X6R907_HUMAN Loading...

Myb/SANT-like DNA-binding domain-containing protein 3

AlphaFold DB , UniProt , Accession X6R907, Species HUMAN (Homo sapiens, Human), Gene MSANTD3, Length 181 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	37.4	Very low	52.5	Low	223 Å²	223	147.1 Å²	147.1	100%	1.099	74%	0.742	S	S	*	*				0	89.2	0	-64.8	176.4	-178.7	0	0	107	N3	M1-N3 PolarHBondContact O-N 3.49Å
2	Q	44.3	Very low	55.4	Low	178 Å²	178	149.2 Å²	149.2	83%	0.832	74%	0.737	S	S	*	*			trans	-74.6	112.2	171.7	-90.2	82.7	-4.2	0	0	107.8	N4	Q2-N4 PolarHBondContact O-N 3.03Å
3	N	43.1	Very low	58.2	Low	141 Å²	141	141 Å²	141	75%	0.754	70%	0.695	S	S	*	*			trans	-69.3	97.4	172.8	-68.2	-46.6	0	0	0	108.5	M1 E5	M1-N3 PolarHBondContact O-N 3.49Å; N3-E5 PolarHBondContact O-N 3.03Å
4	N	46.2	Very low	60.7	Low	153 Å²	153	134.9 Å²	134.9	82%	0.818	67%	0.672	S	S	*	*			trans	-73.6	86.4	162.9	-95.9	17.2	0	0	0	107.7	Q2 I6	Q2-N4 PolarHBondContact O-N 3.03Å; N4-I6 PolarHBondContact O-N 3.34Å; N4-I6 VanDerWaalsContact O-N 3.14Å
5	E	57.6	Low	63	Low	163 Å²	163	134.8 Å²	134.8	76%	0.762	67%	0.669	S	S	*	*			trans	-67.1	110.5	167.2	-64	-162.5	166.6	0	0	108.3	N3 I7	N3-E5 PolarHBondContact O-N 3.03Å; E5-I7 VanDerWaalsContact C-N 3.3Å; E5-I7 PolarHBondContact O-N 3.14Å
6	I	51.2	Low	64.9	Low	154 Å²	154	132.1 Å²	132.1	79%	0.79	66%	0.658	S	S	*	*			trans	-63.2	97.7	169.5	-60.8	169.1	0	0	0	106	N4 K8	N4-I6 PolarHBondContact O-N 3.34Å; N4-I6 VanDerWaalsContact O-N 3.14Å; I6-K8 VanDerWaalsContact C-N 3.3Å; I6-K8 PolarHBondContact O-N 3.1Å
7	I	60.3	Low	66.7	Low	106 Å²	106	124.7 Å²	124.7	54%	0.544	62%	0.621	S	S	.	*			trans	-63.4	93.2	179	-55.2	176.3	0	0	0	107.4	E5 L64	E5-I7 VanDerWaalsContact C-N 3.3Å; E5-I7 PolarHBondContact O-N 3.14Å; I7-L64 HydrophobicContact CD1-CD1 4.4Å
8	K	50.7	Low	68.3	Low	173 Å²	173	121.1 Å²	121.1	75%	0.752	60%	0.601	S	S	*	*			trans	-59.9	132.6	169.3	-67.9	175.1	-177.1	167.5	0	107.1	I6 A10	I6-K8 VanDerWaalsContact C-N 3.3Å; I6-K8 PolarHBondContact O-N 3.1Å; K8-A10 PolarHBondContact O-N 3.3Å
9	P	53.2	Low	69.8	Low	122 Å²	122	117.8 Å²	117.8	79%	0.792	59%	0.591	S	S	*	*			trans	-63.4	104.8	174.1	24	-30.6	0	0	0	108.3	K11	P9-K11 PolarHBondContact O-N 2.67Å; P9-K11 VanDerWaalsContact O-N 3.14Å
10	A	60.7	Low	71.2	Confident	34 Å²	34	113.4 Å²	113.4	28%	0.281	57%	0.568	S	S	.	*			trans	-58.8	122.6	172.4	0	0	0	0	0	107.8	K8 Y12 S63 R65	K8-A10 PolarHBondContact O-N 3.3Å; A10-Y12 PolarHBondContact O-N 3.28Å; A10-S63 WeakPolarHBondContact CB-OG 3.4Å; A10-R65 PolarHBondContact O-NH1 3.42Å; A10-R65 PolarHBondContact O-NH2 2.92Å
11	K	72.6	Confident	72.5	Confident	171 Å²	171	108 Å²	108	74%	0.743	54%	0.541	S	S	*	.	S	Bend	trans	-69	-24	-178.4	-172.6	174.6	178.3	179.7	0	112.3	P9	P9-K11 PolarHBondContact O-N 2.67Å; P9-K11 VanDerWaalsContact O-N 3.14Å
12	Y	87.9	Confident	75.3	Confident	172 Å²	172	100.9 Å²	100.9	68%	0.675	51%	0.507	S	S	*	.	S	Bend	trans	-124.4	153	-175.2	-59.6	-75.8	0	0	0	111.5	A10 R65	A10-Y12 PolarHBondContact O-N 3.28Å; Y12-R65 PolarHBondContact O-NH2 3.06Å; Y12-R65 VanDerWaalsContact O-NH2 3.16Å
13	F	91.9	Very high	77.9	Confident	43 Å²	43	95.5 Å²	95.5	19%	0.189	49%	0.494	C	S	.	.			trans	-83.1	121.8	170.4	-74.3	-93.6	0	0	0	109.5	E17 K18 R65 Q69 L70 C73	F13-E17 WeakPolarHBondContact CA-OE2 3.46Å; F13-E17 HydrophobicContact CD1-CB 4.13Å; F13-K18 HydrophobicContact CB-CG 4.1Å; F13-K18 WeakPolarHBondContact O-CE 3.3Å; F13-R65 HydrophobicContact CE1-CG 3.74Å; F13-R65 HydrophobicContact CZ-CG 3.81Å; F13-Q69 HydrophobicContact CZ-CB 4.35Å; F13-L70 HydrophobicContact CE1-CD2 3.7Å; F13-L70 HydrophobicContact CZ-CD2 4.05Å; F13-C73 HydrophobicContact CD2-CB 4.04Å; F13-C73 HydrophobicContact CE1-CB 4.28Å; F13-C73 HydrophobicContact CE2-CB 3.75Å; F13-C73 HydrophobicContact CG-CB 4.42Å; F13-C73 HydrophobicContact CZ-CB 3.88Å
14	S	93.4	Very high	80.5	Confident	55 Å²	55	89.3 Å²	89.3	39%	0.385	46%	0.46	S	S	.	.			trans	-66.2	167.9	169.9	70.4	0	0	0	0	111.3	L16 E17 K18	S14-L16 VanDerWaalsContact C-N 3.35Å; S14-E17 PolarHBondContact N-OE2 2.87Å; S14-E17 PolarHBondContact O-N 3.48Å; S14-E17 WeakPolarHBondContact OG-CB 3.49Å; S14-E17 VanDerWaalsContact OG-CG 3.23Å; S14-E17 WeakPolarHBondContact OG-CG 3.39Å; S14-E17 PolarHBondContact OG-N 3Å; S14-E17 PolarHBondContact OG-OE2 3.18Å; S14-E17 VanDerWaalsContact OG-OE2 3.11Å; S14-K18 WeakPolarHBondContact O-CG 3.27Å; S14-K18 PolarHBondContact O-N 2.81Å
15	E	93.8	Very high	82.9	Confident	134 Å²	134	82.2 Å²	82.2	63%	0.626	42%	0.423	S	S	*	.	H	α-helix	trans	-68.8	-35.6	179	-158.3	59.2	-153.2	0	0	112.3	K18 S19	E15-K18 PolarHBondContact O-N 3.2Å; E15-K18 IonicContact OE2-NZ 2.85Å; E15-K18 PolarHBondContact OE2-NZ 3.32Å; E15-S19 PolarHBondContact O-N 2.88Å
16	L	94.1	Very high	84.8	Confident	92 Å²	92	79.8 Å²	79.8	48%	0.482	41%	0.411	S	S	.	.	H	α-helix	trans	-61	-46.4	172.2	176.4	63.7	0	0	0	111.3	S14 K18 S19 I20	S14-L16 VanDerWaalsContact C-N 3.35Å; L16-K18 VanDerWaalsContact C-N 3.27Å; L16-K18 PolarHBondContact O-N 3.35Å; L16-S19 PolarHBondContact O-N 2.68Å; L16-S19 PolarHBondContact O-OG 3.38Å; L16-I20 HydrophobicContact CD1-CD1 4.12Å; L16-I20 HydrophobicContact CD1-CG1 4.38Å; L16-I20 HydrophobicContact CG-CD1 4.01Å; L16-I20 WeakPolarHBondContact O-CG1 3.27Å; L16-I20 PolarHBondContact O-N 2.88Å
17	E	95.5	Very high	87	Confident	6 Å²	6	78.1 Å²	78.1	3%	0.028	40%	0.398	C	S	.	.	H	α-helix	trans	-61.6	-38.1	177.5	-75.2	176.7	125.9	0	0	111.9	F13 S14 L21 Y56 V62 S63	F13-E17 WeakPolarHBondContact CA-OE2 3.46Å; F13-E17 HydrophobicContact CD1-CB 4.13Å; S14-E17 PolarHBondContact N-OE2 2.87Å; S14-E17 PolarHBondContact O-N 3.48Å; S14-E17 WeakPolarHBondContact OG-CB 3.49Å; S14-E17 VanDerWaalsContact OG-CG 3.23Å; S14-E17 WeakPolarHBondContact OG-CG 3.39Å; S14-E17 PolarHBondContact OG-N 3Å; S14-E17 PolarHBondContact OG-OE2 3.18Å; S14-E17 VanDerWaalsContact OG-OE2 3.11Å; E17-L21 WeakPolarHBondContact O-CB 3.47Å; E17-L21 PolarHBondContact O-N 2.92Å; E17-Y56 HydrophobicContact CB-CE2 4.49Å; E17-Y56 WeakPolarHBondContact CB-OH 3.49Å; E17-Y56 WeakPolarHBondContact CG-OH 3.44Å; E17-Y56 PolarHBondContact OE1-OH 3.02Å; E17-V62 HydrophobicContact CG-CB 4.28Å; E17-V62 HydrophobicContact CG-CG1 4.25Å; E17-S63 WeakPolarHBondContact OE1-CB 3.24Å; E17-S63 PolarHBondContact OE1-N 3.15Å; E17-S63 PolarHBondContact OE1-OG 3.01Å
18	K	96	Very high	88.7	Confident	60 Å²	60	75.8 Å²	75.8	26%	0.261	38%	0.383	S	S	.	.	H	α-helix	trans	-67.2	-40.1	174.7	-69.1	177.4	-140.9	149.5	0	112.1	F13 S14 E15 L16 L21 L22 I77	F13-K18 HydrophobicContact CB-CG 4.1Å; F13-K18 WeakPolarHBondContact O-CE 3.3Å; S14-K18 WeakPolarHBondContact O-CG 3.27Å; S14-K18 PolarHBondContact O-N 2.81Å; E15-K18 PolarHBondContact O-N 3.2Å; E15-K18 IonicContact OE2-NZ 2.85Å; E15-K18 PolarHBondContact OE2-NZ 3.32Å; L16-K18 VanDerWaalsContact C-N 3.27Å; L16-K18 PolarHBondContact O-N 3.35Å; K18-L21 PolarHBondContact O-N 3.49Å; K18-L22 VanDerWaalsContact O-CG 3.29Å; K18-L22 WeakPolarHBondContact O-CG 3.3Å; K18-L22 PolarHBondContact O-N 3.22Å; K18-I77 HydrophobicContact CB-CD1 4.38Å; K18-I77 HydrophobicContact CG-CD1 4.28Å
19	S	97	Very high	90.9	Very high	59 Å²	59	71.9 Å²	71.9	41%	0.413	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-40.7	178.9	69.8	0	0	0	0	111.7	E15 L16 L22 A23	E15-S19 PolarHBondContact O-N 2.88Å; L16-S19 PolarHBondContact O-N 2.68Å; L16-S19 PolarHBondContact O-OG 3.38Å; S19-L22 PolarHBondContact O-N 2.61Å; S19-A23 PolarHBondContact O-N 2.97Å
20	I	97.3	Very high	92.9	Very high	28 Å²	28	75.1 Å²	75.1	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-60.2	-47.7	172.6	-67.1	168.3	0	0	0	110.3	L16 L22 A23 L24 Y56 Q59 V62	L16-I20 HydrophobicContact CD1-CD1 4.12Å; L16-I20 HydrophobicContact CD1-CG1 4.38Å; L16-I20 HydrophobicContact CG-CD1 4.01Å; L16-I20 WeakPolarHBondContact O-CG1 3.27Å; L16-I20 PolarHBondContact O-N 2.88Å; I20-L22 VanDerWaalsContact C-N 3.31Å; I20-L22 PolarHBondContact O-N 3.32Å; I20-A23 PolarHBondContact O-N 2.8Å; I20-L24 HydrophobicContact CG2-CD1 4.1Å; I20-L24 WeakPolarHBondContact O-CG 3.41Å; I20-L24 PolarHBondContact O-N 3.43Å; I20-Y56 HydrophobicContact CB-CE2 4.47Å; I20-Y56 HydrophobicContact CG2-CD2 3.79Å; I20-Y56 HydrophobicContact CG2-CE2 4.15Å; I20-Q59 HydrophobicContact CD1-CB 4.36Å; I20-Q59 HydrophobicContact CG2-CG 3.87Å; I20-V62 HydrophobicContact CD1-CG1 3.59Å
21	L	97.3	Very high	94.6	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-57.8	-43.8	176.9	176	60.5	0	0	0	111.7	E17 K18 L24 V25 W49 L52 L70 C73 W74 I77	E17-L21 WeakPolarHBondContact O-CB 3.47Å; E17-L21 PolarHBondContact O-N 2.92Å; K18-L21 PolarHBondContact O-N 3.49Å; L21-L24 PolarHBondContact O-N 3.22Å; L21-V25 HydrophobicContact CD1-CG2 3.95Å; L21-V25 HydrophobicContact CG-CG2 4.38Å; L21-V25 WeakPolarHBondContact O-CB 3.43Å; L21-V25 VanDerWaalsContact O-CG2 3.29Å; L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.19Å; L21-W49 HydrophobicContact CD1-CZ3 4.46Å; L21-L52 HydrophobicContact CD1-CD2 3.92Å; L21-L70 HydrophobicContact CD1-CB 4.13Å; L21-L70 HydrophobicContact CD1-CD2 4.36Å; L21-C73 HydrophobicContact CD2-CB 3.75Å; L21-W74 HydrophobicContact CD2-CB 4.49Å; L21-I77 HydrophobicContact CD2-CD1 4.33Å
22	L	97.7	Very high	95.7	Very high	74 Å²	74	67.9 Å²	67.9	39%	0.387	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-45.6	177.8	-73.8	173.2	0	0	0	112.2	K18 S19 I20 L24 V25 E26 W74 I77	K18-L22 VanDerWaalsContact O-CG 3.29Å; K18-L22 WeakPolarHBondContact O-CG 3.3Å; K18-L22 PolarHBondContact O-N 3.22Å; S19-L22 PolarHBondContact O-N 2.61Å; I20-L22 VanDerWaalsContact C-N 3.31Å; I20-L22 PolarHBondContact O-N 3.32Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L22-L24 PolarHBondContact O-N 2.91Å; L22-V25 PolarHBondContact O-N 3.11Å; L22-E26 PolarHBondContact O-N 2.87Å; L22-W74 HydrophobicContact CD2-CE3 4.06Å; L22-W74 HydrophobicContact CD2-CH2 4.49Å; L22-W74 HydrophobicContact CD2-CZ3 3.47Å; L22-W74 VanDerWaalsContact CD2-CZ3 3.47Å; L22-I77 HydrophobicContact CD2-CG2 4.26Å
23	A	97.6	Very high	95.9	Very high	66 Å²	66	63.8 Å²	63.8	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-43.2	178.5	0	0	0	0	0	111.9	S19 I20 E26 K27	S19-A23 PolarHBondContact O-N 2.97Å; I20-A23 PolarHBondContact O-N 2.8Å; A23-E26 PolarHBondContact O-N 2.85Å; A23-K27 PolarHBondContact O-N 2.92Å
24	L	97.9	Very high	96	Very high	10 Å²	10	63.5 Å²	63.5	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-68.3	-40.3	177.4	-66.6	174.6	0	0	0	112.3	I20 L21 L22 E26 K27 Y28 L52 E55 Y56	I20-L24 HydrophobicContact CG2-CD1 4.1Å; I20-L24 WeakPolarHBondContact O-CG 3.41Å; I20-L24 PolarHBondContact O-N 3.43Å; L21-L24 PolarHBondContact O-N 3.22Å; L22-L24 VanDerWaalsContact C-N 3.34Å; L22-L24 PolarHBondContact O-N 2.91Å; L24-E26 VanDerWaalsContact C-N 3.31Å; L24-E26 PolarHBondContact O-N 3.34Å; L24-K27 WeakPolarHBondContact O-CB 3.22Å; L24-K27 PolarHBondContact O-N 2.9Å; L24-Y28 WeakPolarHBondContact O-CD2 3.41Å; L24-Y28 PolarHBondContact O-N 3.14Å; L24-L52 HydrophobicContact CB-CD1 3.99Å; L24-L52 HydrophobicContact CB-CD2 4.48Å; L24-L52 HydrophobicContact CB-CG 3.88Å; L24-L52 HydrophobicContact CD1-CD2 4.44Å; L24-L52 HydrophobicContact CD1-CG 4.35Å; L24-E55 HydrophobicContact CD2-CB 4.27Å; L24-E55 HydrophobicContact CD2-CG 3.68Å; L24-E55 WeakPolarHBondContact CD2-OE1 3.46Å; L24-Y56 HydrophobicContact CD1-CD2 4.32Å
25	V	97.6	Very high	96	Very high	4 Å²	4	70.6 Å²	70.6	2%	0.024	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-40.3	175.6	168.9	0	0	0	0	110.9	L21 L22 K27 Y28 K29 L32 W49 L52 W74	L21-V25 HydrophobicContact CD1-CG2 3.95Å; L21-V25 HydrophobicContact CG-CG2 4.38Å; L21-V25 WeakPolarHBondContact O-CB 3.43Å; L21-V25 VanDerWaalsContact O-CG2 3.29Å; L21-V25 WeakPolarHBondContact O-CG2 3.45Å; L21-V25 PolarHBondContact O-N 3.19Å; L22-V25 PolarHBondContact O-N 3.11Å; V25-K27 PolarHBondContact O-N 3.4Å; V25-Y28 CarbonylContact O-C 3.45Å; V25-Y28 PolarHBondContact O-N 3.26Å; V25-K29 WeakPolarHBondContact O-CA 3.39Å; V25-K29 PolarHBondContact O-N 3.5Å; V25-L32 HydrophobicContact CG1-CD1 4.34Å; V25-L32 HydrophobicContact CG2-CD1 4.28Å; V25-W49 HydrophobicContact CG2-CH2 4.04Å; V25-W49 HydrophobicContact CG2-CZ3 4.36Å; V25-L52 HydrophobicContact CG2-CD1 3.88Å; V25-W74 HydrophobicContact CG1-CD2 4.04Å; V25-W74 HydrophobicContact CG1-CE3 4.27Å; V25-W74 HydrophobicContact CG1-CH2 3.94Å; V25-W74 HydrophobicContact CG1-CZ2 3.66Å; V25-W74 HydrophobicContact CG1-CZ3 4.25Å; V25-W74 HydrophobicContact CG2-CD2 4.27Å; V25-W74 HydrophobicContact CG2-CE3 4.46Å; V25-W74 HydrophobicContact CG2-CG 4.42Å
26	E	97.4	Very high	96	Very high	112 Å²	112	71 Å²	71	52%	0.523	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-43	176.1	-168.2	63.7	-152.7	0	0	111.2	L22 A23 L24 Y28 K29	L22-E26 PolarHBondContact O-N 2.87Å; A23-E26 PolarHBondContact O-N 2.85Å; L24-E26 VanDerWaalsContact C-N 3.31Å; L24-E26 PolarHBondContact O-N 3.34Å; E26-Y28 VanDerWaalsContact C-N 3.25Å; E26-Y28 PolarHBondContact O-N 3.23Å; E26-K29 VanDerWaalsContact O-CB 3.22Å; E26-K29 WeakPolarHBondContact O-CB 3.34Å; E26-K29 PolarHBondContact O-N 3.3Å; E26-K29 VanDerWaalsContact OE1-CD 3.3Å; E26-K29 WeakPolarHBondContact OE1-CD 3.35Å; E26-K29 IonicContact OE1-NZ 3.03Å; E26-K29 PolarHBondContact OE1-NZ 3.43Å; E26-K29 IonicContact OE2-NZ 2.9Å
27	K	97.2	Very high	96	Very high	119 Å²	119	70.9 Å²	70.9	52%	0.517	35%	0.351	S	S	.	.	H	α-helix	trans	-55.3	-38.4	174.7	-177.7	-173.3	178.7	-170.4	0	112.7	A23 L24 V25 E55	A23-K27 PolarHBondContact O-N 2.92Å; L24-K27 WeakPolarHBondContact O-CB 3.22Å; L24-K27 PolarHBondContact O-N 2.9Å; V25-K27 PolarHBondContact O-N 3.4Å; K27-E55 IonicContact NZ-OE1 2.68Å; K27-E55 PolarHBondContact NZ-OE1 2.86Å; K27-E55 IonicContact NZ-OE2 2.88Å; K27-E55 PolarHBondContact NZ-OE2 3.01Å
28	Y	96.9	Very high	96.1	Very high	57 Å²	57	74 Å²	74	22%	0.224	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	14.7	-177.6	-61.2	-66.6	0	0	0	114.2	L24 V25 E26 Y30 V31 L32 T48 L52 E55	L24-Y28 WeakPolarHBondContact O-CD2 3.41Å; L24-Y28 PolarHBondContact O-N 3.14Å; V25-Y28 CarbonylContact O-C 3.45Å; V25-Y28 PolarHBondContact O-N 3.26Å; E26-Y28 VanDerWaalsContact C-N 3.25Å; E26-Y28 PolarHBondContact O-N 3.23Å; Y28-Y30 PolarHBondContact O-N 3.39Å; Y28-V31 PolarHBondContact O-N 3.34Å; Y28-V31 VanDerWaalsContact O-N 3.08Å; Y28-L32 PolarHBondContact O-N 3.18Å; Y28-T48 HydrophobicContact CD1-CG2 3.88Å; Y28-T48 HydrophobicContact CD2-CG2 4.48Å; Y28-T48 HydrophobicContact CG-CG2 3.74Å; Y28-L52 HydrophobicContact CD2-CB 4.22Å; Y28-L52 HydrophobicContact CD2-CD1 4.11Å; Y28-L52 HydrophobicContact CD2-CG 4.4Å; Y28-L52 HydrophobicContact CE2-CB 4.27Å; Y28-E55 WeakPolarHBondContact CE2-OE2 3.29Å; Y28-E55 PolarHBondContact OH-OE2 3.31Å
29	K	95.4	Very high	96.2	Very high	91 Å²	91	75.1 Å²	75.1	40%	0.396	39%	0.387	S	S	.	.	H	α-helix	trans	-54.5	-43.9	-169.4	177.3	178.9	-176.2	174.6	0	114.4	V25 E26 V31 L32 E33	V25-K29 WeakPolarHBondContact O-CA 3.39Å; V25-K29 PolarHBondContact O-N 3.5Å; E26-K29 VanDerWaalsContact O-CB 3.22Å; E26-K29 WeakPolarHBondContact O-CB 3.34Å; E26-K29 PolarHBondContact O-N 3.3Å; E26-K29 VanDerWaalsContact OE1-CD 3.3Å; E26-K29 WeakPolarHBondContact OE1-CD 3.35Å; E26-K29 IonicContact OE1-NZ 3.03Å; E26-K29 PolarHBondContact OE1-NZ 3.43Å; E26-K29 IonicContact OE2-NZ 2.9Å; K29-V31 PolarHBondContact O-N 2.91Å; K29-V31 VanDerWaalsContact O-N 3.14Å; K29-L32 PolarHBondContact O-N 3.06Å; K29-E33 PolarHBondContact O-N 3.41Å
30	Y	95.6	Very high	96.2	Very high	190 Å²	190	82 Å²	82	75%	0.745	41%	0.405	S	S	*	.	H	α-helix	trans	-58.7	-29.7	-178.2	-63.2	-69.8	0	0	0	113.2	Y28 C34	Y28-Y30 PolarHBondContact O-N 3.39Å; Y30-C34 WeakPolarHBondContact O-CB 3.14Å
31	V	96.6	Very high	96.1	Very high	40 Å²	40	81.6 Å²	81.6	24%	0.242	40%	0.403	C	S	.	.	H	α-helix	trans	-89.5	-49.2	177.1	-179.8	0	0	0	0	110.8	Y28 K29 C34 L44 K45 T48	Y28-V31 PolarHBondContact O-N 3.34Å; Y28-V31 VanDerWaalsContact O-N 3.08Å; K29-V31 PolarHBondContact O-N 2.91Å; K29-V31 VanDerWaalsContact O-N 3.14Å; V31-C34 WeakPolarHBondContact O-CB 3.44Å; V31-C34 PolarHBondContact O-N 3.33Å; V31-L44 HydrophobicContact CG1-CD2 3.99Å; V31-L44 HydrophobicContact CG1-CG 3.72Å; V31-L44 HydrophobicContact CG2-CD2 4.38Å; V31-K45 HydrophobicContact CG1-CG 4.19Å; V31-K45 WeakPolarHBondContact O-CE 3.42Å; V31-K45 VanDerWaalsContact O-CG 3.29Å; V31-K45 WeakPolarHBondContact O-CG 3.4Å; V31-T48 HydrophobicContact CB-CG2 4.35Å; V31-T48 HydrophobicContact CG1-CG2 4.29Å; V31-T48 WeakPolarHBondContact CG1-OG1 3.39Å
32	L	95	Very high	96.1	Very high	14 Å²	14	85.9 Å²	85.9	7%	0.073	43%	0.425	C	S	.	.	H	α-helix	trans	-67.2	-39.6	-172.7	-65.8	-174.4	0	0	0	112.9	V25 Y28 K29 T48 W49 L52	V25-L32 HydrophobicContact CG1-CD1 4.34Å; V25-L32 HydrophobicContact CG2-CD1 4.28Å; Y28-L32 PolarHBondContact O-N 3.18Å; K29-L32 PolarHBondContact O-N 3.06Å; L32-T48 HydrophobicContact CD2-CG2 3.71Å; L32-T48 HydrophobicContact CG-CG2 4.03Å; L32-W49 HydrophobicContact CD1-CH2 4.19Å; L32-W49 HydrophobicContact CD1-CZ2 4.02Å; L32-W49 HydrophobicContact CD2-CD2 4.12Å; L32-W49 HydrophobicContact CD2-CG 4.1Å; L32-W49 HydrophobicContact CD2-CZ2 4.28Å; L32-L52 HydrophobicContact CD1-CD1 3.94Å
33	E	92.8	Very high	96.1	Very high	86 Å²	86	83.9 Å²	83.9	40%	0.402	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	10.1	-178.5	-63.4	-67.5	147.6	0	0	112.5	K29 K35 W74 K78	K29-E33 PolarHBondContact O-N 3.41Å; E33-K35 PolarHBondContact O-N 2.72Å; E33-W74 WeakPolarHBondContact OE1-CZ2 3.33Å; E33-W74 PolarHBondContact OE1-NE1 2.68Å; E33-K78 IonicContact OE1-NZ 3.71Å; E33-K78 PolarHBondContact OE1-NZ 3.36Å; E33-K78 IonicContact OE2-NZ 2.8Å
34	C	94.2	Very high	96.1	Very high	37 Å²	37	84.4 Å²	84.4	25%	0.25	41%	0.413	C	S	.	.			trans	-56.3	132.3	171.8	-174.2	0	0	0	0	110.5	Y30 V31 K36 T41 K45	Y30-C34 WeakPolarHBondContact O-CB 3.14Å; V31-C34 WeakPolarHBondContact O-CB 3.44Å; V31-C34 PolarHBondContact O-N 3.33Å; C34-K36 PolarHBondContact O-N 2.9Å; C34-T41 HydrophobicContact CB-CG2 4.44Å; C34-K45 WeakPolarHBondContact O-CE 3.3Å; C34-K45 PolarHBondContact O-NZ 3.32Å
35	K	93.8	Very high	96.1	Very high	204 Å²	204	86 Å²	86	89%	0.887	42%	0.419	S	S	*	.			trans	-73.6	-12.8	178.7	-69.1	179.3	176.9	176.5	0	114	E33	E33-K35 PolarHBondContact O-N 2.72Å
36	K	93.9	Very high	96.1	Very high	141 Å²	141	90.3 Å²	90.3	61%	0.613	44%	0.439	S	S	*	.			trans	-71	146	-179.7	-61.1	179.7	-178	175.6	0	111.4	C34 T41 K45	C34-K36 PolarHBondContact O-N 2.9Å; K36-T41 HydrophobicContact CB-CG2 4.03Å; K36-T41 WeakPolarHBondContact O-CG2 3.22Å; K36-K45 PolarHBondContact O-NZ 2.93Å
37	S	94	Very high	96.1	Very high	91 Å²	91	92.8 Å²	92.8	64%	0.636	44%	0.444	S	S	*	.			trans	-135.2	20.7	-175.5	-60.4	0	0	0	0	112.5	I42	S37-I42 VanDerWaalsContact O-CD1 3.26Å; S37-I42 WeakPolarHBondContact O-CD1 3.44Å
38	D	96.9	Very high	96.2	Very high	72 Å²	72	87.8 Å²	87.8	39%	0.385	42%	0.423	S	S	.	.	S	Bend	trans	-69.4	157.4	170.2	63.6	-63.9	0	0	0	110.9	R40 T41 I42	D38-R40 PolarHBondContact O-N 3.04Å; D38-R40 VanDerWaalsContact O-N 3.15Å; D38-R40 WeakPolarHBondContact OD2-CB 3.45Å; D38-T41 PolarHBondContact O-N 3Å; D38-T41 WeakPolarHBondContact OD1-CB 3.4Å; D38-T41 PolarHBondContact OD1-OG1 3.28Å; D38-T41 PolarHBondContact OD2-N 3.38Å; D38-T41 PolarHBondContact OD2-OG1 2.84Å; D38-I42 WeakPolarHBondContact O-CG1 3.26Å; D38-I42 PolarHBondContact O-N 2.99Å
39	A	97.5	Very high	96.3	Very high	82 Å²	82	85.8 Å²	85.8	68%	0.678	42%	0.415	S	S	*	.	H	α-helix	trans	-55.3	-37.2	-174.4	0	0	0	0	0	113.1	I42 A43	A39-I42 PolarHBondContact O-N 3.46Å; A39-A43 WeakPolarHBondContact O-CB 3.23Å; A39-A43 PolarHBondContact O-N 3.4Å
40	R	97.1	Very high	96.4	Very high	205 Å²	205	85.9 Å²	85.9	77%	0.774	42%	0.417	S	S	*	.	H	α-helix	trans	-64.8	-48.4	176.3	-179.3	-168.4	-65.9	-127.3	0.3	110.9	D38 I42 A43 L44	D38-R40 PolarHBondContact O-N 3.04Å; D38-R40 VanDerWaalsContact O-N 3.15Å; D38-R40 WeakPolarHBondContact OD2-CB 3.45Å; R40-I42 VanDerWaalsContact C-N 3.34Å; R40-I42 PolarHBondContact O-N 3.26Å; R40-A43 PolarHBondContact O-N 3.01Å; R40-L44 WeakPolarHBondContact O-CB 3.44Å; R40-L44 PolarHBondContact O-N 3.32Å
41	T	96.5	Very high	96.5	Very high	18 Å²	18	79 Å²	79	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-63.1	-39.8	177.4	-60.6	0	0	0	0	112.1	C34 K36 D38 L44 K45	C34-T41 HydrophobicContact CB-CG2 4.44Å; K36-T41 HydrophobicContact CB-CG2 4.03Å; K36-T41 WeakPolarHBondContact O-CG2 3.22Å; D38-T41 PolarHBondContact O-N 3Å; D38-T41 WeakPolarHBondContact OD1-CB 3.4Å; D38-T41 PolarHBondContact OD1-OG1 3.28Å; D38-T41 PolarHBondContact OD2-N 3.38Å; D38-T41 PolarHBondContact OD2-OG1 2.84Å; T41-L44 PolarHBondContact O-N 2.99Å; T41-K45 HydrophobicContact CG2-CD 4.19Å; T41-K45 HydrophobicContact CG2-CG 4.42Å; T41-K45 WeakPolarHBondContact O-CB 3.41Å; T41-K45 WeakPolarHBondContact O-CG 3.4Å; T41-K45 PolarHBondContact O-N 2.93Å
42	I	97.2	Very high	96.6	Very high	90 Å²	90	77.1 Å²	77.1	46%	0.462	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-48.6	177	-67.6	170.3	0	0	0	110.5	S37 D38 A39 R40 L44 K45 Q46	S37-I42 VanDerWaalsContact O-CD1 3.26Å; S37-I42 WeakPolarHBondContact O-CD1 3.44Å; D38-I42 WeakPolarHBondContact O-CG1 3.26Å; D38-I42 PolarHBondContact O-N 2.99Å; A39-I42 PolarHBondContact O-N 3.46Å; R40-I42 VanDerWaalsContact C-N 3.34Å; R40-I42 PolarHBondContact O-N 3.26Å; I42-L44 VanDerWaalsContact C-N 3.31Å; I42-L44 PolarHBondContact O-N 3.46Å; I42-K45 PolarHBondContact O-N 3.4Å; I42-Q46 PolarHBondContact O-N 3.19Å
43	A	97.4	Very high	96.7	Very high	33 Å²	33	76.8 Å²	76.8	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-40.5	177.2	0	0	0	0	0	111.7	A39 R40 Q46 R47	A39-A43 WeakPolarHBondContact O-CB 3.23Å; A39-A43 PolarHBondContact O-N 3.4Å; R40-A43 PolarHBondContact O-N 3.01Å; A43-Q46 PolarHBondContact O-N 3.3Å; A43-R47 WeakPolarHBondContact O-CG 3.22Å; A43-R47 PolarHBondContact O-N 3.39Å
44	L	97.7	Very high	97	Very high	77 Å²	77	79.8 Å²	79.8	40%	0.403	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-45.9	177.2	-177.4	62.4	0	0	0	112	V31 R40 T41 I42 Q46 R47 T48	V31-L44 HydrophobicContact CG1-CD2 3.99Å; V31-L44 HydrophobicContact CG1-CG 3.72Å; V31-L44 HydrophobicContact CG2-CD2 4.38Å; R40-L44 WeakPolarHBondContact O-CB 3.44Å; R40-L44 PolarHBondContact O-N 3.32Å; T41-L44 PolarHBondContact O-N 2.99Å; I42-L44 VanDerWaalsContact C-N 3.31Å; I42-L44 PolarHBondContact O-N 3.46Å; L44-Q46 VanDerWaalsContact C-N 3.29Å; L44-Q46 PolarHBondContact O-N 3.17Å; L44-R47 PolarHBondContact O-N 3.07Å; L44-T48 WeakPolarHBondContact O-CB 3.15Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.26Å
45	K	97.4	Very high	97.1	Very high	42 Å²	42	80.2 Å²	80.2	18%	0.183	40%	0.4	C	S	.	.	H	α-helix	trans	-57.7	-42.7	173.6	-77	173.1	175.5	170	0	111.4	V31 C34 K36 T41 I42 T48 W49	V31-K45 HydrophobicContact CG1-CG 4.19Å; V31-K45 WeakPolarHBondContact O-CE 3.42Å; V31-K45 VanDerWaalsContact O-CG 3.29Å; V31-K45 WeakPolarHBondContact O-CG 3.4Å; C34-K45 WeakPolarHBondContact O-CE 3.3Å; C34-K45 PolarHBondContact O-NZ 3.32Å; K36-K45 PolarHBondContact O-NZ 2.93Å; T41-K45 HydrophobicContact CG2-CD 4.19Å; T41-K45 HydrophobicContact CG2-CG 4.42Å; T41-K45 WeakPolarHBondContact O-CB 3.41Å; T41-K45 WeakPolarHBondContact O-CG 3.4Å; T41-K45 PolarHBondContact O-N 2.93Å; I42-K45 PolarHBondContact O-N 3.4Å; K45-T48 PolarHBondContact O-N 3.35Å; K45-W49 PolarHBondContact O-N 2.91Å
46	Q	97.8	Very high	97.3	Very high	96 Å²	96	70.5 Å²	70.5	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-47.7	178.7	-177	167.7	-4.1	0	0	112.2	I42 A43 L44 T48 W49 Q50	I42-Q46 PolarHBondContact O-N 3.19Å; A43-Q46 PolarHBondContact O-N 3.3Å; L44-Q46 VanDerWaalsContact C-N 3.29Å; L44-Q46 PolarHBondContact O-N 3.17Å; Q46-T48 VanDerWaalsContact C-N 3.27Å; Q46-T48 PolarHBondContact O-N 3.11Å; Q46-W49 PolarHBondContact O-N 3.11Å; Q46-Q50 WeakPolarHBondContact O-CG 3.42Å; Q46-Q50 PolarHBondContact O-N 3.23Å; Q46-Q50 VanDerWaalsContact O-N 3.07Å
47	R	98.1	Very high	97.4	Very high	163 Å²	163	66.2 Å²	66.2	62%	0.615	34%	0.341	S	S	*	.	H	α-helix	trans	-60.7	-39.3	174.9	-67.9	-179.7	-156.8	146.3	2.5	112	A43 L44 W49 Q50 A51	A43-R47 WeakPolarHBondContact O-CG 3.22Å; A43-R47 PolarHBondContact O-N 3.39Å; L44-R47 PolarHBondContact O-N 3.07Å; R47-W49 PolarHBondContact O-N 3.12Å; R47-Q50 WeakPolarHBondContact O-CB 3.29Å; R47-Q50 PolarHBondContact O-N 2.77Å; R47-Q50 VanDerWaalsContact O-N 3.17Å; R47-A51 PolarHBondContact O-N 3.35Å
48	T	98.4	Very high	97.5	Very high	15 Å²	15	65.8 Å²	65.8	9%	0.092	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-41.2	178.2	-55.3	0	0	0	0	111.4	Y28 V31 L32 L44 K45 Q46 Q50 A51 L52	Y28-T48 HydrophobicContact CD1-CG2 3.88Å; Y28-T48 HydrophobicContact CD2-CG2 4.48Å; Y28-T48 HydrophobicContact CG-CG2 3.74Å; V31-T48 HydrophobicContact CB-CG2 4.35Å; V31-T48 HydrophobicContact CG1-CG2 4.29Å; V31-T48 WeakPolarHBondContact CG1-OG1 3.39Å; L32-T48 HydrophobicContact CD2-CG2 3.71Å; L32-T48 HydrophobicContact CG-CG2 4.03Å; L44-T48 WeakPolarHBondContact O-CB 3.15Å; L44-T48 PolarHBondContact O-N 3.49Å; L44-T48 PolarHBondContact O-OG1 3.26Å; K45-T48 PolarHBondContact O-N 3.35Å; Q46-T48 VanDerWaalsContact C-N 3.27Å; Q46-T48 PolarHBondContact O-N 3.11Å; T48-Q50 VanDerWaalsContact C-N 3.33Å; T48-Q50 PolarHBondContact O-N 2.74Å; T48-A51 PolarHBondContact O-N 3.14Å; T48-L52 VanDerWaalsContact O-CB 3.26Å; T48-L52 WeakPolarHBondContact O-CB 3.4Å; T48-L52 PolarHBondContact O-N 2.9Å
49	W	98.3	Very high	97.4	Very high	14 Å²	14	65.8 Å²	65.8	5%	0.053	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-37.7	172.7	-84.7	114.2	0	0	0	112.9	L21 V25 L32 K45 Q46 R47 L52 A53 F67 L70 K71 W74	L21-W49 HydrophobicContact CD1-CZ3 4.46Å; V25-W49 HydrophobicContact CG2-CH2 4.04Å; V25-W49 HydrophobicContact CG2-CZ3 4.36Å; L32-W49 HydrophobicContact CD1-CH2 4.19Å; L32-W49 HydrophobicContact CD1-CZ2 4.02Å; L32-W49 HydrophobicContact CD2-CD2 4.12Å; L32-W49 HydrophobicContact CD2-CG 4.1Å; L32-W49 HydrophobicContact CD2-CZ2 4.28Å; K45-W49 PolarHBondContact O-N 2.91Å; Q46-W49 PolarHBondContact O-N 3.11Å; R47-W49 PolarHBondContact O-N 3.12Å; W49-L52 HydrophobicContact CE3-CD1 4.21Å; W49-L52 HydrophobicContact CE3-CD2 4.22Å; W49-L52 HydrophobicContact CZ3-CD1 3.99Å; W49-L52 HydrophobicContact CZ3-CD2 4.13Å; W49-A53 WeakPolarHBondContact O-CB 3.4Å; W49-A53 PolarHBondContact O-N 3.08Å; W49-F67 HydrophobicContact CB-CB 4.18Å; W49-F67 HydrophobicContact CB-CD2 4.02Å; W49-F67 HydrophobicContact CB-CG 4.46Å; W49-F67 WeakPolarHBondContact O-CB 3.41Å; W49-L70 HydrophobicContact CZ3-CB 4.33Å; W49-K71 HydrophobicContact CD2-CB 4.14Å; W49-K71 HydrophobicContact CD2-CG 4.45Å; W49-K71 HydrophobicContact CE3-CB 4.22Å; W49-K71 HydrophobicContact CH2-CB 4.31Å; W49-K71 HydrophobicContact CZ2-CB 4.2Å; W49-K71 HydrophobicContact CZ2-CG 4.01Å; W49-K71 HydrophobicContact CZ3-CB 4.3Å; W49-W74 HydrophobicContact CH2-CB 3.87Å; W49-W74 AromaticContact CH2-CD1 3.83Å; W49-W74 HydrophobicContact CH2-CG 4.01Å; W49-W74 AromaticContact CZ2-CD1 3.87Å; W49-W74 HydrophobicContact CZ2-CG 4.49Å
50	Q	98.1	Very high	97	Very high	93 Å²	93	66.6 Å²	66.6	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-66.7	-45.3	175.5	-69.6	171	-30.8	0	0	111.7	Q46 R47 T48 A53 H54 F67	Q46-Q50 WeakPolarHBondContact O-CG 3.42Å; Q46-Q50 PolarHBondContact O-N 3.23Å; Q46-Q50 VanDerWaalsContact O-N 3.07Å; R47-Q50 WeakPolarHBondContact O-CB 3.29Å; R47-Q50 PolarHBondContact O-N 2.77Å; R47-Q50 VanDerWaalsContact O-N 3.17Å; T48-Q50 VanDerWaalsContact C-N 3.33Å; T48-Q50 PolarHBondContact O-N 2.74Å; Q50-A53 PolarHBondContact O-N 2.79Å; Q50-H54 PolarHBondContact O-N 2.9Å; Q50-F67 HydrophobicContact CG-CD1 4.1Å; Q50-F67 HydrophobicContact CG-CE1 4.49Å; Q50-F67 HydrophobicContact CG-CG 4.35Å
51	A	98.1	Very high	96.6	Very high	46 Å²	46	62 Å²	62	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-61.5	-43.9	175.3	0	0	0	0	0	111.5	R47 T48 A53 H54 E55	R47-A51 PolarHBondContact O-N 3.35Å; T48-A51 PolarHBondContact O-N 3.14Å; A51-A53 VanDerWaalsContact C-N 3.32Å; A51-A53 PolarHBondContact O-N 3.41Å; A51-H54 WeakPolarHBondContact O-CB 3.29Å; A51-H54 PolarHBondContact O-N 3.31Å; A51-E55 PolarHBondContact O-N 2.94Å
52	L	98.3	Very high	96.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.4	-44.2	173.7	-176.5	157.2	0	0	0	111.2	L21 L24 V25 Y28 L32 T48 W49 H54 E55 Y56 L70	L21-L52 HydrophobicContact CD1-CD2 3.92Å; L24-L52 HydrophobicContact CB-CD1 3.99Å; L24-L52 HydrophobicContact CB-CD2 4.48Å; L24-L52 HydrophobicContact CB-CG 3.88Å; L24-L52 HydrophobicContact CD1-CD2 4.44Å; L24-L52 HydrophobicContact CD1-CG 4.35Å; V25-L52 HydrophobicContact CG2-CD1 3.88Å; Y28-L52 HydrophobicContact CD2-CB 4.22Å; Y28-L52 HydrophobicContact CD2-CD1 4.11Å; Y28-L52 HydrophobicContact CD2-CG 4.4Å; Y28-L52 HydrophobicContact CE2-CB 4.27Å; L32-L52 HydrophobicContact CD1-CD1 3.94Å; T48-L52 VanDerWaalsContact O-CB 3.26Å; T48-L52 WeakPolarHBondContact O-CB 3.4Å; T48-L52 PolarHBondContact O-N 2.9Å; W49-L52 HydrophobicContact CE3-CD1 4.21Å; W49-L52 HydrophobicContact CE3-CD2 4.22Å; W49-L52 HydrophobicContact CZ3-CD1 3.99Å; W49-L52 HydrophobicContact CZ3-CD2 4.13Å; L52-H54 VanDerWaalsContact C-N 3.34Å; L52-H54 PolarHBondContact O-N 3.06Å; L52-E55 PolarHBondContact O-N 3.47Å; L52-Y56 VanDerWaalsContact O-CB 3.27Å; L52-Y56 WeakPolarHBondContact O-CB 3.5Å; L52-Y56 PolarHBondContact O-N 3.14Å; L52-L70 HydrophobicContact CD2-CB 4.47Å; L52-L70 HydrophobicContact CD2-CD1 3.69Å
53	A	97.6	Very high	96.1	Very high	8 Å²	8	58.9 Å²	58.9	7%	0.066	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-39.1	178	0	0	0	0	0	112.5	W49 Q50 A51 N57 F67 L70	W49-A53 WeakPolarHBondContact O-CB 3.4Å; W49-A53 PolarHBondContact O-N 3.08Å; Q50-A53 PolarHBondContact O-N 2.79Å; A51-A53 VanDerWaalsContact C-N 3.32Å; A51-A53 PolarHBondContact O-N 3.41Å; A53-N57 VanDerWaalsContact O-CB 3.3Å; A53-N57 WeakPolarHBondContact O-CB 3.16Å; A53-N57 PolarHBondContact O-N 2.93Å; A53-N57 PolarHBondContact O-ND2 3.24Å; A53-F67 HydrophobicContact CB-CB 3.82Å; A53-L70 HydrophobicContact CB-CD1 3.78Å
54	H	97.8	Very high	95.9	Very high	149 Å²	149	62.4 Å²	62.4	69%	0.69	33%	0.334	S	S	*	.	H	α-helix	trans	-62.3	-48.2	173.6	-176.4	-87.3	0	0	0	111.4	Q50 A51 L52 Y56 N57 S58	Q50-H54 PolarHBondContact O-N 2.9Å; A51-H54 WeakPolarHBondContact O-CB 3.29Å; A51-H54 PolarHBondContact O-N 3.31Å; L52-H54 VanDerWaalsContact C-N 3.34Å; L52-H54 PolarHBondContact O-N 3.06Å; H54-Y56 PolarHBondContact O-N 3.22Å; H54-N57 PolarHBondContact O-N 2.96Å; H54-S58 PolarHBondContact O-N 2.88Å
55	E	97.7	Very high	95.8	Very high	46 Å²	46	59.7 Å²	59.7	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-40.9	177.9	-167.9	172.4	177	0	0	111.9	L24 K27 Y28 A51 L52 S58	L24-E55 HydrophobicContact CD2-CB 4.27Å; L24-E55 HydrophobicContact CD2-CG 3.68Å; L24-E55 WeakPolarHBondContact CD2-OE1 3.46Å; K27-E55 IonicContact NZ-OE1 2.68Å; K27-E55 PolarHBondContact NZ-OE1 2.86Å; K27-E55 IonicContact NZ-OE2 2.88Å; K27-E55 PolarHBondContact NZ-OE2 3.01Å; Y28-E55 WeakPolarHBondContact CE2-OE2 3.29Å; Y28-E55 PolarHBondContact OH-OE2 3.31Å; A51-E55 PolarHBondContact O-N 2.94Å; L52-E55 PolarHBondContact O-N 3.47Å; E55-S58 PolarHBondContact O-N 3.34Å; E55-S58 PolarHBondContact O-OG 2.92Å
56	Y	97.8	Very high	95.7	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.9	-51.6	174.1	176.8	-86.7	0	0	0	111	E17 I20 L24 L52 H54 S58 Q59 V62 S63 R65 L70	E17-Y56 HydrophobicContact CB-CE2 4.49Å; E17-Y56 WeakPolarHBondContact CB-OH 3.49Å; E17-Y56 WeakPolarHBondContact CG-OH 3.44Å; E17-Y56 PolarHBondContact OE1-OH 3.02Å; I20-Y56 HydrophobicContact CB-CE2 4.47Å; I20-Y56 HydrophobicContact CG2-CD2 3.79Å; I20-Y56 HydrophobicContact CG2-CE2 4.15Å; L24-Y56 HydrophobicContact CD1-CD2 4.32Å; L52-Y56 VanDerWaalsContact O-CB 3.27Å; L52-Y56 WeakPolarHBondContact O-CB 3.5Å; L52-Y56 PolarHBondContact O-N 3.14Å; H54-Y56 PolarHBondContact O-N 3.22Å; Y56-S58 PolarHBondContact O-N 3.31Å; Y56-Q59 VanDerWaalsContact O-CB 3.27Å; Y56-Q59 WeakPolarHBondContact O-CB 3.43Å; Y56-Q59 WeakPolarHBondContact O-CG 3.21Å; Y56-Q59 PolarHBondContact O-N 2.92Å; Y56-V62 HydrophobicContact CD1-CG2 4.19Å; Y56-V62 HydrophobicContact CE1-CB 3.88Å; Y56-V62 HydrophobicContact CE1-CG1 4.41Å; Y56-V62 HydrophobicContact CE1-CG2 3.88Å; Y56-V62 HydrophobicContact CE2-CG1 4.34Å; Y56-V62 VanDerWaalsContact O-CG2 3.3Å; Y56-V62 WeakPolarHBondContact O-CG2 3.39Å; Y56-S63 WeakPolarHBondContact CE1-O 3.38Å; Y56-R65 HydrophobicContact CD1-CB 4.43Å; Y56-R65 HydrophobicContact CE1-CB 4.09Å; Y56-R65 HydrophobicContact CE1-CG 3.77Å; Y56-L70 HydrophobicContact CD1-CD1 4.08Å; Y56-L70 HydrophobicContact CD1-CD2 3.99Å; Y56-L70 HydrophobicContact CD2-CD2 4.11Å; Y56-L70 HydrophobicContact CE1-CD2 3.96Å; Y56-L70 HydrophobicContact CE2-CD2 4.05Å; Y56-L70 HydrophobicContact CG-CD1 3.93Å; Y56-L70 HydrophobicContact CG-CD2 4.08Å
57	N	96.4	Very high	95.6	Very high	50 Å²	50	58.5 Å²	58.5	27%	0.267	32%	0.315	S	S	.	.	H	α-helix	trans	-67.6	-16.3	-178.2	-70.8	-23.8	0	0	0	113.5	A53 H54 Q59 L64 R65	A53-N57 VanDerWaalsContact O-CB 3.3Å; A53-N57 WeakPolarHBondContact O-CB 3.16Å; A53-N57 PolarHBondContact O-N 2.93Å; A53-N57 PolarHBondContact O-ND2 3.24Å; H54-N57 PolarHBondContact O-N 2.96Å; N57-Q59 VanDerWaalsContact C-N 3.33Å; N57-L64 HydrophobicContact CB-CD2 3.7Å; N57-L64 WeakPolarHBondContact OD1-CA 3.12Å; N57-R65 PolarHBondContact ND2-O 3.38Å; N57-R65 PolarHBondContact OD1-N 3.48Å; N57-R65 PolarHBondContact OD1-O 3.48Å
58	S	96	Very high	95.5	Very high	82 Å²	82	57.3 Å²	57.3	57%	0.573	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-11.5	172.5	75.1	0	0	0	0	113.8	H54 E55 Y56	H54-S58 PolarHBondContact O-N 2.88Å; E55-S58 PolarHBondContact O-N 3.34Å; E55-S58 PolarHBondContact O-OG 2.92Å; Y56-S58 PolarHBondContact O-N 3.31Å
59	Q	94.1	Very high	95.4	Very high	72 Å²	72	60.7 Å²	60.7	34%	0.336	33%	0.329	S	S	.	.	S	Bend	trans	-71.8	144.4	177.8	-62.4	-63.9	-30	0	0	111	I20 Y56 N57 V62	I20-Q59 HydrophobicContact CD1-CB 4.36Å; I20-Q59 HydrophobicContact CG2-CG 3.87Å; Y56-Q59 VanDerWaalsContact O-CB 3.27Å; Y56-Q59 WeakPolarHBondContact O-CB 3.43Å; Y56-Q59 WeakPolarHBondContact O-CG 3.21Å; Y56-Q59 PolarHBondContact O-N 2.92Å; N57-Q59 VanDerWaalsContact C-N 3.33Å; Q59-V62 HydrophobicContact CB-CG1 3.88Å; Q59-V62 HydrophobicContact CB-CG2 4.33Å; Q59-V62 WeakPolarHBondContact O-CG2 3.37Å
60	P	90	Very high	95.3	Very high	99 Å²	99	60 Å²	60	64%	0.643	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	152.8	170.7	29.3	-34	0	0	0	110.6	V62	P60-V62 PolarHBondContact O-N 3.19Å; P60-V62 VanDerWaalsContact O-N 3.11Å
61	S	87.2	Confident	95.2	Very high	110 Å²	110	60.3 Å²	60.3	77%	0.769	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	16.1	171	-50.5	0	0	0	0	116.1
62	V	91.8	Very high	95.1	Very high	21 Å²	21	64.4 Å²	64.4	13%	0.127	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-98.2	152.2	168.4	-53.6	0	0	0	0	111.2	E17 I20 Y56 Q59 P60	E17-V62 HydrophobicContact CG-CB 4.28Å; E17-V62 HydrophobicContact CG-CG1 4.25Å; I20-V62 HydrophobicContact CD1-CG1 3.59Å; Y56-V62 HydrophobicContact CD1-CG2 4.19Å; Y56-V62 HydrophobicContact CE1-CB 3.88Å; Y56-V62 HydrophobicContact CE1-CG1 4.41Å; Y56-V62 HydrophobicContact CE1-CG2 3.88Å; Y56-V62 HydrophobicContact CE2-CG1 4.34Å; Y56-V62 VanDerWaalsContact O-CG2 3.3Å; Y56-V62 WeakPolarHBondContact O-CG2 3.39Å; Q59-V62 HydrophobicContact CB-CG1 3.88Å; Q59-V62 HydrophobicContact CB-CG2 4.33Å; Q59-V62 WeakPolarHBondContact O-CG2 3.37Å; P60-V62 PolarHBondContact O-N 3.19Å; P60-V62 VanDerWaalsContact O-N 3.11Å
63	S	91.6	Very high	95	Very high	21 Å²	21	65 Å²	65	15%	0.147	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-80.2	141.9	164.8	-57.1	0	0	0	0	109.7	A10 E17 Y56 R65	A10-S63 WeakPolarHBondContact CB-OG 3.4Å; E17-S63 WeakPolarHBondContact OE1-CB 3.24Å; E17-S63 PolarHBondContact OE1-N 3.15Å; E17-S63 PolarHBondContact OE1-OG 3.01Å; Y56-S63 WeakPolarHBondContact CE1-O 3.38Å; S63-R65 WeakPolarHBondContact O-CG 3.41Å; S63-R65 PolarHBondContact O-N 2.98Å
64	L	93.8	Very high	95	Very high	107 Å²	107	66.2 Å²	66.2	56%	0.56	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-60.5	130	175.7	-64	177.7	0	0	0	111.2	I7 N57	I7-L64 HydrophobicContact CD1-CD1 4.4Å; N57-L64 HydrophobicContact CB-CD2 3.7Å; N57-L64 WeakPolarHBondContact OD1-CA 3.12Å
65	R	94.8	Very high	94.9	Very high	20 Å²	20	63 Å²	63	8%	0.075	33%	0.327	C	S	.	.			trans	-130.6	142.9	179.5	-61.3	-62.2	-175.2	-173.4	-0.7	111.8	A10 Y12 F13 Y56 N57 S63 Q69 L70	A10-R65 PolarHBondContact O-NH1 3.42Å; A10-R65 PolarHBondContact O-NH2 2.92Å; Y12-R65 PolarHBondContact O-NH2 3.06Å; Y12-R65 VanDerWaalsContact O-NH2 3.16Å; F13-R65 HydrophobicContact CE1-CG 3.74Å; F13-R65 HydrophobicContact CZ-CG 3.81Å; Y56-R65 HydrophobicContact CD1-CB 4.43Å; Y56-R65 HydrophobicContact CE1-CB 4.09Å; Y56-R65 HydrophobicContact CE1-CG 3.77Å; N57-R65 PolarHBondContact ND2-O 3.38Å; N57-R65 PolarHBondContact OD1-N 3.48Å; N57-R65 PolarHBondContact OD1-O 3.48Å; S63-R65 WeakPolarHBondContact O-CG 3.41Å; S63-R65 PolarHBondContact O-N 2.98Å; R65-Q69 HydrophobicContact CB-CB 4.41Å; R65-L70 HydrophobicContact CB-CD1 4.46Å; R65-L70 HydrophobicContact CB-CD2 3.69Å; R65-L70 HydrophobicContact CB-CG 3.86Å; R65-L70 HydrophobicContact CG-CD2 3.98Å
66	D	95.4	Very high	94.9	Very high	75 Å²	75	64.9 Å²	64.9	40%	0.401	34%	0.339	S	S	.	.			trans	-75.5	152.2	166	-173.7	19.3	0	0	0	110.3	K68 Q69 L70	D66-K68 PolarHBondContact O-N 2.89Å; D66-K68 VanDerWaalsContact O-N 3.11Å; D66-Q69 HydrophobicContact CB-CG 4.45Å; D66-Q69 WeakPolarHBondContact O-CB 3.37Å; D66-Q69 PolarHBondContact O-N 3.15Å; D66-L70 PolarHBondContact O-N 3.39Å; D66-L70 VanDerWaalsContact O-N 3.12Å
67	F	96.4	Very high	94.8	Very high	37 Å²	37	66.4 Å²	66.4	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-56.5	-31.5	178.4	79	-92.1	0	0	0	111.9	W49 Q50 A53 L70 K71	W49-F67 HydrophobicContact CB-CB 4.18Å; W49-F67 HydrophobicContact CB-CD2 4.02Å; W49-F67 HydrophobicContact CB-CG 4.46Å; W49-F67 WeakPolarHBondContact O-CB 3.41Å; Q50-F67 HydrophobicContact CG-CD1 4.1Å; Q50-F67 HydrophobicContact CG-CE1 4.49Å; Q50-F67 HydrophobicContact CG-CG 4.35Å; A53-F67 HydrophobicContact CB-CB 3.82Å; F67-L70 PolarHBondContact O-N 3.29Å; F67-K71 VanDerWaalsContact O-CB 3.24Å; F67-K71 WeakPolarHBondContact O-CB 3.26Å; F67-K71 PolarHBondContact O-N 3.29Å
68	K	95.9	Very high	94.7	Very high	138 Å²	138	66 Å²	66	60%	0.6	34%	0.343	S	S	*	.	H	α-helix	trans	-63.4	-40.1	175.2	-63.7	178.4	-175.3	172	0	112	D66 K72	D66-K68 PolarHBondContact O-N 2.89Å; D66-K68 VanDerWaalsContact O-N 3.11Å; K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.07Å
69	Q	95.9	Very high	94.7	Very high	86 Å²	86	64.8 Å²	64.8	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-70.1	-43.2	178.9	-64.1	173.7	-51.2	0	0	110.7	F13 R65 D66 K72 C73	F13-Q69 HydrophobicContact CZ-CB 4.35Å; R65-Q69 HydrophobicContact CB-CB 4.41Å; D66-Q69 HydrophobicContact CB-CG 4.45Å; D66-Q69 WeakPolarHBondContact O-CB 3.37Å; D66-Q69 PolarHBondContact O-N 3.15Å; Q69-K72 PolarHBondContact O-N 2.8Å; Q69-C73 WeakPolarHBondContact O-CB 3.17Å; Q69-C73 PolarHBondContact O-N 2.86Å
70	L	96.8	Very high	94.7	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.1	-46.9	175.5	-63.2	-178.6	0	0	0	111.6	F13 L21 W49 L52 A53 Y56 R65 D66 F67 K72 C73 W74	F13-L70 HydrophobicContact CE1-CD2 3.7Å; F13-L70 HydrophobicContact CZ-CD2 4.05Å; L21-L70 HydrophobicContact CD1-CB 4.13Å; L21-L70 HydrophobicContact CD1-CD2 4.36Å; W49-L70 HydrophobicContact CZ3-CB 4.33Å; L52-L70 HydrophobicContact CD2-CB 4.47Å; L52-L70 HydrophobicContact CD2-CD1 3.69Å; A53-L70 HydrophobicContact CB-CD1 3.78Å; Y56-L70 HydrophobicContact CD1-CD1 4.08Å; Y56-L70 HydrophobicContact CD1-CD2 3.99Å; Y56-L70 HydrophobicContact CD2-CD2 4.11Å; Y56-L70 HydrophobicContact CE1-CD2 3.96Å; Y56-L70 HydrophobicContact CE2-CD2 4.05Å; Y56-L70 HydrophobicContact CG-CD1 3.93Å; Y56-L70 HydrophobicContact CG-CD2 4.08Å; R65-L70 HydrophobicContact CB-CD1 4.46Å; R65-L70 HydrophobicContact CB-CD2 3.69Å; R65-L70 HydrophobicContact CB-CG 3.86Å; R65-L70 HydrophobicContact CG-CD2 3.98Å; D66-L70 PolarHBondContact O-N 3.39Å; D66-L70 VanDerWaalsContact O-N 3.12Å; F67-L70 PolarHBondContact O-N 3.29Å; L70-K72 VanDerWaalsContact C-N 3.32Å; L70-K72 PolarHBondContact O-N 2.97Å; L70-C73 WeakPolarHBondContact O-CB 3.46Å; L70-C73 PolarHBondContact O-N 3.47Å; L70-C73 VanDerWaalsContact O-N 3.15Å; L70-W74 PolarHBondContact O-N 2.87Å
71	K	96.3	Very high	95	Very high	100 Å²	100	68.5 Å²	68.5	44%	0.435	34%	0.343	S	S	.	.	H	α-helix	trans	-57.2	-45.5	174.3	-175.9	177.3	-179.8	-178.4	0	111.4	W49 F67 C73 W74 E75	W49-K71 HydrophobicContact CD2-CB 4.14Å; W49-K71 HydrophobicContact CD2-CG 4.45Å; W49-K71 HydrophobicContact CE3-CB 4.22Å; W49-K71 HydrophobicContact CH2-CB 4.31Å; W49-K71 HydrophobicContact CZ2-CB 4.2Å; W49-K71 HydrophobicContact CZ2-CG 4.01Å; W49-K71 HydrophobicContact CZ3-CB 4.3Å; F67-K71 VanDerWaalsContact O-CB 3.24Å; F67-K71 WeakPolarHBondContact O-CB 3.26Å; F67-K71 PolarHBondContact O-N 3.29Å; K71-C73 VanDerWaalsContact C-N 3.34Å; K71-C73 PolarHBondContact O-N 3.16Å; K71-W74 PolarHBondContact O-N 3.44Å; K71-E75 WeakPolarHBondContact O-CG 3.36Å; K71-E75 PolarHBondContact O-N 3.43Å
72	K	96.3	Very high	95.3	Very high	131 Å²	131	70.4 Å²	70.4	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-63.2	-40.7	177.1	-176.4	59.9	176.6	178.5	0	112.1	K68 Q69 L70 E75 N76	K68-K72 WeakPolarHBondContact O-CB 3.32Å; K68-K72 PolarHBondContact O-N 3.07Å; Q69-K72 PolarHBondContact O-N 2.8Å; L70-K72 VanDerWaalsContact C-N 3.32Å; L70-K72 PolarHBondContact O-N 2.97Å; K72-E75 PolarHBondContact O-N 3.33Å; K72-N76 WeakPolarHBondContact O-CB 3.46Å; K72-N76 PolarHBondContact O-N 3.48Å; K72-N76 PolarHBondContact O-OD1 3.35Å
73	C	96.1	Very high	95.4	Very high	12 Å²	12	77.2 Å²	77.2	8%	0.081	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-46.2	175.8	-172	0	0	0	0	111.2	F13 L21 Q69 L70 K71 E75 N76 I77	F13-C73 HydrophobicContact CD2-CB 4.04Å; F13-C73 HydrophobicContact CE1-CB 4.28Å; F13-C73 HydrophobicContact CE2-CB 3.75Å; F13-C73 HydrophobicContact CG-CB 4.42Å; F13-C73 HydrophobicContact CZ-CB 3.88Å; L21-C73 HydrophobicContact CD2-CB 3.75Å; Q69-C73 WeakPolarHBondContact O-CB 3.17Å; Q69-C73 PolarHBondContact O-N 2.86Å; L70-C73 WeakPolarHBondContact O-CB 3.46Å; L70-C73 PolarHBondContact O-N 3.47Å; L70-C73 VanDerWaalsContact O-N 3.15Å; K71-C73 VanDerWaalsContact C-N 3.34Å; K71-C73 PolarHBondContact O-N 3.16Å; C73-E75 PolarHBondContact O-N 3Å; C73-N76 WeakPolarHBondContact O-CB 3.42Å; C73-N76 PolarHBondContact O-N 2.82Å; C73-I77 WeakPolarHBondContact O-CG1 3.49Å; C73-I77 PolarHBondContact O-N 3.49Å
74	W	97.1	Very high	95.4	Very high	34 Å²	34	80.1 Å²	80.1	13%	0.129	38%	0.379	C	S	.	.	H	α-helix	trans	-58.1	-48.3	175.3	173.3	-124.1	0	0	0	112.6	L21 L22 V25 E33 W49 L70 K71 N76 I77 K78	L21-W74 HydrophobicContact CD2-CB 4.49Å; L22-W74 HydrophobicContact CD2-CE3 4.06Å; L22-W74 HydrophobicContact CD2-CH2 4.49Å; L22-W74 HydrophobicContact CD2-CZ3 3.47Å; L22-W74 VanDerWaalsContact CD2-CZ3 3.47Å; V25-W74 HydrophobicContact CG1-CD2 4.04Å; V25-W74 HydrophobicContact CG1-CE3 4.27Å; V25-W74 HydrophobicContact CG1-CH2 3.94Å; V25-W74 HydrophobicContact CG1-CZ2 3.66Å; V25-W74 HydrophobicContact CG1-CZ3 4.25Å; V25-W74 HydrophobicContact CG2-CD2 4.27Å; V25-W74 HydrophobicContact CG2-CE3 4.46Å; V25-W74 HydrophobicContact CG2-CG 4.42Å; E33-W74 WeakPolarHBondContact OE1-CZ2 3.33Å; E33-W74 PolarHBondContact OE1-NE1 2.68Å; W49-W74 HydrophobicContact CH2-CB 3.87Å; W49-W74 AromaticContact CH2-CD1 3.83Å; W49-W74 HydrophobicContact CH2-CG 4.01Å; W49-W74 AromaticContact CZ2-CD1 3.87Å; W49-W74 HydrophobicContact CZ2-CG 4.49Å; L70-W74 PolarHBondContact O-N 2.87Å; K71-W74 PolarHBondContact O-N 3.44Å; W74-N76 VanDerWaalsContact C-N 3.29Å; W74-N76 PolarHBondContact O-N 2.86Å; W74-I77 HydrophobicContact CE3-CB 4.48Å; W74-I77 HydrophobicContact CZ3-CG2 4.43Å; W74-I77 WeakPolarHBondContact O-CB 3.44Å; W74-I77 PolarHBondContact O-N 2.56Å; W74-I77 VanDerWaalsContact O-N 3.15Å; W74-K78 HydrophobicContact CD2-CD 4.38Å; W74-K78 HydrophobicContact CD2-CG 4.19Å; W74-K78 HydrophobicContact CE3-CG 4.41Å; W74-K78 HydrophobicContact CH2-CD 4.36Å; W74-K78 HydrophobicContact CH2-CG 4.06Å; W74-K78 HydrophobicContact CZ2-CD 3.63Å; W74-K78 HydrophobicContact CZ2-CG 3.81Å; W74-K78 HydrophobicContact CZ3-CG 4.32Å; W74-K78 VanDerWaalsContact NE1-CE 3.3Å; W74-K78 PolarHBondContact O-N 2.99Å
75	E	96.4	Very high	95.3	Very high	81 Å²	81	80 Å²	80	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-60.5	-39.5	176.8	-67.5	-53.9	136.2	0	0	112	K71 K72 C73 K78 A79	K71-E75 WeakPolarHBondContact O-CG 3.36Å; K71-E75 PolarHBondContact O-N 3.43Å; K72-E75 PolarHBondContact O-N 3.33Å; C73-E75 PolarHBondContact O-N 3Å; E75-K78 VanDerWaalsContact CD-CE 3.44Å; E75-K78 PolarHBondContact O-N 3.47Å; E75-K78 WeakPolarHBondContact OE1-CE 3.49Å; E75-K78 IonicContact OE1-NZ 3Å; E75-K78 PolarHBondContact OE1-NZ 3.2Å; E75-K78 VanDerWaalsContact OE2-CE 3.28Å; E75-K78 WeakPolarHBondContact OE2-CE 3.28Å; E75-K78 IonicContact OE2-NZ 3.81Å; E75-K78 PolarHBondContact OE2-NZ 2.99Å; E75-A79 WeakPolarHBondContact O-CB 3.4Å; E75-A79 PolarHBondContact O-N 3.48Å
76	N	96.4	Very high	95	Very high	87 Å²	87	80.9 Å²	80.9	47%	0.465	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-40.6	175.3	-70.9	-9.1	0	0	0	112	K72 C73 W74 A79 R80	K72-N76 WeakPolarHBondContact O-CB 3.46Å; K72-N76 PolarHBondContact O-N 3.48Å; K72-N76 PolarHBondContact O-OD1 3.35Å; C73-N76 WeakPolarHBondContact O-CB 3.42Å; C73-N76 PolarHBondContact O-N 2.82Å; W74-N76 VanDerWaalsContact C-N 3.29Å; W74-N76 PolarHBondContact O-N 2.86Å; N76-A79 PolarHBondContact O-N 3.42Å; N76-R80 WeakPolarHBondContact O-CB 3.4Å; N76-R80 PolarHBondContact O-N 3.15Å
77	I	95.8	Very high	94.6	Very high	31 Å²	31	82.8 Å²	82.8	16%	0.159	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-50.7	174.9	-69.4	164.8	0	0	0	109.7	K18 L21 L22 C73 W74 A79 R80 T81	K18-I77 HydrophobicContact CB-CD1 4.38Å; K18-I77 HydrophobicContact CG-CD1 4.28Å; L21-I77 HydrophobicContact CD2-CD1 4.33Å; L22-I77 HydrophobicContact CD2-CG2 4.26Å; C73-I77 WeakPolarHBondContact O-CG1 3.49Å; C73-I77 PolarHBondContact O-N 3.49Å; W74-I77 HydrophobicContact CE3-CB 4.48Å; W74-I77 HydrophobicContact CZ3-CG2 4.43Å; W74-I77 WeakPolarHBondContact O-CB 3.44Å; W74-I77 PolarHBondContact O-N 2.56Å; W74-I77 VanDerWaalsContact O-N 3.15Å; I77-A79 VanDerWaalsContact C-N 3.33Å; I77-A79 PolarHBondContact O-N 2.94Å; I77-R80 PolarHBondContact O-N 2.9Å; I77-T81 PolarHBondContact O-N 3.44Å; I77-T81 PolarHBondContact O-OG1 3.42Å; I77-T81 VanDerWaalsContact O-OG1 3.06Å
78	K	95.6	Very high	94.1	Very high	43 Å²	43	85.2 Å²	85.2	19%	0.187	41%	0.406	C	S	.	.	H	α-helix	trans	-56	-46.3	176.7	-74	-168.3	-69.6	-169.1	0	112	E33 W74 E75 T81 K82	E33-K78 IonicContact OE1-NZ 3.71Å; E33-K78 PolarHBondContact OE1-NZ 3.36Å; E33-K78 IonicContact OE2-NZ 2.8Å; W74-K78 HydrophobicContact CD2-CD 4.38Å; W74-K78 HydrophobicContact CD2-CG 4.19Å; W74-K78 HydrophobicContact CE3-CG 4.41Å; W74-K78 HydrophobicContact CH2-CD 4.36Å; W74-K78 HydrophobicContact CH2-CG 4.06Å; W74-K78 HydrophobicContact CZ2-CD 3.63Å; W74-K78 HydrophobicContact CZ2-CG 3.81Å; W74-K78 HydrophobicContact CZ3-CG 4.32Å; W74-K78 VanDerWaalsContact NE1-CE 3.3Å; W74-K78 PolarHBondContact O-N 2.99Å; E75-K78 VanDerWaalsContact CD-CE 3.44Å; E75-K78 PolarHBondContact O-N 3.47Å; E75-K78 WeakPolarHBondContact OE1-CE 3.49Å; E75-K78 IonicContact OE1-NZ 3Å; E75-K78 PolarHBondContact OE1-NZ 3.2Å; E75-K78 VanDerWaalsContact OE2-CE 3.28Å; E75-K78 WeakPolarHBondContact OE2-CE 3.28Å; E75-K78 IonicContact OE2-NZ 3.81Å; E75-K78 PolarHBondContact OE2-NZ 2.99Å; K78-T81 PolarHBondContact O-N 3.02Å; K78-K82 WeakPolarHBondContact O-CG 3.33Å; K78-K82 PolarHBondContact O-N 3.32Å
79	A	96.1	Very high	93.5	Very high	56 Å²	56	86.2 Å²	86.2	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-44.2	178.7	0	0	0	0	0	112	E75 N76 I77 K82 K83	E75-A79 WeakPolarHBondContact O-CB 3.4Å; E75-A79 PolarHBondContact O-N 3.48Å; N76-A79 PolarHBondContact O-N 3.42Å; I77-A79 VanDerWaalsContact C-N 3.33Å; I77-A79 PolarHBondContact O-N 2.94Å; A79-K82 PolarHBondContact O-N 3.06Å; A79-K83 PolarHBondContact O-N 2.93Å
80	R	94.1	Very high	92.6	Very high	178 Å²	178	90.8 Å²	90.8	67%	0.672	42%	0.42	S	S	*	.	H	α-helix	trans	-63.4	-44.6	177.4	-172.4	177.1	-176.4	-101.2	2	111.6	N76 I77 K83 I84	N76-R80 WeakPolarHBondContact O-CB 3.4Å; N76-R80 PolarHBondContact O-N 3.15Å; I77-R80 PolarHBondContact O-N 2.9Å; R80-K83 WeakPolarHBondContact O-CB 3.36Å; R80-K83 PolarHBondContact O-N 3.35Å; R80-I84 HydrophobicContact CG-CD1 4.05Å; R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.4Å
81	T	94.3	Very high	91.6	Very high	70 Å²	70	93 Å²	93	43%	0.429	43%	0.43	S	S	.	.	H	α-helix	trans	-60	-47.4	177.4	-58.8	0	0	0	0	111.2	I77 K78 K83 I84 M85	I77-T81 PolarHBondContact O-N 3.44Å; I77-T81 PolarHBondContact O-OG1 3.42Å; I77-T81 VanDerWaalsContact O-OG1 3.06Å; K78-T81 PolarHBondContact O-N 3.02Å; T81-K83 VanDerWaalsContact C-N 3.3Å; T81-K83 PolarHBondContact O-N 3.4Å; T81-I84 PolarHBondContact O-N 3.01Å; T81-M85 HydrophobicContact CG2-CG 4.47Å; T81-M85 HydrophobicContact CG2-SD 4.15Å; T81-M85 WeakPolarHBondContact O-CG 3.48Å; T81-M85 PolarHBondContact O-N 2.97Å
82	K	94.5	Very high	90.4	Very high	150 Å²	150	94.2 Å²	94.2	65%	0.652	44%	0.436	S	S	*	.	H	α-helix	trans	-57.3	-42.3	175.4	-71.8	175	-177.6	-178.3	0	112.1	K78 A79 M85 A86	K78-K82 WeakPolarHBondContact O-CG 3.33Å; K78-K82 PolarHBondContact O-N 3.32Å; A79-K82 PolarHBondContact O-N 3.06Å; K82-M85 PolarHBondContact O-N 3.33Å; K82-A86 WeakPolarHBondContact O-CB 3.36Å; K82-A86 PolarHBondContact O-N 2.9Å
83	K	94.3	Very high	89	Confident	165 Å²	165	91.9 Å²	91.9	72%	0.717	43%	0.432	S	S	*	.	H	α-helix	trans	-63.3	-44.1	177.4	-173.5	177.2	-179.6	177.7	0	112.2	A79 R80 T81 A86 H87	A79-K83 PolarHBondContact O-N 2.93Å; R80-K83 WeakPolarHBondContact O-CB 3.36Å; R80-K83 PolarHBondContact O-N 3.35Å; T81-K83 VanDerWaalsContact C-N 3.3Å; T81-K83 PolarHBondContact O-N 3.4Å; K83-A86 PolarHBondContact O-N 3.04Å; K83-H87 WeakPolarHBondContact O-CB 3.37Å; K83-H87 PolarHBondContact O-N 2.99Å
84	I	92.1	Very high	87.3	Confident	82 Å²	82	97.6 Å²	97.6	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-62.5	-49.2	177.8	-67.9	167.7	0	0	0	110.2	R80 T81 A86 H87 E88	R80-I84 HydrophobicContact CG-CD1 4.05Å; R80-I84 WeakPolarHBondContact O-CG1 3.38Å; R80-I84 PolarHBondContact O-N 3.4Å; T81-I84 PolarHBondContact O-N 3.01Å; I84-A86 VanDerWaalsContact C-N 3.3Å; I84-A86 PolarHBondContact O-N 3.19Å; I84-H87 PolarHBondContact O-N 2.92Å; I84-H87 VanDerWaalsContact O-N 3.17Å; I84-E88 WeakPolarHBondContact O-CB 3.45Å; I84-E88 PolarHBondContact O-N 3.5Å
85	M	91.1	Very high	85.5	Confident	105 Å²	105	104.4 Å²	104.4	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-37.9	179.1	-65.8	179.6	84.9	0	0	112.5	T81 K82 R89	T81-M85 HydrophobicContact CG2-CG 4.47Å; T81-M85 HydrophobicContact CG2-SD 4.15Å; T81-M85 WeakPolarHBondContact O-CG 3.48Å; T81-M85 PolarHBondContact O-N 2.97Å; K82-M85 PolarHBondContact O-N 3.33Å; M85-R89 PolarHBondContact O-N 3.21Å
86	A	88.7	Confident	83.5	Confident	38 Å²	38	104.4 Å²	104.4	31%	0.314	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-41.5	175.8	0	0	0	0	0	112.4	K82 K83 I84 R90	K82-A86 WeakPolarHBondContact O-CB 3.36Å; K82-A86 PolarHBondContact O-N 2.9Å; K83-A86 PolarHBondContact O-N 3.04Å; I84-A86 VanDerWaalsContact C-N 3.3Å; I84-A86 PolarHBondContact O-N 3.19Å; A86-R90 WeakPolarHBondContact O-CG 3.09Å; A86-R90 PolarHBondContact O-N 2.96Å
87	H	86.9	Confident	81.4	Confident	114 Å²	114	105.2 Å²	105.2	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-46.8	175.5	-177.6	-90.1	0	0	0	111.5	K83 I84 R89 R90 E91	K83-H87 WeakPolarHBondContact O-CB 3.37Å; K83-H87 PolarHBondContact O-N 2.99Å; I84-H87 PolarHBondContact O-N 2.92Å; I84-H87 VanDerWaalsContact O-N 3.17Å; H87-R89 VanDerWaalsContact C-N 3.3Å; H87-R89 PolarHBondContact O-N 3.34Å; H87-R90 PolarHBondContact O-N 3.46Å; H87-R90 VanDerWaalsContact O-N 3.08Å; H87-E91 WeakPolarHBondContact CE1-CG 3.38Å; H87-E91 WeakPolarHBondContact O-CG 3.48Å; H87-E91 PolarHBondContact O-N 3.44Å
88	E	86.4	Confident	79.5	Confident	89 Å²	89	108.6 Å²	108.6	42%	0.416	53%	0.525	S	S	.	.	H	α-helix	trans	-58.6	-40.9	178.2	-169.5	-172.3	167.2	0	0	112	I84 R90 E91 K92	I84-E88 WeakPolarHBondContact O-CB 3.45Å; I84-E88 PolarHBondContact O-N 3.5Å; E88-R90 VanDerWaalsContact C-N 3.35Å; E88-R90 PolarHBondContact O-N 3.2Å; E88-E91 PolarHBondContact O-N 2.88Å; E88-K92 HydrophobicContact CG-CD 4.38Å; E88-K92 WeakPolarHBondContact O-CG 3.49Å; E88-K92 PolarHBondContact O-N 3.17Å; E88-K92 WeakPolarHBondContact OE1-CE 3.47Å; E88-K92 IonicContact OE1-NZ 3.48Å; E88-K92 PolarHBondContact OE1-NZ 3.07Å
89	R	82.2	Confident	77.3	Confident	159 Å²	159	110.6 Å²	110.6	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-59.3	-43.8	174.4	-170.1	-177.4	-63.2	99.4	-0.1	112.1	M85 H87 V93	M85-R89 PolarHBondContact O-N 3.21Å; H87-R89 VanDerWaalsContact C-N 3.3Å; H87-R89 PolarHBondContact O-N 3.34Å; R89-V93 WeakPolarHBondContact O-CG2 3.49Å; R89-V93 PolarHBondContact O-N 3.34Å
90	R	78.3	Confident	75.1	Confident	182 Å²	182	114.6 Å²	114.6	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-66.5	-39.1	178.1	-68.9	176.1	-179	-171.5	-0.7	112	A86 H87 E88 V93 K94	A86-R90 WeakPolarHBondContact O-CG 3.09Å; A86-R90 PolarHBondContact O-N 2.96Å; H87-R90 PolarHBondContact O-N 3.46Å; H87-R90 VanDerWaalsContact O-N 3.08Å; E88-R90 VanDerWaalsContact C-N 3.35Å; E88-R90 PolarHBondContact O-N 3.2Å; R90-V93 PolarHBondContact O-N 3.44Å; R90-K94 WeakPolarHBondContact O-CG 3.48Å; R90-K94 PolarHBondContact O-N 3.48Å
91	E	75	Confident	73	Confident	45 Å²	45	114 Å²	114	21%	0.21	56%	0.564	C	S	.	*	H	α-helix	trans	-70.9	-34.7	179.7	-74.4	-63.3	111.7	0	0	113.2	H87 E88 K94 R95	H87-E91 WeakPolarHBondContact CE1-CG 3.38Å; H87-E91 WeakPolarHBondContact O-CG 3.48Å; H87-E91 PolarHBondContact O-N 3.44Å; E88-E91 PolarHBondContact O-N 2.88Å; E91-K94 PolarHBondContact O-N 2.67Å; E91-K94 WeakPolarHBondContact OE1-CD 3.38Å; E91-K94 IonicContact OE1-NZ 2.67Å; E91-K94 PolarHBondContact OE1-NZ 3.3Å; E91-R95 PolarHBondContact O-N 2.93Å; E91-R95 VanDerWaalsContact O-N 3.08Å; E91-R95 IonicContact OE2-NH1 2.82Å; E91-R95 PolarHBondContact OE2-NH1 2.96Å
92	K	71.6	Confident	70.8	Confident	127 Å²	127	116.7 Å²	116.7	55%	0.552	59%	0.585	S	S	*	*	H	α-helix	trans	-62.8	-43.1	170.8	-74.5	175.2	-178.9	172.2	0	111.2	E88 R95 S96	E88-K92 HydrophobicContact CG-CD 4.38Å; E88-K92 WeakPolarHBondContact O-CG 3.49Å; E88-K92 PolarHBondContact O-N 3.17Å; E88-K92 WeakPolarHBondContact OE1-CE 3.47Å; E88-K92 IonicContact OE1-NZ 3.48Å; E88-K92 PolarHBondContact OE1-NZ 3.07Å; K92-R95 PolarHBondContact O-N 3.03Å; K92-S96 WeakPolarHBondContact O-CB 3.42Å; K92-S96 PolarHBondContact O-N 3.02Å; K92-S96 PolarHBondContact O-OG 3.23Å; K92-S96 VanDerWaalsContact O-OG 3.13Å
93	V	65.6	Low	68.6	Low	81 Å²	81	113.9 Å²	113.9	49%	0.491	58%	0.581	S	S	.	*	H	α-helix	trans	-61.9	-44	175.5	173.4	0	0	0	0	111.6	R89 R90 R95 S96 V97	R89-V93 WeakPolarHBondContact O-CG2 3.49Å; R89-V93 PolarHBondContact O-N 3.34Å; R90-V93 PolarHBondContact O-N 3.44Å; V93-R95 PolarHBondContact O-N 3.42Å; V93-S96 WeakPolarHBondContact CA-OG 3.43Å; V93-S96 PolarHBondContact O-N 3.37Å; V93-S96 PolarHBondContact O-OG 3.06Å; V93-S96 VanDerWaalsContact O-OG 3.05Å; V93-V97 HydrophobicContact CG1-CG2 4.1Å; V93-V97 WeakPolarHBondContact O-CB 3.12Å; V93-V97 WeakPolarHBondContact O-CG2 3.41Å; V93-V97 PolarHBondContact O-N 3.08Å
94	K	61.1	Low	66.5	Low	133 Å²	133	114.1 Å²	114.1	58%	0.578	58%	0.584	S	S	*	*	H	α-helix	trans	-64.6	-37.6	177.7	-68.4	177.2	-165.9	164.2	0	113.2	R90 E91	R90-K94 WeakPolarHBondContact O-CG 3.48Å; R90-K94 PolarHBondContact O-N 3.48Å; E91-K94 PolarHBondContact O-N 2.67Å; E91-K94 WeakPolarHBondContact OE1-CD 3.38Å; E91-K94 IonicContact OE1-NZ 2.67Å; E91-K94 PolarHBondContact OE1-NZ 3.3Å
95	R	58.8	Low	64.6	Low	176 Å²	176	117 Å²	117	66%	0.664	61%	0.606	S	S	*	*	H	α-helix	trans	-71.5	-33.9	175.7	-75.9	-179.5	179	75.2	-1.6	112.2	E91 K92 V93	E91-R95 PolarHBondContact O-N 2.93Å; E91-R95 VanDerWaalsContact O-N 3.08Å; E91-R95 IonicContact OE2-NH1 2.82Å; E91-R95 PolarHBondContact OE2-NH1 2.96Å; K92-R95 PolarHBondContact O-N 3.03Å; V93-R95 PolarHBondContact O-N 3.42Å
96	S	55.8	Low	62.6	Low	81 Å²	81	119.7 Å²	119.7	57%	0.566	62%	0.621	S	S	*	*	H	α-helix	trans	-79.9	-17.9	176.9	66.5	0	0	0	0	114.1	K92 V93 S98 P99	K92-S96 WeakPolarHBondContact O-CB 3.42Å; K92-S96 PolarHBondContact O-N 3.02Å; K92-S96 PolarHBondContact O-OG 3.23Å; K92-S96 VanDerWaalsContact O-OG 3.13Å; V93-S96 WeakPolarHBondContact CA-OG 3.43Å; V93-S96 PolarHBondContact O-N 3.37Å; V93-S96 PolarHBondContact O-OG 3.06Å; V93-S96 VanDerWaalsContact O-OG 3.05Å; S96-S98 VanDerWaalsContact C-N 3.25Å; S96-P99 WeakPolarHBondContact O-CD 3.44Å
97	V	51.4	Low	60.3	Low	104 Å²	104	120.9 Å²	120.9	63%	0.63	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	13.6	175	-178.4	0	0	0	0	112	V93 P99	V93-V97 HydrophobicContact CG1-CG2 4.1Å; V93-V97 WeakPolarHBondContact O-CB 3.12Å; V93-V97 WeakPolarHBondContact O-CG2 3.41Å; V93-V97 PolarHBondContact O-N 3.08Å; V97-P99 WeakPolarHBondContact O-CD 3.33Å
98	S	55.1	Low	58.6	Low	103 Å²	103	124.4 Å²	124.4	72%	0.72	65%	0.651	S	S	*	*			trans	-94.3	57.5	161.3	-57.3	0	0	0	0	114.1	S96	S96-S98 VanDerWaalsContact C-N 3.25Å
99	P	50.5	Low	56.9	Low	84 Å²	84	129.2 Å²	129.2	55%	0.545	67%	0.673	S	S	.	*	S	Bend	trans	-88.3	116.2	153.3	-5.4	23.5	0	0	0	110.2	S96 V97 L101	S96-P99 WeakPolarHBondContact O-CD 3.44Å; V97-P99 WeakPolarHBondContact O-CD 3.33Å; P99-L101 WeakPolarHBondContact O-CD2 3.19Å; P99-L101 PolarHBondContact O-N 3.29Å
100	L	49.2	Very low	55.6	Low	141 Å²	141	129.8 Å²	129.8	74%	0.738	68%	0.68	S	S	*	*	S	Bend	trans	71.3	23.5	142.5	-77.3	176.2	0	0	0	122.6	T103	L100-T103 PolarHBondContact O-OG1 3.34Å
101	L	50.6	Low	54.5	Low	165 Å²	165	127.8 Å²	127.8	86%	0.864	68%	0.682	S	S	*	*			trans	-100.8	9.7	171.3	-77.3	-69.8	0	0	0	114.4	P99 T103	P99-L101 WeakPolarHBondContact O-CD2 3.19Å; P99-L101 PolarHBondContact O-N 3.29Å; L101-T103 VanDerWaalsContact C-N 3.34Å
102	S	47.5	Very low	53.6	Low	126 Å²	126	130.1 Å²	130.1	88%	0.881	71%	0.709	S	S	*	*			trans	-99.7	45.2	166.2	-158.1	0	0	0	0	111.5
103	T	48.6	Very low	52.5	Low	91 Å²	91	128.6 Å²	128.6	56%	0.558	71%	0.714	S	S	*	*			trans	-124.4	22.3	172.7	-18.3	0	0	0	0	111.9	L100 L101 V105	L100-T103 PolarHBondContact O-OG1 3.34Å; L101-T103 VanDerWaalsContact C-N 3.34Å; T103-V105 VanDerWaalsContact C-N 3.3Å
104	H	50.8	Low	51.8	Low	171 Å²	171	131.9 Å²	131.9	79%	0.792	73%	0.726	S	S	*	*			trans	-97.1	32.7	172.6	-145.9	-71.3	0	0	0	112.8
105	V	52.1	Low	51.3	Low	143 Å²	143	132.1 Å²	132.1	87%	0.867	73%	0.733	S	S	*	*	S	Bend	trans	-135.8	55.4	161.2	-166.3	0	0	0	0	109.3	T103	T103-V105 VanDerWaalsContact C-N 3.3Å
106	L	49.2	Very low	50.8	Low	161 Å²	161	128.6 Å²	128.6	84%	0.843	73%	0.733	S	S	*	*	S	Bend	trans	-160.5	118.3	152.8	-163.8	58.8	0	0	0	110.4
107	G	39.6	Very low	50.6	Low	63 Å²	63	134 Å²	134	65%	0.649	75%	0.749	S	S	*	*			trans	94.8	60.7	158.7	0	0	0	0	0	116.4
108	K	51.6	Low	50.2	Low	188 Å²	188	137.2 Å²	137.2	82%	0.817	76%	0.757	S	S	*	*			trans	-66.7	147.6	149.7	-21.9	-168.9	-173.4	-161.8	0	107.1
109	E	49.6	Very low	49.8	Very low	190 Å²	190	140.6 Å²	140.6	89%	0.888	77%	0.766	S	S	*	*	S	Bend	trans	109.7	-5.6	164	-55.7	-162.4	143.4	0	0	120.9
110	K	55.1	Low	49.5	Very low	171 Å²	171	146 Å²	146	74%	0.743	78%	0.777	S	S	*	*	S	Bend	trans	-116.6	-1.8	-179.5	-146.2	158.9	-175	-91.2	0	117.6	S113	K110-S113 PolarHBondContact O-OG 3.43Å
111	I	56.3	Low	49.3	Very low	139 Å²	139	147.8 Å²	147.8	71%	0.713	78%	0.779	S	S	*	*	S	Bend	trans	-96.1	-27	-177.9	-56.5	175.5	0	0	0	111.8	S113 M114	I111-S113 VanDerWaalsContact C-N 3.29Å; I111-S113 PolarHBondContact O-N 3.08Å; I111-M114 PolarHBondContact O-N 3.45Å
112	A	54.8	Low	48.9	Very low	94 Å²	94	146.4 Å²	146.4	78%	0.777	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-69.9	-21.1	178.3	0	0	0	0	0	113.9	M114	A112-M114 VanDerWaalsContact C-N 3.33Å
113	S	49.7	Very low	48.8	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-85.7	-2.3	177.7	60	0	0	0	0	114.2	K110 I111	K110-S113 PolarHBondContact O-OG 3.43Å; I111-S113 VanDerWaalsContact C-N 3.29Å; I111-S113 PolarHBondContact O-N 3.08Å
114	M	49.8	Very low	48.7	Very low	149 Å²	149	149.4 Å²	149.4	73%	0.734	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-106.8	0.1	-175.7	-73.3	-127.5	63.6	0	0	114.1	I111 A112	I111-M114 PolarHBondContact O-N 3.45Å; A112-M114 VanDerWaalsContact C-N 3.33Å
115	L	50.5	Low	48.2	Very low	139 Å²	139	146.8 Å²	146.8	73%	0.728	78%	0.776	S	S	*	*	S	Bend	trans	-98.7	117.9	175.9	-73.9	174.6	0	0	0	110.2
116	P	49.9	Very low	47.9	Very low	102 Å²	102	145.4 Å²	145.4	66%	0.662	77%	0.77	S	S	*	*			trans	-61.4	138	170.2	-16.7	29	0	0	0	110.5	Q118	P116-Q118 PolarHBondContact O-N 2.85Å
117	E	50.9	Low	48	Very low	195 Å²	195	147.4 Å²	147.4	91%	0.911	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	18.9	-178.5	-146	159.6	-161.3	0	0	114.4
118	Q	42.5	Very low	48.2	Very low	171 Å²	171	153.2 Å²	153.2	80%	0.799	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	8.7	-164.9	-73.1	-77.8	-38.9	0	0	114.5	P116	P116-Q118 PolarHBondContact O-N 2.85Å
119	L	46	Very low	48	Very low	174 Å²	174	152.5 Å²	152.5	91%	0.911	79%	0.785	S	S	*	*			trans	-117.6	43.2	177	-150.2	78.3	0	0	0	112.5
120	Y	45.8	Very low	47.8	Very low	197 Å²	197	149.4 Å²	149.4	77%	0.773	78%	0.782	S	S	*	*			trans	-123.5	84.8	161.5	177	-98.4	0	0	0	108.8
121	F	45	Very low	47.3	Very low	179 Å²	179	148.5 Å²	148.5	79%	0.785	78%	0.78	S	S	*	*			trans	-179.4	117.5	165.7	-137.4	-116.2	0	0	0	104.7
122	L	42.1	Very low	46.6	Very low	136 Å²	136	153.2 Å²	153.2	71%	0.712	79%	0.791	S	S	*	*			cis	-142.7	143.3	29.9	-78.5	95.1	0	0	0	111.4
123	Q	45.4	Very low	46.1	Very low	168 Å²	168	156.2 Å²	156.2	79%	0.785	79%	0.788	S	S	*	*			trans	-51	133.2	144.4	-103.1	157.3	-31.7	0	0	111.4
124	S	45.8	Very low	46.2	Very low	111 Å²	111	157 Å²	157	78%	0.776	79%	0.79	S	S	*	*			trans	-143.9	117.3	143.2	-68.3	0	0	0	0	108
125	P	40.6	Very low	45.3	Very low	117 Å²	117	157.7 Å²	157.7	76%	0.76	80%	0.797	S	S	*	*			trans	-92	-176.3	174.7	40.9	-35.3	0	0	0	110.8
126	P	46.7	Very low	44.7	Very low	114 Å²	114	155.1 Å²	155.1	74%	0.74	80%	0.796	S	S	*	*	P	Polyproline II helix		-80.7	151.6	-118	37.5	-20.8	0	0	0	114.7
127	E	49.7	Very low	44.1	Very low	202 Å²	202	155.8 Å²	155.8	94%	0.944	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-97.4	134	160.6	-73.3	-151.4	174.2	0	0	111.3
128	E	44.4	Very low	43.9	Very low	185 Å²	185	151.3 Å²	151.3	86%	0.864	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68	140.5	-167.4	-64.1	168.9	135.3	0	0	113.2
129	E	47.4	Very low	43.7	Very low	174 Å²	174	152 Å²	152	81%	0.813	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58.3	147.4	160.6	-74	-85.9	153.4	0	0	111.5
130	P	45.8	Very low	43.1	Very low	125 Å²	125	153.4 Å²	153.4	81%	0.812	81%	0.805	S	S	*	*			trans	-116.8	109.8	136.8	0.6	19.7	0	0	0	111.1
131	E	44.1	Very low	42.6	Very low	151 Å²	151	149.4 Å²	149.4	71%	0.706	81%	0.806	S	S	*	*			trans	-53.6	123.8	162.9	-164.8	164.3	-146.1	0	0	111.1
132	Y	41	Very low	42.1	Very low	239 Å²	239	150.5 Å²	150.5	94%	0.937	81%	0.811	S	S	*	*			trans	-148.6	137	150.6	-128.7	-92.2	0	0	0	112.5
133	H	45.9	Very low	41.8	Very low	157 Å²	157	148.6 Å²	148.6	73%	0.727	82%	0.815	S	S	*	*			trans	-87.1	177.4	-157.6	-103.7	-83.2	0	0	0	114.1
134	P	50.4	Low	41.5	Very low	111 Å²	111	146.9 Å²	146.9	72%	0.721	82%	0.815	S	S	*	*			trans	-97.2	164.7	-145.6	39.6	-37.6	0	0	0	114.2
135	D	31.4	Very low	41.1	Very low	164 Å²	164	146.1 Å²	146.1	88%	0.877	81%	0.81	S	S	*	*			trans	-150.3	146.9	139	-144.6	-14.9	0	0	0	112.9
136	A	38.9	Very low	41	Very low	86 Å²	86	148.7 Å²	148.7	71%	0.711	82%	0.817	S	S	*	*			trans	-78.9	145.7	-169.1	0	0	0	0	0	113.1
137	S	37	Very low	41	Very low	115 Å²	115	154.4 Å²	154.4	80%	0.804	82%	0.824	S	S	*	*			trans	-160.1	108.8	137.1	45.5	0	0	0	0	110.3
138	A	45.1	Very low	40.6	Very low	102 Å²	102	153.7 Å²	153.7	84%	0.843	82%	0.821	S	S	*	*			trans	-70.1	121.8	170	0	0	0	0	0	109.9
139	Q	39.2	Very low	40.6	Very low	185 Å²	185	152.3 Å²	152.3	86%	0.864	82%	0.819	S	S	*	*			trans	-144.2	82.8	155	-87.4	-177.3	-75.4	0	0	108.7	S141	Q139-S141 PolarHBondContact O-N 2.94Å
140	E	34.1	Very low	39.9	Very low	204 Å²	204	149.4 Å²	149.4	95%	0.953	82%	0.816	S	S	*	*			trans	-68.5	108.3	160.5	-74.7	-158.9	145	0	0	108.2
141	S	33.8	Very low	39.4	Very low	113 Å²	113	151.2 Å²	151.2	79%	0.79	82%	0.819	S	S	*	*			trans	-84.2	122.5	170.9	51.7	0	0	0	0	109.4	Q139 A143	Q139-S141 PolarHBondContact O-N 2.94Å; S141-A143 PolarHBondContact O-N 3.05Å
142	F	35.8	Very low	39.1	Very low	202 Å²	202	151.4 Å²	151.4	89%	0.886	83%	0.825	S	S	*	*			trans	-72.5	117.1	172.1	-147.8	-96.3	0	0	0	108.7	V144	F142-V144 HydrophobicContact CE1-CG2 4.47Å
143	A	34.9	Very low	39.2	Very low	96 Å²	96	149 Å²	149	79%	0.793	82%	0.822	S	S	*	*			trans	-148.3	91	165.5	0	0	0	0	0	111.1	S141	S141-A143 PolarHBondContact O-N 3.05Å
144	V	39	Very low	39.2	Very low	132 Å²	132	149.6 Å²	149.6	80%	0.8	82%	0.823	S	S	*	*			trans	-78.7	114.3	158	176.1	0	0	0	0	107.5	F142	F142-V144 HydrophobicContact CE1-CG2 4.47Å
145	S	38.7	Very low	38.5	Very low	94 Å²	94	152.8 Å²	152.8	66%	0.657	83%	0.828	S	S	*	*			trans	-166.9	104.9	153.9	-173.6	0	0	0	0	109.7
146	N	38.1	Very low	38.6	Very low	172 Å²	172	153.2 Å²	153.2	92%	0.92	82%	0.822	S	S	*	*			trans	-135.8	98.7	149.6	-86.7	-29.9	0	0	0	106.8	E148	N146-E148 PolarHBondContact O-N 3.13Å
147	R	46.3	Very low	38.5	Very low	233 Å²	233	154.2 Å²	154.2	88%	0.879	81%	0.814	S	S	*	*			trans	-88.8	93.2	177.6	-163.8	-178.5	-170.7	-159.4	3.1	106.3	L149	R147-L149 PolarHBondContact O-N 3.29Å
148	E	42	Very low	38.7	Very low	187 Å²	187	156.5 Å²	156.5	87%	0.874	81%	0.812	S	S	*	*			trans	-81.6	115	169.7	-113.2	-177.9	130.8	0	0	109.4	N146	N146-E148 PolarHBondContact O-N 3.13Å
149	L	42.8	Very low	38.3	Very low	157 Å²	157	159.5 Å²	159.5	82%	0.822	81%	0.806	S	S	*	*			trans	-66.8	130.7	163.7	-79.1	131.9	0	0	0	109	R147	R147-L149 PolarHBondContact O-N 3.29Å
150	C	32.7	Very low	38.4	Very low	112 Å²	112	155.4 Å²	155.4	76%	0.757	80%	0.796	S	S	*	*			trans	-134.2	126.1	149	-69.4	0	0	0	0	107.9
151	D	35.7	Very low	38.6	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	78%	0.784	S	S	*	*			trans	-51.3	129.5	173.9	-83.5	-71.5	0	0	0	112
152	D	37.4	Very low	38.7	Very low	156 Å²	156	152.2 Å²	152.2	83%	0.834	79%	0.789	S	S	*	*			trans	-101.3	109.4	166.8	-94.1	-65.8	0	0	0	107.6	K154	D152-K154 PolarHBondContact O-N 2.91Å
153	E	43.5	Very low	39	Very low	187 Å²	187	151 Å²	151	87%	0.874	79%	0.787	S	S	*	*			trans	-60.8	125.7	168.9	55.1	-159	100.9	0	0	110.9	E155	E153-E155 PolarHBondContact O-N 3.48Å
154	K	47	Very low	39.2	Very low	171 Å²	171	150 Å²	150	74%	0.743	79%	0.785	S	S	*	*			trans	-78.1	111.4	-177.9	-77.2	179.4	172.7	-168	0	110.8	D152 F156	D152-K154 PolarHBondContact O-N 2.91Å; K154-F156 HydrophobicContact CB-CD2 4.45Å; K154-F156 HydrophobicContact CD-CD2 4.36Å; K154-F156 HydrophobicContact CD-CE2 3.98Å; K154-F156 HydrophobicContact CG-CE2 4.44Å
155	E	35.2	Very low	39.1	Very low	177 Å²	177	150 Å²	150	83%	0.827	79%	0.786	S	S	*	*			trans	-113.1	99.7	151.8	-80.5	-84.5	138.4	0	0	107.7	E153 I157	E153-E155 PolarHBondContact O-N 3.48Å; E155-I157 PolarHBondContact O-N 3.41Å; E155-I157 VanDerWaalsContact O-N 3.14Å
156	F	33.7	Very low	39.5	Very low	173 Å²	173	151.4 Å²	151.4	76%	0.759	80%	0.796	S	S	*	*			trans	-71	98.8	172.8	-97.7	-96.9	0	0	0	108.6	K154 H158	K154-F156 HydrophobicContact CB-CD2 4.45Å; K154-F156 HydrophobicContact CD-CD2 4.36Å; K154-F156 HydrophobicContact CD-CE2 3.98Å; K154-F156 HydrophobicContact CG-CE2 4.44Å; F156-H158 PolarHBondContact O-N 3.18Å
157	I	36.3	Very low	39.6	Very low	107 Å²	107	151.7 Å²	151.7	55%	0.549	79%	0.791	S	S	.	*			trans	-73.2	98.3	164.6	-56	-168.9	0	0	0	107.9	E155 F159	E155-I157 PolarHBondContact O-N 3.41Å; E155-I157 VanDerWaalsContact O-N 3.14Å; I157-F159 HydrophobicContact CB-CE2 4.25Å; I157-F159 HydrophobicContact CG2-CD2 3.85Å; I157-F159 HydrophobicContact CG2-CE2 3.56Å; I157-F159 HydrophobicContact CG2-CZ 4.12Å; I157-F159 PolarHBondContact O-N 3.48Å
158	H	40.4	Very low	39.7	Very low	163 Å²	163	146 Å²	146	76%	0.755	78%	0.784	S	S	*	*			trans	-66.8	104.5	165.7	-179.8	66.4	0	0	0	108.5	F156	F156-H158 PolarHBondContact O-N 3.18Å
159	F	37.9	Very low	39.7	Very low	165 Å²	165	144.9 Å²	144.9	72%	0.724	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-80.9	124.3	167	-83.2	-88.5	0	0	0	108.5	I157 V161	I157-F159 HydrophobicContact CB-CE2 4.25Å; I157-F159 HydrophobicContact CG2-CD2 3.85Å; I157-F159 HydrophobicContact CG2-CE2 3.56Å; I157-F159 HydrophobicContact CG2-CZ 4.12Å; I157-F159 PolarHBondContact O-N 3.48Å; F159-V161 PolarHBondContact O-N 3.32Å
160	P	40.6	Very low	39.9	Very low	99 Å²	99	143.4 Å²	143.4	64%	0.643	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.1	177.2	22.9	-27.1	0	0	0	109.2	C162	P160-C162 PolarHBondContact O-N 3.35Å
161	V	39.4	Very low	40.5	Very low	115 Å²	115	142.8 Å²	142.8	70%	0.697	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-61.3	117.5	161.9	159	0	0	0	0	106.7	F159 E163	F159-V161 PolarHBondContact O-N 3.32Å; V161-E163 HydrophobicContact CG1-CB 4.34Å; V161-E163 HydrophobicContact CG1-CG 3.88Å; V161-E163 PolarHBondContact O-N 3.47Å; V161-E163 VanDerWaalsContact O-N 3.1Å
162	C	35	Very low	40.6	Very low	135 Å²	135	140.6 Å²	140.6	91%	0.912	77%	0.772	S	S	*	*			trans	-72.5	98	165	-70	0	0	0	0	108.1	P160	P160-C162 PolarHBondContact O-N 3.35Å
163	E	41.5	Very low	40.9	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	77%	0.77	S	S	*	*			trans	-99.8	135.4	164.3	-100.9	178.6	152.9	0	0	110.3	V161	V161-E163 HydrophobicContact CG1-CB 4.34Å; V161-E163 HydrophobicContact CG1-CG 3.88Å; V161-E163 PolarHBondContact O-N 3.47Å; V161-E163 VanDerWaalsContact O-N 3.1Å
164	G	39.5	Very low	41	Very low	73 Å²	73	134.1 Å²	134.1	75%	0.753	77%	0.765	S	S	*	*			trans	89.5	132.6	169.2	0	0	0	0	0	113.6
165	T	36.2	Very low	41.1	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	77%	0.765	S	S	*	*			cis	-154.1	131.5	35.1	47.1	0	0	0	0	111.4	Q167	T165-Q167 PolarHBondContact O-N 2.83Å
166	S	47.4	Very low	42	Very low	124 Å²	124	134.8 Å²	134.8	87%	0.867	77%	0.769	S	S	*	*			trans	-56.5	130.3	153.6	-61.2	0	0	0	0	109.9
167	Q	40.5	Very low	42.9	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	77%	0.767	S	S	*	*			trans	-136.6	136.2	149.1	-93	-157.5	-82.3	0	0	109.4	T165	T165-Q167 PolarHBondContact O-N 2.83Å
168	P	48	Very low	43.7	Very low	112 Å²	112	134.1 Å²	134.1	73%	0.727	78%	0.777	S	S	*	*			trans	-85.1	145.4	173.7	34.2	-30.1	0	0	0	111.7
169	E	43.8	Very low	44.3	Very low	164 Å²	164	130.1 Å²	130.1	77%	0.766	77%	0.773	S	S	*	*			trans	29.4	143.8	151	-58.8	-66.8	128.9	0	0	120.5
170	P	45.8	Very low	45	Very low	127 Å²	127	130.1 Å²	130.1	83%	0.825	78%	0.78	S	S	*	*				-149	127.4	101	34.6	-17	0	0	0	115
171	S	44.6	Very low	45.6	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	81%	0.805	S	S	*	*			trans	178.7	135.4	140.2	-140	0	0	0	0	108.6
172	C	39.3	Very low	45.9	Very low	117 Å²	117	139.3 Å²	139.3	79%	0.791	81%	0.81	S	S	*	*			cis	-153	140.9	41.8	-65.9	0	0	0	0	110.1
173	S	43.8	Very low	46.5	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	81%	0.805	S	S	*	*			trans	-76.9	140	163.3	50.3	0	0	0	0	112.2
174	A	44.4	Very low	46.7	Very low	94 Å²	94	137.3 Å²	137.3	78%	0.777	80%	0.803	S	S	*	*			trans	71	136	155	0	0	0	0	0	116.6
175	V	50.4	Low	47.2	Very low	122 Å²	122	141.1 Å²	141.1	74%	0.739	81%	0.806	S	S	*	*			cis	-154.1	138.3	48.1	167	0	0	0	0	109.9	I177	V175-I177 HydrophobicContact CG1-CD1 4.27Å; V175-I177 HydrophobicContact CG1-CG1 3.94Å
176	R	52.8	Low	47.8	Very low	241 Å²	241	141.6 Å²	141.6	91%	0.909	81%	0.806	S	S	*	*			trans	-90	130	165.3	-67.5	177.1	177.4	167.6	-1.5	109.4
177	I	54	Low	47.9	Very low	140 Å²	140	142.8 Å²	142.8	72%	0.718	80%	0.802	S	S	*	*			trans	-145.7	93.9	155.1	-57.3	-178.5	0	0	0	104.7	V175	V175-I177 HydrophobicContact CG1-CD1 4.27Å; V175-I177 HydrophobicContact CG1-CG1 3.94Å
178	T	53.2	Low	48.4	Very low	125 Å²	125	140.3 Å²	140.3	77%	0.767	80%	0.8	S	S	*	*				39.4	145.1	108.2	66.6	0	0	0	0	115.5
179	A	51.4	Low	48.4	Very low	80 Å²	80	142.5 Å²	142.5	66%	0.661	81%	0.805	S	S	*	*			cis	174.2	143.8	-20.9	0	0	0	0	0	104.5
180	N	52.4	Low	48.8	Very low	165 Å²	165	140.7 Å²	140.7	88%	0.882	81%	0.808	S	S	*	*			trans	64.6	145.4	163.4	-77.6	-64.6	0	0	0	117.5
181	K	53.7	Low	49.1	Very low	266 Å²	266	141.9 Å²	141.9	100%	1.157	81%	0.807	S	S	*	*			cis	-151.6	0	24.2	177.3	175.2	177	-178.6	0	109.5

Retrieved 181 of 181 residues in 72.1 ms (Link to these results)

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