolarHBondContact O-N 3.13Å
52	E	95.1	Very high	95.3	Very high	142 Å²	142	89.6 Å²	89.6	66%	0.664	46%	0.46	S	S	*	.	H	α-helix	trans	-68.7	-44.7	176.2	-172.7	61	-149	0	0	111.2	S50 L54 R55 H56	S50-E52 PolarHBondContact O-N 2.97Å; E52-L54 VanDerWaalsContact C-N 3.34Å; E52-L54 PolarHBondContact O-N 3.48Å; E52-R55 WeakPolarHBondContact O-CB 3.42Å; E52-R55 PolarHBondContact O-N 3.32Å; E52-H56 PolarHBondContact O-N 3.34Å
53	E	95.3	Very high	95.4	Very high	95 Å²	95	91 Å²	91	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-41.1	176.1	-73.5	164.4	121.2	0	0	111.5	I49 S50 R55 H56 F57	I49-E53 HydrophobicContact CB-CB 4.18Å; S50-E53 WeakPolarHBondContact CB-OE2 3.46Å; S50-E53 PolarHBondContact N-OE2 3.43Å; S50-E53 PolarHBondContact O-N 3.45Å; S50-E53 VanDerWaalsContact OG-CG 3.31Å; S50-E53 WeakPolarHBondContact OG-CG 3.31Å; S50-E53 PolarHBondContact OG-N 3.28Å; S50-E53 PolarHBondContact OG-OE2 3.4Å; E53-R55 VanDerWaalsContact C-N 3.33Å; E53-R55 PolarHBondContact O-N 3.15Å; E53-H56 PolarHBondContact O-N 3.3Å; E53-F57 HydrophobicContact CB-CE2 4.31Å; E53-F57 WeakPolarHBondContact O-CD2 3.31Å; E53-F57 WeakPolarHBondContact O-CG 3.31Å; E53-F57 PolarHBondContact O-N 2.96Å
54	L	95.1	Very high	95.6	Very high	38 Å²	38	93.6 Å²	93.6	20%	0.199	47%	0.466	C	S	.	.	H	α-helix	trans	-61.1	-42.5	174.1	179.6	59.1	0	0	0	111.7	V43 L47 I49 S50 M51 E52 H56 F57 I58	V43-L54 HydrophobicContact CG1-CD2 3.5Å; V43-L54 VanDerWaalsContact CG1-CD2 3.5Å; L47-L54 HydrophobicContact CD1-CD1 4.32Å; L47-L54 HydrophobicContact CD1-CD2 4.33Å; I49-L54 HydrophobicContact CD1-CB 3.94Å; I49-L54 HydrophobicContact CD1-CD1 4.29Å; S50-L54 PolarHBondContact O-N 3.04Å; M51-L54 HydrophobicContact CE-CD2 4.28Å; M51-L54 HydrophobicContact SD-CD2 4.09Å; E52-L54 VanDerWaalsContact C-N 3.34Å; E52-L54 PolarHBondContact O-N 3.48Å; L54-H56 VanDerWaalsContact C-N 3.34Å; L54-F57 PolarHBondContact O-N 3.38Å; L54-I58 HydrophobicContact CD1-CD1 4.22Å; L54-I58 HydrophobicContact CD1-CG1 4.43Å; L54-I58 HydrophobicContact CG-CD1 4.04Å; L54-I58 VanDerWaalsContact O-CG1 3.31Å; L54-I58 WeakPolarHBondContact O-CG1 3.19Å; L54-I58 PolarHBondContact O-N 2.84Å
55	R	95.2	Very high	95.8	Very high	157 Å²	157	95.7 Å²	95.7	59%	0.592	47%	0.474	S	S	*	.	H	α-helix	trans	-62.4	-44	176.8	-132.4	152.7	-169.9	-110.2	-2	111.6	M51 E52 E53 F57 I58 D59	M51-R55 WeakPolarHBondContact O-CB 3.4Å; M51-R55 PolarHBondContact O-N 3.13Å; E52-R55 WeakPolarHBondContact O-CB 3.42Å; E52-R55 PolarHBondContact O-N 3.32Å; E53-R55 VanDerWaalsContact C-N 3.33Å; E53-R55 PolarHBondContact O-N 3.15Å; R55-F57 PolarHBondContact O-N 2.55Å; R55-I58 PolarHBondContact O-N 3.3Å; R55-D59 PolarHBondContact O-N 3.14Å
56	H	97.3	Very high	95.9	Very high	111 Å²	111	95.2 Å²	95.2	51%	0.514	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-44.2	175.9	-176.9	58.1	0	0	0	112.2	E52 E53 L54 D59 E60	E52-H56 PolarHBondContact O-N 3.34Å; E53-H56 PolarHBondContact O-N 3.3Å; L54-H56 VanDerWaalsContact C-N 3.34Å; H56-D59 PolarHBondContact O-N 3.14Å; H56-E60 VanDerWaalsContact O-CB 3.31Å; H56-E60 WeakPolarHBondContact O-CB 3.43Å; H56-E60 PolarHBondContact O-N 3.46Å
57	F	96.3	Very high	96	Very high	101 Å²	101	90.6 Å²	90.6	44%	0.443	46%	0.462	S	S	.	.	H	α-helix	trans	-64.4	-40	176.2	-67.2	-47.4	0	0	0	112.6	I49 E53 L54 R55 E60 E61	I49-F57 HydrophobicContact CD1-CD2 4.03Å; I49-F57 HydrophobicContact CD1-CE2 4.03Å; E53-F57 HydrophobicContact CB-CE2 4.31Å; E53-F57 WeakPolarHBondContact O-CD2 3.31Å; E53-F57 WeakPolarHBondContact O-CG 3.31Å; E53-F57 PolarHBondContact O-N 2.96Å; L54-F57 PolarHBondContact O-N 3.38Å; R55-F57 PolarHBondContact O-N 2.55Å; F57-E60 PolarHBondContact O-N 2.73Å; F57-E61 VanDerWaalsContact O-CB 3.31Å; F57-E61 WeakPolarHBondContact O-CB 3.49Å; F57-E61 PolarHBondContact O-N 3.2Å
58	I	96.1	Very high	96.2	Very high	85 Å²	85	87.9 Å²	87.9	44%	0.436	45%	0.45	S	S	.	.	H	α-helix	trans	-61.3	-49.4	174.9	-69.1	165.5	0	0	0	109.7	L54 R55 E60 E61 L62	L54-I58 HydrophobicContact CD1-CD1 4.22Å; L54-I58 HydrophobicContact CD1-CG1 4.43Å; L54-I58 HydrophobicContact CG-CD1 4.04Å; L54-I58 VanDerWaalsContact O-CG1 3.31Å; L54-I58 WeakPolarHBondContact O-CG1 3.19Å; L54-I58 PolarHBondContact O-N 2.84Å; R55-I58 PolarHBondContact O-N 3.3Å; I58-E60 PolarHBondContact O-N 3.32Å; I58-E61 PolarHBondContact O-N 3.49Å; I58-L62 HydrophobicContact CG2-CD1 3.79Å; I58-L62 HydrophobicContact CG2-CG 4.19Å; I58-L62 WeakPolarHBondContact O-CB 3.47Å; I58-L62 WeakPolarHBondContact O-CG 3.49Å; I58-L62 PolarHBondContact O-N 2.99Å
59	D	96.7	Very high	96.4	Very high	94 Å²	94	89.2 Å²	89.2	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-42.6	179.6	-70.5	-21.3	0	0	0	111.8	R55 H56 L62 E63	R55-D59 PolarHBondContact O-N 3.14Å; H56-D59 PolarHBondContact O-N 3.14Å; D59-L62 PolarHBondContact O-N 3.38Å; D59-E63 WeakPolarHBondContact O-CB 3.33Å; D59-E63 PolarHBondContact O-N 3.46Å
60	E	97.5	Very high	96.6	Very high	89 Å²	89	92.8 Å²	92.8	42%	0.416	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-42.3	176.8	-170.9	-172.4	-164.7	0	0	111.6	H56 F57 I58 E63	H56-E60 VanDerWaalsContact O-CB 3.31Å; H56-E60 WeakPolarHBondContact O-CB 3.43Å; H56-E60 PolarHBondContact O-N 3.46Å; F57-E60 PolarHBondContact O-N 2.73Å; I58-E60 PolarHBondContact O-N 3.32Å; E60-E63 WeakPolarHBondContact O-CB 3.4Å; E60-E63 PolarHBondContact O-N 3.07Å
61	E	97.8	Very high	96.7	Very high	113 Å²	113	99.9 Å²	99.9	53%	0.528	47%	0.473	S	S	.	.	H	α-helix	trans	-72.8	-37.3	179.3	-157.5	62.3	-149.5	0	0	111.7	F57 I58 E63 K64	F57-E61 VanDerWaalsContact O-CB 3.31Å; F57-E61 WeakPolarHBondContact O-CB 3.49Å; F57-E61 PolarHBondContact O-N 3.2Å; I58-E61 PolarHBondContact O-N 3.49Å; E61-E63 VanDerWaalsContact C-N 3.27Å; E61-E63 PolarHBondContact O-N 3.25Å; E61-K64 WeakPolarHBondContact O-CB 3.45Å; E61-K64 PolarHBondContact O-N 2.94Å; E61-K64 VanDerWaalsContact O-N 3.15Å; E61-K64 IonicContact OE2-NZ 2.55Å; E61-K64 PolarHBondContact OE2-NZ 3.45Å
62	L	96.7	Very high	96.8	Very high	78 Å²	78	101.8 Å²	101.8	41%	0.408	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-36.9	171.7	-73.4	176.8	0	0	0	111.5	I58 D59 K64 M65 V68	I58-L62 HydrophobicContact CG2-CD1 3.79Å; I58-L62 HydrophobicContact CG2-CG 4.19Å; I58-L62 WeakPolarHBondContact O-CB 3.47Å; I58-L62 WeakPolarHBondContact O-CG 3.49Å; I58-L62 PolarHBondContact O-N 2.99Å; D59-L62 PolarHBondContact O-N 3.38Å; L62-K64 PolarHBondContact O-N 3.15Å; L62-M65 HydrophobicContact CD2-SD 3.56Å; L62-M65 VanDerWaalsContact CD2-SD 3.56Å; L62-M65 WeakPolarHBondContact O-CB 3.45Å; L62-M65 PolarHBondContact O-N 3.09Å; L62-M65 VanDerWaalsContact O-N 3.07Å; L62-V68 WeakPolarHBondContact O-CB 3.43Å; L62-V68 WeakPolarHBondContact O-CG2 3.43Å
63	E	96.4	Very high	96.9	Very high	78 Å²	78	101.4 Å²	101.4	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-64.1	-24.3	177.6	-164.3	60.2	-157.4	0	0	113.2	D59 E60 E61 M65 Q69 K72	D59-E63 WeakPolarHBondContact O-CB 3.33Å; D59-E63 PolarHBondContact O-N 3.46Å; E60-E63 WeakPolarHBondContact O-CB 3.4Å; E60-E63 PolarHBondContact O-N 3.07Å; E61-E63 VanDerWaalsContact C-N 3.27Å; E61-E63 PolarHBondContact O-N 3.25Å; E63-M65 VanDerWaalsContact C-N 3.31Å; E63-Q69 VanDerWaalsContact O-CG 3.29Å; E63-Q69 WeakPolarHBondContact O-CG 3.36Å; E63-Q69 PolarHBondContact O-NE2 3.41Å; E63-K72 IonicContact OE1-NZ 2.73Å; E63-K72 PolarHBondContact OE1-NZ 3.49Å; E63-K72 WeakPolarHBondContact OE2-CE 3.36Å; E63-K72 IonicContact OE2-NZ 3.31Å; E63-K72 PolarHBondContact OE2-NZ 2.73Å
64	K	96.8	Very high	97	Very high	104 Å²	104	101.4 Å²	101.4	45%	0.452	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.4	176.8	-62.3	168.9	-162.2	162.8	0	112.5	E61 L62 D66	E61-K64 WeakPolarHBondContact O-CB 3.45Å; E61-K64 PolarHBondContact O-N 2.94Å; E61-K64 VanDerWaalsContact O-N 3.15Å; E61-K64 IonicContact OE2-NZ 2.55Å; E61-K64 PolarHBondContact OE2-NZ 3.45Å; L62-K64 PolarHBondContact O-N 3.15Å; K64-D66 PolarHBondContact O-N 2.91Å
65	M	98.1	Very high	97.1	Very high	90 Å²	90	104.3 Å²	104.3	44%	0.443	49%	0.491	S	S	.	.			trans	-73.1	126.4	-178.3	-61.3	-178.3	70.1	0	0	111.3	L62 E63 C67 V68 Q69	L62-M65 HydrophobicContact CD2-SD 3.56Å; L62-M65 VanDerWaalsContact CD2-SD 3.56Å; L62-M65 WeakPolarHBondContact O-CB 3.45Å; L62-M65 PolarHBondContact O-N 3.09Å; L62-M65 VanDerWaalsContact O-N 3.07Å; E63-M65 VanDerWaalsContact C-N 3.31Å; M65-C67 PolarHBondContact O-N 3.28Å; M65-C67 VanDerWaalsContact O-N 3.15Å; M65-V68 HydrophobicContact CB-CB 4.36Å; M65-V68 HydrophobicContact CB-CG2 4.05Å; M65-V68 WeakPolarHBondContact O-CB 3.46Å; M65-V68 PolarHBondContact O-N 3.43Å; M65-Q69 PolarHBondContact O-N 3.26Å; M65-Q69 VanDerWaalsContact O-N 3.09Å
66	D	98.3	Very high	97.1	Very high	130 Å²	130	99.2 Å²	99.2	70%	0.695	48%	0.482	S	S	*	.	H	α-helix	trans	-54.3	-38.1	-179.5	-71	-24.8	0	0	0	113	K64 V68 Q69 Q70	K64-D66 PolarHBondContact O-N 2.91Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.86Å; D66-Q69 PolarHBondContact O-N 3.36Å; D66-Q70 WeakPolarHBondContact O-CB 3.29Å; D66-Q70 PolarHBondContact O-N 3.43Å
67	C	96.3	Very high	97.1	Very high	77 Å²	77	98.4 Å²	98.4	52%	0.52	48%	0.478	S	S	.	.	H	α-helix	trans	-66	-34.8	179.5	62.9	0	0	0	0	112.6	M65 R71	M65-C67 PolarHBondContact O-N 3.28Å; M65-C67 VanDerWaalsContact O-N 3.15Å; C67-R71 WeakPolarHBondContact O-CB 3.49Å; C67-R71 PolarHBondContact O-N 3.33Å; C67-R71 VanDerWaalsContact O-N 3.08Å
68	V	97.3	Very high	97.1	Very high	42 Å²	42	98.6 Å²	98.6	26%	0.255	48%	0.484	S	S	.	.	H	α-helix	trans	-70.6	-48.3	176.3	174.9	0	0	0	0	109.3	L62 M65 D66 Q70 R71 K72	L62-V68 WeakPolarHBondContact O-CB 3.43Å; L62-V68 WeakPolarHBondContact O-CG2 3.43Å; M65-V68 HydrophobicContact CB-CB 4.36Å; M65-V68 HydrophobicContact CB-CG2 4.05Å; M65-V68 WeakPolarHBondContact O-CB 3.46Å; M65-V68 PolarHBondContact O-N 3.43Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.86Å; V68-Q70 PolarHBondContact O-N 3.16Å; V68-R71 PolarHBondContact O-N 3.35Å; V68-K72 WeakPolarHBondContact O-CG 3.41Å; V68-K72 PolarHBondContact O-N 3.27Å
69	Q	98.1	Very high	97	Very high	96 Å²	96	98.3 Å²	98.3	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-43.6	177.6	-65.4	-171.5	-7.5	0	0	112.3	E63 M65 D66 R71 K72 K73	E63-Q69 VanDerWaalsContact O-CG 3.29Å; E63-Q69 WeakPolarHBondContact O-CG 3.36Å; E63-Q69 PolarHBondContact O-NE2 3.41Å; M65-Q69 PolarHBondContact O-N 3.26Å; M65-Q69 VanDerWaalsContact O-N 3.09Å; D66-Q69 PolarHBondContact O-N 3.36Å; Q69-R71 PolarHBondContact O-N 2.95Å; Q69-K72 PolarHBondContact O-N 3.08Å; Q69-K73 WeakPolarHBondContact O-CB 3.33Å; Q69-K73 PolarHBondContact O-N 2.91Å
70	Q	98.4	Very high	97	Very high	118 Å²	118	98.1 Å²	98.1	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-61.1	-45.7	177	-177.9	176.8	-0.1	0	0	111.1	D66 V68 K73 Q74	D66-Q70 WeakPolarHBondContact O-CB 3.29Å; D66-Q70 PolarHBondContact O-N 3.43Å; V68-Q70 PolarHBondContact O-N 3.16Å; Q70-K73 WeakPolarHBondContact O-CB 3.14Å; Q70-K73 PolarHBondContact O-N 2.91Å; Q70-Q74 WeakPolarHBondContact O-CG 3.42Å; Q70-Q74 PolarHBondContact O-N 3.37Å
71	R	97.5	Very high	97	Very high	195 Å²	195	101.7 Å²	101.7	74%	0.736	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-40	179.1	-169	175.3	-177.2	123.5	-0.9	111.8	C67 V68 Q69 K73 Q74 L75	C67-R71 WeakPolarHBondContact O-CB 3.49Å; C67-R71 PolarHBondContact O-N 3.33Å; C67-R71 VanDerWaalsContact O-N 3.08Å; V68-R71 PolarHBondContact O-N 3.35Å; Q69-R71 PolarHBondContact O-N 2.95Å; R71-K73 VanDerWaalsContact C-N 3.34Å; R71-K73 PolarHBondContact O-N 3.35Å; R71-Q74 PolarHBondContact O-N 3.49Å; R71-L75 WeakPolarHBondContact O-CB 3.5Å; R71-L75 PolarHBondContact O-N 3.44Å
72	K	96.9	Very high	96.9	Very high	105 Å²	105	98.5 Å²	98.5	46%	0.457	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-42.9	173.3	-75.4	-171.8	177.8	-171	0	112.1	E63 V68 Q69 L75 A76	E63-K72 IonicContact OE1-NZ 2.73Å; E63-K72 PolarHBondContact OE1-NZ 3.49Å; E63-K72 WeakPolarHBondContact OE2-CE 3.36Å; E63-K72 IonicContact OE2-NZ 3.31Å; E63-K72 PolarHBondContact OE2-NZ 2.73Å; V68-K72 WeakPolarHBondContact O-CG 3.41Å; V68-K72 PolarHBondContact O-N 3.27Å; Q69-K72 PolarHBondContact O-N 3.08Å; K72-L75 PolarHBondContact O-N 3.44Å; K72-A76 PolarHBondContact O-N 2.95Å
73	K	97.9	Very high	96.8	Very high	134 Å²	134	100.2 Å²	100.2	58%	0.583	49%	0.489	S	S	*	.	H	α-helix	trans	-62.2	-47.8	175.9	-177.4	-180	173.8	-178.1	0	111.6	Q69 Q70 R71 L75 A76 E77	Q69-K73 WeakPolarHBondContact O-CB 3.33Å; Q69-K73 PolarHBondContact O-N 2.91Å; Q70-K73 WeakPolarHBondContact O-CB 3.14Å; Q70-K73 PolarHBondContact O-N 2.91Å; R71-K73 VanDerWaalsContact C-N 3.34Å; R71-K73 PolarHBondContact O-N 3.35Å; K73-L75 VanDerWaalsContact C-N 3.26Å; K73-L75 PolarHBondContact O-N 2.82Å; K73-A76 PolarHBondContact O-N 3.14Å; K73-E77 WeakPolarHBondContact CE-OE1 3.49Å; K73-E77 WeakPolarHBondContact O-CG 3.3Å; K73-E77 PolarHBondContact O-N 2.95Å
74	Q	96.6	Very high	96.8	Very high	95 Å²	95	100.7 Å²	100.7	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-59.2	-39.5	176.7	-71.9	175.1	-43.4	0	0	111.8	Q70 R71 E77 L78	Q70-Q74 WeakPolarHBondContact O-CG 3.42Å; Q70-Q74 PolarHBondContact O-N 3.37Å; R71-Q74 PolarHBondContact O-N 3.49Å; Q74-E77 PolarHBondContact O-N 3.26Å; Q74-L78 WeakPolarHBondContact O-CB 3.46Å; Q74-L78 WeakPolarHBondContact O-CG 3.38Å; Q74-L78 PolarHBondContact O-N 3.34Å
75	L	96.5	Very high	96.9	Very high	99 Å²	99	101.6 Å²	101.6	52%	0.518	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-46	177.2	-170.1	64.5	0	0	0	111.6	R71 K72 K73 E77 L78 E79	R71-L75 WeakPolarHBondContact O-CB 3.5Å; R71-L75 PolarHBondContact O-N 3.44Å; K72-L75 PolarHBondContact O-N 3.44Å; K73-L75 VanDerWaalsContact C-N 3.26Å; K73-L75 PolarHBondContact O-N 2.82Å; L75-E77 VanDerWaalsContact C-N 3.32Å; L75-E77 PolarHBondContact O-N 3.41Å; L75-L78 WeakPolarHBondContact O-CB 3.2Å; L75-L78 PolarHBondContact O-N 3.5Å; L75-L78 VanDerWaalsContact O-N 3.16Å; L75-E79 WeakPolarHBondContact O-CG 3.39Å; L75-E79 PolarHBondContact O-N 3.47Å
76	A	96.2	Very high	96.6	Very high	49 Å²	49	100 Å²	100	41%	0.405	49%	0.487	S	S	.	.	H	α-helix	trans	-63.2	-37.1	177.5	0	0	0	0	0	112.8	K72 K73 T80	K72-A76 PolarHBondContact O-N 2.95Å; K73-A76 PolarHBondContact O-N 3.14Å; A76-T80 PolarHBondContact O-N 3.26Å; A76-T80 VanDerWaalsContact O-N 3.14Å; A76-T80 PolarHBondContact O-OG1 2.95Å
77	E	97.1	Very high	96.5	Very high	94 Å²	94	97.7 Å²	97.7	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-46	172.6	-73.6	174	-171.8	0	0	110.9	K73 Q74 L75 T80 W81	K73-E77 WeakPolarHBondContact CE-OE1 3.49Å; K73-E77 WeakPolarHBondContact O-CG 3.3Å; K73-E77 PolarHBondContact O-N 2.95Å; Q74-E77 PolarHBondContact O-N 3.26Å; L75-E77 VanDerWaalsContact C-N 3.32Å; L75-E77 PolarHBondContact O-N 3.41Å; E77-T80 WeakPolarHBondContact O-CB 3.38Å; E77-T80 PolarHBondContact O-N 2.88Å; E77-W81 PolarHBondContact O-N 3.43Å
78	L	96.3	Very high	96.6	Very high	106 Å²	106	97.7 Å²	97.7	56%	0.555	47%	0.473	S	S	*	.	H	α-helix	trans	-62.1	-43.1	176.9	-76.6	168.5	0	0	0	112.5	Q74 L75 T80 W81 V82	Q74-L78 WeakPolarHBondContact O-CB 3.46Å; Q74-L78 WeakPolarHBondContact O-CG 3.38Å; Q74-L78 PolarHBondContact O-N 3.34Å; L75-L78 WeakPolarHBondContact O-CB 3.2Å; L75-L78 PolarHBondContact O-N 3.5Å; L75-L78 VanDerWaalsContact O-N 3.16Å; L78-T80 VanDerWaalsContact C-N 3.27Å; L78-T80 PolarHBondContact O-N 3.47Å; L78-W81 PolarHBondContact O-N 2.95Å; L78-W81 VanDerWaalsContact O-N 3.17Å; L78-V82 WeakPolarHBondContact O-CG2 3.49Å; L78-V82 PolarHBondContact O-N 3.34Å
79	E	94.3	Very high	96.6	Very high	79 Å²	79	98.3 Å²	98.3	37%	0.369	48%	0.477	S	S	.	.	H	α-helix	trans	-56.6	-43.7	174.9	-75.6	176.3	-178.3	0	0	111.1	L75 W81 V82 I83	L75-E79 WeakPolarHBondContact O-CG 3.39Å; L75-E79 PolarHBondContact O-N 3.47Å; E79-W81 PolarHBondContact O-N 3.49Å; E79-V82 PolarHBondContact O-N 2.93Å; E79-I83 VanDerWaalsContact O-CG1 3.3Å; E79-I83 WeakPolarHBondContact O-CG1 3.47Å; E79-I83 PolarHBondContact O-N 3.35Å
80	T	95.8	Very high	96.5	Very high	90 Å²	90	96.3 Å²	96.3	55%	0.552	48%	0.476	S	S	*	.	H	α-helix	trans	-63.1	-43.9	177.1	-55.4	0	0	0	0	111.6	A76 E77 L78 V82 I83 Q84	A76-T80 PolarHBondContact O-N 3.26Å; A76-T80 VanDerWaalsContact O-N 3.14Å; A76-T80 PolarHBondContact O-OG1 2.95Å; E77-T80 WeakPolarHBondContact O-CB 3.38Å; E77-T80 PolarHBondContact O-N 2.88Å; L78-T80 VanDerWaalsContact C-N 3.27Å; L78-T80 PolarHBondContact O-N 3.47Å; T80-V82 PolarHBondContact O-N 3.48Å; T80-I83 PolarHBondContact O-N 3.17Å; T80-Q84 PolarHBondContact O-N 3Å
81	W	96.9	Very high	96.5	Very high	164 Å²	164	95.8 Å²	95.8	62%	0.621	47%	0.474	S	S	*	.	H	α-helix	trans	-62.5	-40.4	177	-79.7	114.4	0	0	0	112.8	E77 L78 E79 Q84 K85	E77-W81 PolarHBondContact O-N 3.43Å; L78-W81 PolarHBondContact O-N 2.95Å; L78-W81 VanDerWaalsContact O-N 3.17Å; E79-W81 PolarHBondContact O-N 3.49Å; W81-Q84 PolarHBondContact O-N 3.04Å; W81-K85 WeakPolarHBondContact O-CB 3.33Å; W81-K85 PolarHBondContact O-N 3.05Å
82	V	96.4	Very high	96.5	Very high	46 Å²	46	90.7 Å²	90.7	28%	0.279	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-50.7	176.9	169.6	0	0	0	0	110.3	I9 L78 E79 T80 Q84 K85 E86	I9-V82 HydrophobicContact CD1-CG1 4.09Å; L78-V82 WeakPolarHBondContact O-CG2 3.49Å; L78-V82 PolarHBondContact O-N 3.34Å; E79-V82 PolarHBondContact O-N 2.93Å; T80-V82 PolarHBondContact O-N 3.48Å; V82-Q84 VanDerWaalsContact C-N 3.3Å; V82-Q84 PolarHBondContact O-N 2.9Å; V82-K85 PolarHBondContact O-N 3.49Å; V82-E86 HydrophobicContact CG1-CG 4.31Å; V82-E86 WeakPolarHBondContact O-CG 3.41Å; V82-E86 PolarHBondContact O-N 3.07Å
83	I	95	Very high	96.5	Very high	113 Å²	113	89.8 Å²	89.8	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-57.7	-45.2	179	-67.7	164.7	0	0	0	110.9	E79 T80 K85 E86 S87	E79-I83 VanDerWaalsContact O-CG1 3.3Å; E79-I83 WeakPolarHBondContact O-CG1 3.47Å; E79-I83 PolarHBondContact O-N 3.35Å; T80-I83 PolarHBondContact O-N 3.17Å; I83-K85 VanDerWaalsContact C-N 3.33Å; I83-K85 PolarHBondContact O-N 3.37Å; I83-E86 PolarHBondContact O-N 2.99Å; I83-S87 PolarHBondContact O-N 3.21Å; I83-S87 VanDerWaalsContact O-N 3.07Å
84	Q	97.2	Very high	96.5	Very high	89 Å²	89	88.8 Å²	88.8	42%	0.416	46%	0.462	S	S	.	.	H	α-helix	trans	-59.6	-46.4	176.2	-179.3	-178.8	-17.3	0	0	110.9	T80 W81 V82 E86 S87 E88	T80-Q84 PolarHBondContact O-N 3Å; W81-Q84 PolarHBondContact O-N 3.04Å; V82-Q84 VanDerWaalsContact C-N 3.3Å; V82-Q84 PolarHBondContact O-N 2.9Å; Q84-E86 PolarHBondContact O-N 3.46Å; Q84-S87 WeakPolarHBondContact O-CB 3.04Å; Q84-S87 PolarHBondContact O-N 3.49Å; Q84-E88 PolarHBondContact NE2-OE1 3.3Å; Q84-E88 WeakPolarHBondContact O-CG 3.47Å; Q84-E88 PolarHBondContact O-N 2.91Å
85	K	97.3	Very high	96.6	Very high	122 Å²	122	88.7 Å²	88.7	53%	0.53	46%	0.464	S	S	.	.	H	α-helix	trans	-68.3	-36.8	-175.7	-166.1	62.5	-175.5	170.9	0	112.6	W81 V82 I83 S87 E88 V89	W81-K85 WeakPolarHBondContact O-CB 3.33Å; W81-K85 PolarHBondContact O-N 3.05Å; V82-K85 PolarHBondContact O-N 3.49Å; I83-K85 VanDerWaalsContact C-N 3.33Å; I83-K85 PolarHBondContact O-N 3.37Å; K85-S87 VanDerWaalsContact C-N 3.34Å; K85-E88 WeakPolarHBondContact CD-OE2 3.46Å; K85-E88 IonicContact NZ-OE2 2.63Å; K85-E88 PolarHBondContact NZ-OE2 3.24Å; K85-E88 PolarHBondContact O-N 3.5Å; K85-V89 WeakPolarHBondContact O-CG2 3.47Å; K85-V89 PolarHBondContact O-N 2.96Å
86	E	93.4	Very high	96.7	Very high	58 Å²	58	90.7 Å²	90.7	27%	0.271	47%	0.468	S	S	.	.	H	α-helix	trans	-62.5	-42.4	173.2	-72.1	-179.9	160.8	0	0	111.5	V82 I83 Q84 E88 V89 A90	V82-E86 HydrophobicContact CG1-CG 4.31Å; V82-E86 WeakPolarHBondContact O-CG 3.41Å; V82-E86 PolarHBondContact O-N 3.07Å; I83-E86 PolarHBondContact O-N 2.99Å; Q84-E86 PolarHBondContact O-N 3.46Å; E86-E88 VanDerWaalsContact C-N 3.34Å; E86-E88 PolarHBondContact O-N 3.01Å; E86-V89 PolarHBondContact O-N 3.24Å; E86-A90 WeakPolarHBondContact O-CB 3.36Å; E86-A90 PolarHBondContact O-N 2.96Å
87	S	96.3	Very high	96.8	Very high	80 Å²	80	92.9 Å²	92.9	56%	0.559	47%	0.474	S	S	*	.	H	α-helix	trans	-62.8	-39.3	174.2	-177.2	0	0	0	0	112.5	I83 Q84 K85 H91	I83-S87 PolarHBondContact O-N 3.21Å; I83-S87 VanDerWaalsContact O-N 3.07Å; Q84-S87 WeakPolarHBondContact O-CB 3.04Å; Q84-S87 PolarHBondContact O-N 3.49Å; K85-S87 VanDerWaalsContact C-N 3.34Å; S87-H91 WeakPolarHBondContact O-CB 3.39Å; S87-H91 PolarHBondContact O-N 3.46Å; S87-H91 VanDerWaalsContact O-N 3.07Å
88	E	97.6	Very high	96.9	Very high	77 Å²	77	91.2 Å²	91.2	36%	0.36	47%	0.468	S	S	.	.	H	α-helix	trans	-65.2	-43.1	176	-73	175	-169.4	0	0	111.9	Q84 K85 E86 H91 V92	Q84-E88 PolarHBondContact NE2-OE1 3.3Å; Q84-E88 WeakPolarHBondContact O-CG 3.47Å; Q84-E88 PolarHBondContact O-N 2.91Å; K85-E88 WeakPolarHBondContact CD-OE2 3.46Å; K85-E88 IonicContact NZ-OE2 2.63Å; K85-E88 PolarHBondContact NZ-OE2 3.24Å; K85-E88 PolarHBondContact O-N 3.5Å; E86-E88 VanDerWaalsContact C-N 3.34Å; E86-E88 PolarHBondContact O-N 3.01Å; E88-H91 PolarHBondContact O-N 2.97Å; E88-V92 WeakPolarHBondContact O-CG2 3.21Å; E88-V92 PolarHBondContact O-N 3.08Å
89	V	97.4	Very high	97	Very high	55 Å²	55	88.8 Å²	88.8	33%	0.333	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-48.3	177.1	169.7	0	0	0	0	110.3	K85 E86 H91 V92 D93	K85-V89 WeakPolarHBondContact O-CG2 3.47Å; K85-V89 PolarHBondContact O-N 2.96Å; E86-V89 PolarHBondContact O-N 3.24Å; V89-H91 PolarHBondContact O-N 3.42Å; V89-V92 PolarHBondContact O-N 3.18Å; V89-V92 VanDerWaalsContact O-N 3.09Å; V89-D93 PolarHBondContact O-N 2.9Å
90	A	96.2	Very high	97.2	Very high	54 Å²	54	87.2 Å²	87.2	45%	0.446	46%	0.461	S	S	.	.	H	α-helix	trans	-57.7	-37.9	177	0	0	0	0	0	112.3	E86 Q94	E86-A90 WeakPolarHBondContact O-CB 3.36Å; E86-A90 PolarHBondContact O-N 2.96Å; A90-Q94 WeakPolarHBondContact O-CB 3.43Å; A90-Q94 PolarHBondContact O-N 3.26Å; A90-Q94 VanDerWaalsContact O-N 3.08Å
91	H	97.9	Very high	97.3	Very high	108 Å²	108	89 Å²	89	50%	0.5	46%	0.457	S	S	.	.	H	α-helix	trans	-67.1	-41.7	176.1	176.4	-102.8	0	0	0	112.6	S87 E88 V89 Q94 L95	S87-H91 WeakPolarHBondContact O-CB 3.39Å; S87-H91 PolarHBondContact O-N 3.46Å; S87-H91 VanDerWaalsContact O-N 3.07Å; E88-H91 PolarHBondContact O-N 2.97Å; V89-H91 PolarHBondContact O-N 3.42Å; H91-Q94 PolarHBondContact O-N 2.95Å; H91-L95 WeakPolarHBondContact O-CG 3.38Å; H91-L95 PolarHBondContact O-N 3.29Å
92	V	98	Very high	97.4	Very high	88 Å²	88	83.6 Å²	83.6	53%	0.533	45%	0.447	S	S	.	.	H	α-helix	trans	-67.9	-41.4	177.3	175.3	0	0	0	0	111.5	E88 V89 Q94 L95 F96	E88-V92 WeakPolarHBondContact O-CG2 3.21Å; E88-V92 PolarHBondContact O-N 3.08Å; V89-V92 PolarHBondContact O-N 3.18Å; V89-V92 VanDerWaalsContact O-N 3.09Å; V92-Q94 VanDerWaalsContact C-N 3.3Å; V92-Q94 PolarHBondContact O-N 3.29Å; V92-L95 PolarHBondContact O-N 3.44Å; V92-L95 VanDerWaalsContact O-N 3.17Å; V92-F96 PolarHBondContact O-N 2.63Å
93	D	97.1	Very high	97.4	Very high	86 Å²	86	86.1 Å²	86.1	46%	0.46	46%	0.462	S	S	.	.	H	α-helix	trans	-58.6	-44.6	176	-73.6	-16.2	0	0	0	110.7	V89 L95 F96 D97	V89-D93 PolarHBondContact O-N 2.9Å; D93-L95 PolarHBondContact O-N 3.09Å; D93-F96 WeakPolarHBondContact O-CB 3.4Å; D93-F96 PolarHBondContact O-N 3Å; D93-D97 PolarHBondContact O-N 3.07Å
94	Q	98.3	Very high	97.5	Very high	113 Å²	113	84.7 Å²	84.7	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-60	-45.1	175	-176.5	177.3	7.5	0	0	112.3	A90 H91 V92 F96 D97 D98	A90-Q94 WeakPolarHBondContact O-CB 3.43Å; A90-Q94 PolarHBondContact O-N 3.26Å; A90-Q94 VanDerWaalsContact O-N 3.08Å; H91-Q94 PolarHBondContact O-N 2.95Å; V92-Q94 VanDerWaalsContact C-N 3.3Å; V92-Q94 PolarHBondContact O-N 3.29Å; Q94-F96 VanDerWaalsContact C-N 3.27Å; Q94-F96 PolarHBondContact O-N 3.06Å; Q94-D97 PolarHBondContact O-N 2.98Å; Q94-D98 WeakPolarHBondContact O-CB 3.45Å; Q94-D98 PolarHBondContact O-N 2.85Å
95	L	98.6	Very high	97.5	Very high	92 Å²	92	85 Å²	85	48%	0.482	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-37.6	177.1	-73	175.4	0	0	0	112	H91 V92 D93 A99	H91-L95 WeakPolarHBondContact O-CG 3.38Å; H91-L95 PolarHBondContact O-N 3.29Å; V92-L95 PolarHBondContact O-N 3.44Å; V92-L95 VanDerWaalsContact O-N 3.17Å; D93-L95 PolarHBondContact O-N 3.09Å; L95-A99 VanDerWaalsContact O-CB 3.3Å; L95-A99 WeakPolarHBondContact O-CB 3.48Å; L95-A99 PolarHBondContact O-N 2.8Å
96	F	98.3	Very high	97.5	Very high	141 Å²	141	82.9 Å²	82.9	62%	0.618	46%	0.463	S	S	*	.	H	α-helix	trans	-66.6	-43.8	177.1	-174.8	-94.6	0	0	0	111.8	V92 D93 Q94 D98 A99 S100	V92-F96 PolarHBondContact O-N 2.63Å; D93-F96 WeakPolarHBondContact O-CB 3.4Å; D93-F96 PolarHBondContact O-N 3Å; Q94-F96 VanDerWaalsContact C-N 3.27Å; Q94-F96 PolarHBondContact O-N 3.06Å; F96-D98 VanDerWaalsContact C-N 3.35Å; F96-A99 PolarHBondContact O-N 3.5Å; F96-S100 VanDerWaalsContact O-CB 3.29Å; F96-S100 WeakPolarHBondContact O-CB 3.49Å; F96-S100 PolarHBondContact O-N 3.29Å; F96-S100 PolarHBondContact O-OG 2.99Å
97	D	98.3	Very high	97.5	Very high	96 Å²	96	82.9 Å²	82.9	51%	0.513	46%	0.464	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.1	-75.8	-17	0	0	0	111.7	D93 Q94 R101	D93-D97 PolarHBondContact O-N 3.07Å; Q94-D97 PolarHBondContact O-N 2.98Å; D97-R101 WeakPolarHBondContact O-CB 3.42Å; D97-R101 PolarHBondContact O-N 3.04Å; D97-R101 PolarHBondContact O-NH1 3.32Å
98	D	98.4	Very high	97.5	Very high	59 Å²	59	82 Å²	82	32%	0.316	46%	0.457	S	S	.	.	H	α-helix	trans	-63.3	-46.9	177.4	-72.9	-7.6	0	0	0	111.3	Q94 F96 R101 A102	Q94-D98 WeakPolarHBondContact O-CB 3.45Å; Q94-D98 PolarHBondContact O-N 2.85Å; F96-D98 VanDerWaalsContact C-N 3.35Å; D98-R101 PolarHBondContact O-N 3.45Å; D98-R101 IonicContact OD1-CZ 3.49Å; D98-R101 IonicContact OD1-NH1 2.73Å; D98-R101 PolarHBondContact OD1-NH1 2.93Å; D98-R101 IonicContact OD1-NH2 3.48Å; D98-R101 PolarHBondContact OD1-NH2 3.4Å; D98-A102 WeakPolarHBondContact O-CB 3.41Å; D98-A102 PolarHBondContact O-N 3.38Å
99	A	98.6	Very high	97.5	Very high	54 Å²	54	84 Å²	84	45%	0.446	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-47	177.7	0	0	0	0	0	111.8	L95 F96 R101 A102 V103	L95-A99 VanDerWaalsContact O-CB 3.3Å; L95-A99 WeakPolarHBondContact O-CB 3.48Å; L95-A99 PolarHBondContact O-N 2.8Å; F96-A99 PolarHBondContact O-N 3.5Å; A99-R101 VanDerWaalsContact C-N 3.31Å; A99-R101 PolarHBondContact O-N 3.07Å; A99-A102 PolarHBondContact O-N 3.06Å; A99-V103 WeakPolarHBondContact O-CG2 3.29Å; A99-V103 PolarHBondContact O-N 2.91Å
100	S	97.9	Very high	97.4	Very high	47 Å²	47	84.2 Å²	84.2	33%	0.329	47%	0.471	S	S	.	.	H	α-helix	trans	-60.7	-42.3	179.5	-61	0	0	0	0	111.6	F96 V103 T104	F96-S100 VanDerWaalsContact O-CB 3.29Å; F96-S100 WeakPolarHBondContact O-CB 3.49Å; F96-S100 PolarHBondContact O-N 3.29Å; F96-S100 PolarHBondContact O-OG 2.99Å; S100-V103 PolarHBondContact O-N 3.28Å; S100-T104 PolarHBondContact O-N 3.19Å; S100-T104 PolarHBondContact O-OG1 3.4Å
101	R	98.4	Very high	97.4	Very high	128 Å²	128	84.9 Å²	84.9	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-66.5	-41.4	175.6	-174.9	166.8	64.5	-100.4	4.2	112.1	D97 D98 A99 T104 N105	D97-R101 WeakPolarHBondContact O-CB 3.42Å; D97-R101 PolarHBondContact O-N 3.04Å; D97-R101 PolarHBondContact O-NH1 3.32Å; D98-R101 PolarHBondContact O-N 3.45Å; D98-R101 IonicContact OD1-CZ 3.49Å; D98-R101 IonicContact OD1-NH1 2.73Å; D98-R101 PolarHBondContact OD1-NH1 2.93Å; D98-R101 IonicContact OD1-NH2 3.48Å; D98-R101 PolarHBondContact OD1-NH2 3.4Å; A99-R101 VanDerWaalsContact C-N 3.31Å; A99-R101 PolarHBondContact O-N 3.07Å; R101-T104 PolarHBondContact O-N 2.9Å; R101-N105 WeakPolarHBondContact O-CB 3.45Å; R101-N105 PolarHBondContact O-N 3.47Å; R101-N105 PolarHBondContact O-ND2 3.37Å
102	A	98.4	Very high	97.3	Very high	50 Å²	50	83.5 Å²	83.5	41%	0.413	46%	0.46	S	S	.	.	H	α-helix	trans	-61.9	-44	176.5	0	0	0	0	0	111.8	D98 A99 N105 C106	D98-A102 WeakPolarHBondContact O-CB 3.41Å; D98-A102 PolarHBondContact O-N 3.38Å; A99-A102 PolarHBondContact O-N 3.06Å; A102-N105 PolarHBondContact O-N 2.89Å; A102-C106 WeakPolarHBondContact O-CB 3.39Å; A102-C106 PolarHBondContact O-N 3.48Å; A102-C106 PolarHBondContact O-SG 2.93Å
103	V	97	Very high	97.3	Very high	98 Å²	98	85.1 Å²	85.1	59%	0.594	46%	0.46	S	S	*	.	H	α-helix	trans	-60	-48.3	175.9	171.2	0	0	0	0	110.9	A99 S100 N105 C106 E107	A99-V103 WeakPolarHBondContact O-CG2 3.29Å; A99-V103 PolarHBondContact O-N 2.91Å; S100-V103 PolarHBondContact O-N 3.28Å; V103-N105 VanDerWaalsContact C-N 3.31Å; V103-N105 PolarHBondContact O-N 3.42Å; V103-C106 PolarHBondContact O-N 3.38Å; V103-E107 WeakPolarHBondContact O-CB 3.31Å; V103-E107 PolarHBondContact O-N 3.17Å
104	T	96.2	Very high	97.2	Very high	83 Å²	83	85.4 Å²	85.4	51%	0.509	46%	0.456	S	S	.	.	H	α-helix	trans	-59.8	-41.8	178.4	-54.1	0	0	0	0	111.7	S100 R101 E107 S108	S100-T104 PolarHBondContact O-N 3.19Å; S100-T104 PolarHBondContact O-OG1 3.4Å; R101-T104 PolarHBondContact O-N 2.9Å; T104-E107 PolarHBondContact O-N 3.38Å; T104-S108 PolarHBondContact O-N 2.81Å
105	N	97.7	Very high	97.1	Very high	95 Å²	95	83.9 Å²	83.9	51%	0.508	46%	0.457	S	S	.	.	H	α-helix	trans	-65.2	-45.4	177.3	-71.5	-15.6	0	0	0	111.8	R101 A102 V103 E107 S108 L109	R101-N105 WeakPolarHBondContact O-CB 3.45Å; R101-N105 PolarHBondContact O-N 3.47Å; R101-N105 PolarHBondContact O-ND2 3.37Å; A102-N105 PolarHBondContact O-N 2.89Å; V103-N105 VanDerWaalsContact C-N 3.31Å; V103-N105 PolarHBondContact O-N 3.42Å; N105-E107 VanDerWaalsContact C-N 3.31Å; N105-E107 PolarHBondContact O-N 2.94Å; N105-S108 PolarHBondContact O-N 3.31Å; N105-L109 WeakPolarHBondContact O-CG 3.3Å; N105-L109 PolarHBondContact O-N 2.95Å
106	C	97.1	Very high	97	Very high	78 Å²	78	87.9 Å²	87.9	53%	0.527	47%	0.471	S	S	.	.	H	α-helix	trans	-59.3	-43.8	175.9	-73.6	0	0	0	0	111.2	A102 V103 S108 L109 V110	A102-C106 WeakPolarHBondContact O-CB 3.39Å; A102-C106 PolarHBondContact O-N 3.48Å; A102-C106 PolarHBondContact O-SG 2.93Å; V103-C106 PolarHBondContact O-N 3.38Å; C106-S108 PolarHBondContact O-N 2.81Å; C106-L109 PolarHBondContact O-N 2.61Å; C106-V110 WeakPolarHBondContact O-CG2 3.34Å; C106-V110 PolarHBondContact O-N 3.31Å; C106-V110 VanDerWaalsContact O-N 3.13Å
107	E	94.8	Very high	96.9	Very high	59 Å²	59	86.1 Å²	86.1	28%	0.276	47%	0.467	S	S	.	.	H	α-helix	trans	-60.6	-45.1	176.8	-171.3	-173	169.1	0	0	111.9	V103 T104 N105 L109 V110 K111 Y121	V103-E107 WeakPolarHBondContact O-CB 3.31Å; V103-E107 PolarHBondContact O-N 3.17Å; T104-E107 PolarHBondContact O-N 3.38Å; N105-E107 VanDerWaalsContact C-N 3.31Å; N105-E107 PolarHBondContact O-N 2.94Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.35Å; E107-V110 PolarHBondContact O-N 3.07Å; E107-V110 VanDerWaalsContact O-N 3.14Å; E107-K111 HydrophobicContact CG-CD 4.35Å; E107-K111 WeakPolarHBondContact O-CG 3.47Å; E107-K111 PolarHBondContact O-N 3.47Å; E107-K111 WeakPolarHBondContact OE1-CE 3.3Å; E107-K111 IonicContact OE1-NZ 2.81Å; E107-K111 PolarHBondContact OE1-NZ 3.48Å; E107-Y121 HydrophobicContact CG-CE1 4.37Å
108	S	96.2	Very high	96.8	Very high	60 Å²	60	85 Å²	85	42%	0.42	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-43.2	175.8	-170.2	0	0	0	0	112.1	T104 N105 C106 V110 K111 D112	T104-S108 PolarHBondContact O-N 2.81Å; N105-S108 PolarHBondContact O-N 3.31Å; C106-S108 PolarHBondContact O-N 2.81Å; S108-V110 VanDerWaalsContact C-N 3.28Å; S108-V110 PolarHBondContact O-N 3.04Å; S108-K111 PolarHBondContact O-N 3.48Å; S108-D112 WeakPolarHBondContact O-CB 3.31Å; S108-D112 PolarHBondContact O-N 3.13Å
109	L	97.4	Very high	96.6	Very high	120 Å²	120	86.8 Å²	86.8	63%	0.628	49%	0.488	S	S	*	.	H	α-helix	trans	-61.4	-38.2	177.3	-69.6	172.2	0	0	0	112	N105 C106 E107 F113	N105-L109 WeakPolarHBondContact O-CG 3.3Å; N105-L109 PolarHBondContact O-N 2.95Å; C106-L109 PolarHBondContact O-N 2.61Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.35Å; L109-F113 WeakPolarHBondContact O-CB 3.43Å; L109-F113 PolarHBondContact O-N 3.37Å; L109-F113 VanDerWaalsContact O-N 3.08Å
110	V	95.7	Very high	96.2	Very high	60 Å²	60	93 Å²	93	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-44.8	176.4	-179.9	0	0	0	0	110.7	C106 E107 S108 D112 F113 Y114 Y121	C106-V110 WeakPolarHBondContact O-CG2 3.34Å; C106-V110 PolarHBondContact O-N 3.31Å; C106-V110 VanDerWaalsContact O-N 3.13Å; E107-V110 PolarHBondContact O-N 3.07Å; E107-V110 VanDerWaalsContact O-N 3.14Å; S108-V110 VanDerWaalsContact C-N 3.28Å; S108-V110 PolarHBondContact O-N 3.04Å; V110-D112 VanDerWaalsContact C-N 3.3Å; V110-D112 PolarHBondContact O-N 3.08Å; V110-F113 WeakPolarHBondContact O-CB 3.12Å; V110-F113 PolarHBondContact O-N 2.92Å; V110-F113 VanDerWaalsContact O-N 3.13Å; V110-Y114 HydrophobicContact CG1-CD2 3.81Å; V110-Y114 HydrophobicContact CG1-CE2 3.71Å; V110-Y114 VanDerWaalsContact O-CD2 3.31Å; V110-Y114 WeakPolarHBondContact O-CD2 3.49Å; V110-Y114 PolarHBondContact O-N 3.34Å; V110-Y121 HydrophobicContact CB-CE2 4.2Å; V110-Y121 HydrophobicContact CG1-CD2 3.85Å; V110-Y121 HydrophobicContact CG1-CE2 3.5Å
111	K	95	Very high	95.9	Very high	68 Å²	68	94.1 Å²	94.1	30%	0.296	51%	0.505	S	S	.	.	H	α-helix	trans	-56.6	-43.9	175.4	-75.3	177.5	178.9	176.1	0	111.9	E107 S108 F113 Y114 S115 Y121 D123	E107-K111 HydrophobicContact CG-CD 4.35Å; E107-K111 WeakPolarHBondContact O-CG 3.47Å; E107-K111 PolarHBondContact O-N 3.47Å; E107-K111 WeakPolarHBondContact OE1-CE 3.3Å; E107-K111 IonicContact OE1-NZ 2.81Å; E107-K111 PolarHBondContact OE1-NZ 3.48Å; S108-K111 PolarHBondContact O-N 3.48Å; K111-F113 VanDerWaalsContact C-N 3.35Å; K111-F113 PolarHBondContact O-N 3.45Å; K111-Y114 PolarHBondContact O-N 3.02Å; K111-S115 WeakPolarHBondContact O-CB 3.47Å; K111-S115 PolarHBondContact O-N 2.99Å; K111-S115 PolarHBondContact O-OG 3.13Å; K111-Y121 HydrophobicContact CD-CD1 4.03Å; K111-Y121 HydrophobicContact CD-CE1 4.27Å; K111-Y121 HydrophobicContact CG-CD1 3.52Å; K111-Y121 HydrophobicContact CG-CD2 4.1Å; K111-Y121 HydrophobicContact CG-CE1 3.93Å; K111-Y121 HydrophobicContact CG-CE2 4.5Å; K111-Y121 HydrophobicContact CG-CG 3.58Å; K111-D123 IonicContact NZ-OD1 2.61Å; K111-D123 PolarHBondContact NZ-OD1 3.18Å
112	D	96.6	Very high	95.4	Very high	79 Å²	79	93.7 Å²	93.7	42%	0.422	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-40.3	176.6	-74.6	-13.6	0	0	0	112.1	S108 V110 S115 K116	S108-D112 WeakPolarHBondContact O-CB 3.31Å; S108-D112 PolarHBondContact O-N 3.13Å; V110-D112 VanDerWaalsContact C-N 3.3Å; V110-D112 PolarHBondContact O-N 3.08Å; D112-S115 PolarHBondContact O-N 3.27Å; D112-K116 VanDerWaalsContact O-CG 3.3Å; D112-K116 WeakPolarHBondContact O-CG 3.48Å; D112-K116 PolarHBondContact O-N 3.39Å
113	F	96.8	Very high	94.6	Very high	122 Å²	122	95.1 Å²	95.1	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-46	178.1	-178.3	-103.6	0	0	0	112.1	L109 V110 K111 S115 K116 L117	L109-F113 WeakPolarHBondContact O-CB 3.43Å; L109-F113 PolarHBondContact O-N 3.37Å; L109-F113 VanDerWaalsContact O-N 3.08Å; V110-F113 WeakPolarHBondContact O-CB 3.12Å; V110-F113 PolarHBondContact O-N 2.92Å; V110-F113 VanDerWaalsContact O-N 3.13Å; K111-F113 VanDerWaalsContact C-N 3.35Å; K111-F113 PolarHBondContact O-N 3.45Å; F113-S115 VanDerWaalsContact C-N 3.34Å; F113-S115 PolarHBondContact O-N 2.89Å; F113-K116 PolarHBondContact O-N 3.27Å; F113-L117 HydrophobicContact CD1-CD1 4.07Å; F113-L117 HydrophobicContact CE1-CD1 3.48Å; F113-L117 VanDerWaalsContact CE1-CD1 3.48Å; F113-L117 HydrophobicContact CE2-CD1 4.43Å; F113-L117 HydrophobicContact CZ-CD1 3.69Å; F113-L117 HydrophobicContact CZ-CG 4.48Å; F113-L117 PolarHBondContact O-N 3.23Å
114	Y	95.9	Very high	93.2	Very high	92 Å²	92	96.6 Å²	96.6	36%	0.361	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-45.1	175.8	-88	-111	0	0	0	111.4	V110 K111 K116 L117 G118 L119 Y121	V110-Y114 HydrophobicContact CG1-CD2 3.81Å; V110-Y114 HydrophobicContact CG1-CE2 3.71Å; V110-Y114 VanDerWaalsContact O-CD2 3.31Å; V110-Y114 WeakPolarHBondContact O-CD2 3.49Å; V110-Y114 PolarHBondContact O-N 3.34Å; K111-Y114 PolarHBondContact O-N 3.02Å; Y114-K116 VanDerWaalsContact C-N 3.31Å; Y114-K116 PolarHBondContact O-N 2.9Å; Y114-L117 CarbonylContact O-C 3.57Å; Y114-L117 PolarHBondContact O-N 3.26Å; Y114-G118 PolarHBondContact O-N 2.81Å; Y114-L119 CarbonylContact C-O 3.52Å; Y114-L119 HydrophobicContact CD1-CB 3.74Å; Y114-L119 HydrophobicContact CD1-CD1 4.27Å; Y114-L119 HydrophobicContact CE1-CD1 4.49Å; Y114-L119 HydrophobicContact CG-CB 4.4Å; Y114-L119 PolarHBondContact O-N 2.8Å; Y114-Y121 HydrophobicContact CD2-CD2 4.24Å; Y114-Y121 HydrophobicContact CE2-CD2 4.46Å; Y114-Y121 HydrophobicContact CG-CD2 4.38Å
115	S	95.4	Very high	91.5	Very high	81 Å²	81	98 Å²	98	57%	0.566	53%	0.531	S	S	*	.	H	α-helix	trans	-59.4	-41.1	178.8	-58.5	0	0	0	0	112	K111 D112 F113 L117 G118	K111-S115 WeakPolarHBondContact O-CB 3.47Å; K111-S115 PolarHBondContact O-N 2.99Å; K111-S115 PolarHBondContact O-OG 3.13Å; D112-S115 PolarHBondContact O-N 3.27Å; F113-S115 VanDerWaalsContact C-N 3.34Å; F113-S115 PolarHBondContact O-N 2.89Å; S115-L117 VanDerWaalsContact C-N 3.25Å; S115-L117 PolarHBondContact O-N 3.38Å; S115-G118 PolarHBondContact O-N 3.14Å
116	K	96.4	Very high	89.2	Confident	175 Å²	175	95.8 Å²	95.8	76%	0.761	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-27.6	176.2	-73.3	171.1	-169.9	172.7	0	113.4	D112 F113 Y114 G118	D112-K116 VanDerWaalsContact O-CG 3.3Å; D112-K116 WeakPolarHBondContact O-CG 3.48Å; D112-K116 PolarHBondContact O-N 3.39Å; F113-K116 PolarHBondContact O-N 3.27Å; Y114-K116 VanDerWaalsContact C-N 3.31Å; Y114-K116 PolarHBondContact O-N 2.9Å; K116-G118 VanDerWaalsContact C-N 3.3Å
117	L	96.7	Very high	87.1	Confident	104 Å²	104	101.4 Å²	101.4	55%	0.545	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.6	174.7	-66.1	175.7	0	0	0	113.1	F113 Y114 S115 L119	F113-L117 HydrophobicContact CD1-CD1 4.07Å; F113-L117 HydrophobicContact CE1-CD1 3.48Å; F113-L117 VanDerWaalsContact CE1-CD1 3.48Å; F113-L117 HydrophobicContact CE2-CD1 4.43Å; F113-L117 HydrophobicContact CZ-CD1 3.69Å; F113-L117 HydrophobicContact CZ-CG 4.48Å; F113-L117 PolarHBondContact O-N 3.23Å; Y114-L117 CarbonylContact O-C 3.57Å; Y114-L117 PolarHBondContact O-N 3.26Å; S115-L117 VanDerWaalsContact C-N 3.25Å; S115-L117 PolarHBondContact O-N 3.38Å; L117-L119 HydrophobicContact CB-CD1 4.07Å; L117-L119 HydrophobicContact CB-CG 4.08Å; L117-L119 HydrophobicContact CD1-CD1 4.31Å; L117-L119 PolarHBondContact O-N 3.48Å
118	G	96	Very high	85.2	Confident	72 Å²	72	104.4 Å²	104.4	74%	0.742	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	19.6	-174.5	0	0	0	0	0	113.4	Y114 S115 K116	Y114-G118 PolarHBondContact O-N 2.81Å; S115-G118 PolarHBondContact O-N 3.14Å; K116-G118 VanDerWaalsContact C-N 3.3Å
119	L	94.6	Very high	83.3	Confident	98 Å²	98	108.6 Å²	108.6	51%	0.513	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-99.3	152.1	178	-61.5	174.8	0	0	0	110.5	Y114 L117	Y114-L119 CarbonylContact C-O 3.52Å; Y114-L119 HydrophobicContact CD1-CB 3.74Å; Y114-L119 HydrophobicContact CD1-CD1 4.27Å; Y114-L119 HydrophobicContact CE1-CD1 4.49Å; Y114-L119 HydrophobicContact CG-CB 4.4Å; Y114-L119 PolarHBondContact O-N 2.8Å; L117-L119 HydrophobicContact CB-CD1 4.07Å; L117-L119 HydrophobicContact CB-CG 4.08Å; L117-L119 HydrophobicContact CD1-CD1 4.31Å; L117-L119 PolarHBondContact O-N 3.48Å
120	Q	90.4	Very high	81.3	Confident	183 Å²	183	106.8 Å²	106.8	86%	0.855	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-92.9	128.3	172.2	-172.2	176.1	20.7	0	0	110.1
121	Y	90.8	Very high	79.5	Confident	71 Å²	71	109.4 Å²	109.4	28%	0.278	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-77.9	134.1	169.3	-175.6	-91.2	0	0	0	110	E107 V110 K111 Y114 D123	E107-Y121 HydrophobicContact CG-CE1 4.37Å; V110-Y121 HydrophobicContact CB-CE2 4.2Å; V110-Y121 HydrophobicContact CG1-CD2 3.85Å; V110-Y121 HydrophobicContact CG1-CE2 3.5Å; K111-Y121 HydrophobicContact CD-CD1 4.03Å; K111-Y121 HydrophobicContact CD-CE1 4.27Å; K111-Y121 HydrophobicContact CG-CD1 3.52Å; K111-Y121 HydrophobicContact CG-CD2 4.1Å; K111-Y121 HydrophobicContact CG-CE1 3.93Å; K111-Y121 HydrophobicContact CG-CE2 4.5Å; K111-Y121 HydrophobicContact CG-CG 3.58Å; Y114-Y121 HydrophobicContact CD2-CD2 4.24Å; Y114-Y121 HydrophobicContact CE2-CD2 4.46Å; Y114-Y121 HydrophobicContact CG-CD2 4.38Å; Y121-D123 VanDerWaalsContact CE1-OD1 3.31Å; Y121-D123 WeakPolarHBondContact CE1-OD1 3.41Å
122	R	88.1	Confident	78	Confident	119 Å²	119	116.6 Å²	116.6	45%	0.449	62%	0.617	S	S	.	*			trans	-116.4	126.6	177.8	-164.5	-160.1	177.8	-177.8	7.7	109.6	S124 S126 D128 E129	R122-S124 PolarHBondContact O-N 3.18Å; R122-S126 PolarHBondContact NE-OG 2.95Å; R122-S126 PolarHBondContact NH2-O 3.48Å; R122-S126 PolarHBondContact NH2-OG 3.24Å; R122-D128 PolarHBondContact NH2-O 3.04Å; R122-E129 IonicContact NH1-OE1 2.98Å; R122-E129 PolarHBondContact NH1-OE1 2.85Å
123	D	81.9	Confident	76	Confident	81 Å²	81	118.8 Å²	118.8	43%	0.433	64%	0.635	S	S	.	*			trans	-71.5	121.7	172.7	-58.1	-55	0	0	0	109.2	K111 Y121 S125 S126	K111-D123 IonicContact NZ-OD1 2.61Å; K111-D123 PolarHBondContact NZ-OD1 3.18Å; Y121-D123 VanDerWaalsContact CE1-OD1 3.31Å; Y121-D123 WeakPolarHBondContact CE1-OD1 3.41Å; D123-S125 PolarHBondContact O-N 3.4Å; D123-S126 PolarHBondContact O-N 2.87Å; D123-S126 PolarHBondContact O-OG 3.03Å
124	S	68	Low	74.5	Confident	128 Å²	128	119 Å²	119	90%	0.895	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	1.1	-174.7	-56.2	0	0	0	0	115.2	R122	R122-S124 PolarHBondContact O-N 3.18Å
125	S	60.3	Low	73	Confident	112 Å²	112	122.9 Å²	122.9	78%	0.783	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-1.4	177.1	-168.5	0	0	0	0	113.9	D123 E127	D123-S125 PolarHBondContact O-N 3.4Å; S125-E127 PolarHBondContact O-N 3.27Å
126	S	48.8	Very low	72	Confident	50 Å²	50	125.8 Å²	125.8	35%	0.35	68%	0.676	S	S	.	*			trans	-76.4	112.5	175.4	68.1	0	0	0	0	109.9	R122 D123 D128	R122-S126 PolarHBondContact NE-OG 2.95Å; R122-S126 PolarHBondContact NH2-O 3.48Å; R122-S126 PolarHBondContact NH2-OG 3.24Å; D123-S126 PolarHBondContact O-N 2.87Å; D123-S126 PolarHBondContact O-OG 3.03Å; S126-D128 PolarHBondContact O-N 2.99Å
127	E	53.8	Low	70.8	Confident	195 Å²	195	124.1 Å²	124.1	91%	0.911	67%	0.674	S	S	*	*			trans	-62.3	15.2	173.8	-63.6	-169.2	104.7	0	0	114.6	S125 E129	S125-E127 PolarHBondContact O-N 3.27Å; E127-E129 PolarHBondContact O-N 2.77Å
128	D	55.4	Low	69.2	Low	122 Å²	122	127.5 Å²	127.5	65%	0.652	69%	0.687	S	S	*	*			trans	-88.8	57.5	178.6	-131.5	-2.4	0	0	0	109.5	R122 S126 S130	R122-D128 PolarHBondContact NH2-O 3.04Å; S126-D128 PolarHBondContact O-N 2.99Å; D128-S130 PolarHBondContact O-N 2.98Å
129	E	55.2	Low	68.3	Low	148 Å²	148	130.7 Å²	130.7	69%	0.692	69%	0.685	S	S	*	*			trans	-73.3	63.5	151.2	-66.6	-61.9	107.4	0	0	106.9	R122 E127 S131	R122-E129 IonicContact NH1-OE1 2.98Å; R122-E129 PolarHBondContact NH1-OE1 2.85Å; E127-E129 PolarHBondContact O-N 2.77Å; E129-S131 VanDerWaalsContact C-N 3.26Å; E129-S131 PolarHBondContact O-N 2.77Å
130	S	56.2	Low	67.2	Low	83 Å²	83	131.3 Å²	131.3	58%	0.58	70%	0.695	S	S	*	*			trans	-53.3	105.3	156.6	156.9	0	0	0	0	105.2	D128 R132	D128-S130 PolarHBondContact O-N 2.98Å; S130-R132 VanDerWaalsContact C-N 3.35Å; S130-R132 PolarHBondContact O-N 2.84Å
131	S	57.5	Low	66.2	Low	114 Å²	114	130.4 Å²	130.4	80%	0.797	70%	0.696	S	S	*	*			trans	-44	93.8	-177.3	-44.6	0	0	0	0	110.3	E129	E129-S131 VanDerWaalsContact C-N 3.26Å; E129-S131 PolarHBondContact O-N 2.77Å
132	R	62.6	Low	65.2	Low	220 Å²	220	135.5 Å²	135.5	83%	0.83	72%	0.723	S	S	*	*			trans	-79.4	124.2	162.8	-63	-169.8	-175.1	-174.2	2.8	104.7	S130 T134	S130-R132 VanDerWaalsContact C-N 3.35Å; S130-R132 PolarHBondContact O-N 2.84Å; R132-T134 PolarHBondContact O-N 3.13Å
133	P	55.9	Low	64	Low	125 Å²	125	136.9 Å²	136.9	81%	0.812	74%	0.739	S	S	*	*			trans	-58.8	117.8	177.6	1.2	4.9	0	0	0	107.7	E135	P133-E135 PolarHBondContact O-N 3.03Å; P133-E135 VanDerWaalsContact O-N 3.13Å
134	T	64.6	Low	63.2	Low	125 Å²	125	139.8 Å²	139.8	77%	0.767	75%	0.754	S	S	*	*			trans	-61.3	113.1	165.2	-48.7	0	0	0	0	106.1	R132 I136	R132-T134 PolarHBondContact O-N 3.13Å; T134-I136 PolarHBondContact O-N 3Å
135	E	65.1	Low	63.1	Low	174 Å²	174	141 Å²	141	81%	0.813	75%	0.751	S	S	*	*			trans	-69	100.9	176.6	-164.1	172.9	-157.1	0	0	107.8	P133	P133-E135 PolarHBondContact O-N 3.03Å; P133-E135 VanDerWaalsContact O-N 3.13Å
136	I	74.6	Confident	63.4	Low	142 Å²	142	141.1 Å²	141.1	73%	0.728	75%	0.747	S	S	*	*			trans	-83.4	113.3	176	-60.1	168.7	0	0	0	106.5	T134	T134-I136 PolarHBondContact O-N 3Å
137	I	69.4	Low	64	Low	140 Å²	140	146.7 Å²	146.7	72%	0.718	77%	0.772	S	S	*	*			trans	-90.1	106.8	173	-56.5	173.5	0	0	0	107	I139	I137-I139 PolarHBondContact O-N 3.41Å
138	E	63.9	Low	64.6	Low	175 Å²	175	142.9 Å²	142.9	82%	0.818	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70.3	119.9	170.5	-71.8	179.7	-178.2	0	0	109.1
139	I	77.2	Confident	64.9	Low	139 Å²	139	145 Å²	145	71%	0.713	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-84.5	120.2	169.3	-55.7	176.7	0	0	0	105.7	I137 D141	I137-I139 PolarHBondContact O-N 3.41Å; I139-D141 PolarHBondContact O-N 2.99Å
140	P	72.1	Confident	65.1	Low	112 Å²	112	149.1 Å²	149.1	73%	0.727	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.1	125.5	177.1	24.6	-30.4	0	0	0	109.7	E142	P140-E142 VanDerWaalsContact C-N 3.3Å; P140-E142 PolarHBondContact O-N 3.31Å
141	D	69.5	Low	65.5	Low	163 Å²	163	152.5 Å²	152.5	87%	0.872	81%	0.814	S	S	*	*			trans	-72.8	88.6	169.6	-62.3	-32	0	0	0	107.9	I139 D143	I139-D141 PolarHBondContact O-N 2.99Å; D141-D143 VanDerWaalsContact C-N 3.33Å; D141-D143 PolarHBondContact O-N 3.26Å
142	E	68.9	Low	65.9	Low	179 Å²	179	154.5 Å²	154.5	84%	0.836	82%	0.815	S	S	*	*			trans	-82.2	86.7	163.6	-166.8	177.2	130.8	0	0	106.6	P140	P140-E142 VanDerWaalsContact C-N 3.3Å; P140-E142 PolarHBondContact O-N 3.31Å
143	D	62.9	Low	66.1	Low	147 Å²	147	150.8 Å²	150.8	79%	0.786	81%	0.814	S	S	*	*			trans	-165	107.5	142.6	-86.1	-31	0	0	0	110.7	D141 D145	D141-D143 VanDerWaalsContact C-N 3.33Å; D141-D143 PolarHBondContact O-N 3.26Å; D143-D145 PolarHBondContact O-N 3.41Å
144	D	65.2	Low	66.7	Low	142 Å²	142	152.4 Å²	152.4	76%	0.759	81%	0.814	S	S	*	*			trans	-80.4	88.3	174.3	-179.6	23.7	0	0	0	109.1
145	D	66	Low	66.8	Low	154 Å²	154	154.1 Å²	154.1	82%	0.824	82%	0.817	S	S	*	*			trans	-118.6	84.6	165.5	-81.2	-34.1	0	0	0	110.2	D143 L147	D143-D145 PolarHBondContact O-N 3.41Å; D145-L147 PolarHBondContact O-N 3.31Å
146	V	67.2	Low	66.9	Low	115 Å²	115	152.7 Å²	152.7	70%	0.697	82%	0.818	S	S	*	*			trans	-54.8	119.7	169.5	173.9	0	0	0	0	110.5	S148	V146-S148 PolarHBondContact O-N 3.15Å; V146-S148 VanDerWaalsContact O-N 3.15Å
147	L	61.3	Low	66.4	Low	166 Å²	166	153.5 Å²	153.5	87%	0.869	82%	0.824	S	S	*	*			trans	-44.3	115.8	169.2	-69.2	164.7	0	0	0	112.1	D145	D145-L147 PolarHBondContact O-N 3.31Å
148	S	65.4	Low	66.2	Low	116 Å²	116	154.5 Å²	154.5	81%	0.811	83%	0.832	S	S	*	*			trans	-122.7	109.1	157.5	-62.7	0	0	0	0	108.6	V146	V146-S148 PolarHBondContact O-N 3.15Å; V146-S148 VanDerWaalsContact O-N 3.15Å
149	I	62.7	Low	66.4	Low	167 Å²	167	152.8 Å²	152.8	86%	0.856	83%	0.834	S	S	*	*			trans	-121.1	124.4	164.8	-114.7	159.3	0	0	0	106.3
150	D	57.8	Low	65.4	Low	234 Å²	234	154.1 Å²	154.1	100%	1.251	84%	0.844	S	S	*	*			trans	-91.6	0	168.7	-168.8	50.3	0	0	0	109.1

Retrieved 150 of 150 residues in 40.1 ms (Link to these results)

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