A0A077Z9K3_TRITR Loading...

RCC1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9K3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 333 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	41.4	Very low	39.2	Very low	81 Å²	81	125.4 Å²	125.4	40%	0.399	58%	0.578	S	S	.	*				0	101.8	0	-162	166.8	-174.7	0	0	105.8	L17 W18 I26 L55	M1-L17 HydrophobicContact CE-CB 4.46Å; M1-L17 HydrophobicContact CE-CD1 4.31Å; M1-L17 HydrophobicContact CE-CD2 4.11Å; M1-W18 WeakPolarHBondContact CG-O 3.4Å; M1-I26 HydrophobicContact CE-CD1 4.36Å; M1-I26 HydrophobicContact CE-CG1 3.82Å; M1-L55 HydrophobicContact CB-CD1 4.08Å; M1-L55 HydrophobicContact CE-CD1 4.22Å; M1-L55 HydrophobicContact CE-CD2 3.86Å; M1-L55 HydrophobicContact CG-CD1 3.61Å; M1-L55 HydrophobicContact SD-CB 4.36Å; M1-L55 HydrophobicContact SD-CD1 3.62Å; M1-L55 HydrophobicContact SD-CD2 3.99Å; M1-L55 HydrophobicContact SD-CG 4.21Å
2	L	33.9	Very low	41	Very low	116 Å²	116	116.8 Å²	116.8	61%	0.607	54%	0.539	S	S	*	.			trans	-96.9	112.2	-172.6	-124.9	148.4	0	0	0	107.5	W18	L2-W18 HydrophobicContact CB-CZ2 3.83Å; L2-W18 WeakPolarHBondContact O-CZ2 3.47Å
3	L	40.1	Very low	42.8	Very low	68 Å²	68	109.5 Å²	109.5	36%	0.356	52%	0.515	S	S	.	.			trans	-89.8	108.7	173.6	-86.3	165.6	0	0	0	109	L17 L53 L55	L3-L17 HydrophobicContact CD2-CD2 3.81Å; L3-L53 HydrophobicContact CD1-CD2 3.45Å; L3-L53 VanDerWaalsContact CD1-CD2 3.45Å; L3-L53 HydrophobicContact CD1-CG 4.09Å; L3-L53 HydrophobicContact CD2-CD2 3.27Å; L3-L53 HydrophobicContact CG-CD2 3.98Å; L3-L55 HydrophobicContact CD1-CD1 3.23Å; L3-L55 HydrophobicContact CD1-CD2 4.33Å; L3-L55 HydrophobicContact CD1-CG 3.64Å; L3-L55 HydrophobicContact CG-CD1 3.63Å; L3-L55 HydrophobicContact CG-CG 4.48Å
4	R	32	Very low	44.9	Very low	198 Å²	198	104.1 Å²	104.1	75%	0.747	49%	0.491	S	S	*	.			trans	-87.2	111.1	146.5	-78.2	-171.6	179.3	-174.5	0.9	106.5	A6	R4-A6 PolarHBondContact O-N 3.04Å
5	K	38.5	Very low	47.1	Very low	130 Å²	130	97.8 Å²	97.8	57%	0.565	46%	0.462	S	S	*	.			trans	-58.2	102.4	147.7	-94.5	-177.1	173.4	176.6	0	104	R7 T51	K5-R7 PolarHBondContact O-N 3.23Å; K5-T51 PolarHBondContact NZ-O 2.92Å
6	A	38.6	Very low	49.1	Very low	34 Å²	34	94.7 Å²	94.7	28%	0.281	45%	0.446	S	S	.	.			trans	-68.6	69.5	169.8	0	0	0	0	0	107.5	R4 E8 L9	R4-A6 PolarHBondContact O-N 3.04Å; A6-E8 PolarHBondContact O-N 3.46Å; A6-L9 HydrophobicContact CB-CB 4.31Å
7	R	36.6	Very low	51.1	Low	210 Å²	210	89.3 Å²	89.3	79%	0.792	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.8	168	-96.4	-170.3	170.4	-171.7	-1.7	110.7	K5	K5-R7 PolarHBondContact O-N 3.23Å
8	E	34.2	Very low	52.8	Low	182 Å²	182	87.8 Å²	87.8	85%	0.85	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-31.3	-171.8	-68.9	174.7	-172.7	0	0	114.4	A6	A6-E8 PolarHBondContact O-N 3.46Å
9	L	40	Very low	54.4	Low	149 Å²	149	84.1 Å²	84.1	78%	0.78	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-33.1	-176.3	-74.5	166.4	0	0	0	114.3	A6	A6-L9 HydrophobicContact CB-CB 4.31Å
10	H	46.1	Very low	55.6	Low	87 Å²	87	82.3 Å²	82.3	40%	0.403	39%	0.391	S	S	.	.			trans	-135.9	96.5	175.4	-78.5	46.7	0	0	0	107.3	H12 D14	H10-H12 PolarHBondContact O-N 3.21Å; H10-D14 IonicContact CD2-OD2 3.73Å
11	Q	50.1	Low	56.8	Low	124 Å²	124	78.4 Å²	78.4	58%	0.579	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-2.3	-179	-63.1	-177.8	7.6	0	0	113.9
12	H	60.6	Low	58.5	Low	23 Å²	23	81.9 Å²	81.9	11%	0.106	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-6	-169	-56.6	-54.2	0	0	0	113.8	H10 D14 F67 R75	H10-H12 PolarHBondContact O-N 3.21Å; H12-D14 VanDerWaalsContact C-N 3.32Å; H12-F67 VanDerWaalsContact O-CZ 3.32Å; H12-F67 WeakPolarHBondContact O-CZ 3.16Å; H12-R75 VanDerWaalsContact CB-NH2 3.32Å; H12-R75 PolarHBondContact O-NH2 3.5Å
13	G	64.2	Low	60.7	Low	22 Å²	22	81.7 Å²	81.7	23%	0.227	37%	0.373	C	S	.	.			trans	74.6	26.1	-178.8	0	0	0	0	0	113	V50	G13-V50 PolarHBondContact O-N 2.99Å
14	D	72.4	Confident	62.4	Low	33 Å²	33	78.6 Å²	78.6	18%	0.176	36%	0.358	C	S	.	.			trans	-69.7	140.2	178	-57.3	-31	0	0	0	110.2	H10 H12 F16 L41 R75	H10-D14 IonicContact CD2-OD2 3.73Å; H12-D14 VanDerWaalsContact C-N 3.32Å; D14-F16 HydrophobicContact CB-CD2 4.47Å; D14-F16 HydrophobicContact CB-CE2 3.85Å; D14-L41 HydrophobicContact CB-CD1 3.99Å; D14-R75 IonicContact OD1-CZ 2.67Å; D14-R75 IonicContact OD1-NH2 3.94Å; D14-R75 PolarHBondContact OD1-NH2 3.47Å
15	L	77.5	Confident	64.5	Low	10 Å²	10	70 Å²	70	5%	0.052	33%	0.326	C	S	.	.			trans	-95.4	111.3	-176.3	179.7	60.5	0	0	0	110.1	L17 V42 Y45 V50 L53	L15-L17 HydrophobicContact CD1-CD2 3.95Å; L15-L17 HydrophobicContact CD1-CG 4.13Å; L15-L17 HydrophobicContact CD2-CD1 4.32Å; L15-L17 HydrophobicContact CD2-CG 4.41Å; L15-L17 HydrophobicContact CG-CD2 4.46Å; L15-L17 HydrophobicContact CG-CG 4.09Å; L15-V42 HydrophobicContact CD2-CB 4.3Å; L15-V42 HydrophobicContact CD2-CG2 4.19Å; L15-V42 HydrophobicContact CG-CB 4.33Å; L15-V42 HydrophobicContact CG-CG2 4.04Å; L15-V42 PolarHBondContact O-N 2.9Å; L15-Y45 HydrophobicContact CD2-CD2 3.81Å; L15-Y45 HydrophobicContact CD2-CE2 4.35Å; L15-Y45 HydrophobicContact CD2-CG 4.29Å; L15-V50 HydrophobicContact CB-CG2 3.94Å; L15-V50 HydrophobicContact CD2-CG2 4.35Å; L15-L53 HydrophobicContact CD1-CD1 4.28Å; L15-L53 HydrophobicContact CD1-CD2 3.6Å; L15-L53 HydrophobicContact CD2-CD1 4.48Å
16	F	79.7	Confident	66.3	Low	48 Å²	48	63.9 Å²	63.9	21%	0.211	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.5	169	-64.3	-92.8	0	0	0	109.9	D14 P39 K40 L41	D14-F16 HydrophobicContact CB-CD2 4.47Å; D14-F16 HydrophobicContact CB-CE2 3.85Å; F16-P39 HydrophobicContact CB-CB 4.34Å; F16-P39 HydrophobicContact CD1-CB 4.42Å; F16-K40 CarbonylContact C-O 3.55Å; F16-K40 VanDerWaalsContact CA-O 3.26Å; F16-K40 WeakPolarHBondContact CA-O 3.44Å; F16-L41 HydrophobicContact CD1-CB 4.11Å; F16-L41 HydrophobicContact CE1-CB 3.78Å; F16-L41 HydrophobicContact CE1-CD1 4.1Å; F16-L41 HydrophobicContact CE2-CD1 4.3Å; F16-L41 HydrophobicContact CZ-CB 4.45Å; F16-L41 HydrophobicContact CZ-CD1 3.98Å
17	L	82.2	Confident	68.1	Low	3 Å²	3	62.8 Å²	62.8	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.1	175.4	-66.7	-176.8	0	0	0	109.5	M1 L3 L15 I26 K40 V42 L53 L55 T60	M1-L17 HydrophobicContact CE-CB 4.46Å; M1-L17 HydrophobicContact CE-CD1 4.31Å; M1-L17 HydrophobicContact CE-CD2 4.11Å; L3-L17 HydrophobicContact CD2-CD2 3.81Å; L15-L17 HydrophobicContact CD1-CD2 3.95Å; L15-L17 HydrophobicContact CD1-CG 4.13Å; L15-L17 HydrophobicContact CD2-CD1 4.32Å; L15-L17 HydrophobicContact CD2-CG 4.41Å; L15-L17 HydrophobicContact CG-CD2 4.46Å; L15-L17 HydrophobicContact CG-CG 4.09Å; L17-I26 HydrophobicContact CB-CB 4.28Å; L17-I26 HydrophobicContact CB-CG1 4.06Å; L17-I26 HydrophobicContact CB-CG2 3.73Å; L17-K40 PolarHBondContact N-O 2.95Å; L17-K40 WeakPolarHBondContact O-CB 3.23Å; L17-K40 PolarHBondContact O-N 3.31Å; L17-V42 HydrophobicContact CB-CG2 3.9Å; L17-V42 HydrophobicContact CD1-CG2 3.75Å; L17-V42 HydrophobicContact CG-CG2 3.71Å; L17-L53 HydrophobicContact CD2-CD2 4.09Å; L17-L55 HydrophobicContact CD2-CD2 4.46Å; L17-T60 HydrophobicContact CD1-CG2 4.3Å
18	W	81.8	Confident	69.8	Low	62 Å²	62	61.5 Å²	61.5	24%	0.235	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.8	173	67	76.3	0	0	0	110.7	M1 L2 I26 P39	M1-W18 WeakPolarHBondContact CG-O 3.4Å; L2-W18 HydrophobicContact CB-CZ2 3.83Å; L2-W18 WeakPolarHBondContact O-CZ2 3.47Å; W18-I26 VanDerWaalsContact C-CD1 3.48Å; W18-P39 HydrophobicContact CD2-CB 4.45Å; W18-P39 HydrophobicContact CD2-CG 4.28Å; W18-P39 VanDerWaalsContact CE3-CA 3.48Å; W18-P39 HydrophobicContact CE3-CB 3.4Å; W18-P39 HydrophobicContact CE3-CG 3.44Å; W18-P39 VanDerWaalsContact CE3-CG 3.44Å; W18-P39 HydrophobicContact CH2-CG 4.1Å; W18-P39 HydrophobicContact CZ3-CB 3.57Å; W18-P39 HydrophobicContact CZ3-CG 3.35Å
19	G	83.1	Confident	71.7	Confident	18 Å²	18	57.1 Å²	57.1	19%	0.186	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	113.1	-145.1	179.6	0	0	0	0	0	111.5	N21 I26 N35 Y36	G19-N21 PolarHBondContact O-N 3.36Å; G19-I26 WeakPolarHBondContact O-CD1 3.44Å; G19-N35 CarbonylContact O-C 3.26Å; G19-N35 WeakPolarHBondContact O-CA 3.47Å; G19-Y36 VanDerWaalsContact CA-O 3.26Å; G19-Y36 WeakPolarHBondContact CA-O 3.07Å; G19-Y36 PolarHBondContact N-O 3.09Å; G19-Y36 PolarHBondContact O-N 3.25Å
20	N	78.6	Confident	73.2	Confident	48 Å²	48	51.8 Å²	51.8	26%	0.257	25%	0.248	S	C	.	.			trans	-67.9	122.8	-177.9	-176.3	-10.9	0	0	0	111.4	R22 K25 I26 N35	N20-R22 WeakPolarHBondContact OD1-CA 3.31Å; N20-R22 WeakPolarHBondContact OD1-CB 3.43Å; N20-R22 WeakPolarHBondContact OD1-CG 3.21Å; N20-R22 PolarHBondContact OD1-N 2.96Å; N20-K25 WeakPolarHBondContact O-CE 3.35Å; N20-I26 WeakPolarHBondContact O-CD1 3.47Å; N20-N35 WeakPolarHBondContact CA-OD1 3.39Å
21	N	82	Confident	74.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	C	.	.			trans	-96.8	14.6	173.9	-165.4	34.7	0	0	0	113.6	G19 Y23 G24 K25 I26 D27 T30 D31 P32 S34 Y36	G19-N21 PolarHBondContact O-N 3.36Å; N21-Y23 PolarHBondContact O-N 3.29Å; N21-G24 WeakPolarHBondContact O-CA 3.28Å; N21-G24 PolarHBondContact O-N 2.87Å; N21-G24 WeakPolarHBondContact OD1-CA 2.81Å; N21-K25 PolarHBondContact OD1-N 3.44Å; N21-I26 HydrophobicContact CB-CB 4.36Å; N21-I26 HydrophobicContact CB-CD1 4.43Å; N21-I26 WeakPolarHBondContact OD1-CA 3.33Å; N21-I26 VanDerWaalsContact OD1-CB 3.31Å; N21-I26 WeakPolarHBondContact OD1-CB 3.5Å; N21-I26 PolarHBondContact OD1-N 3.28Å; N21-D27 PolarHBondContact ND2-O 2.97Å; N21-D27 PolarHBondContact OD1-N 3.24Å; N21-D27 PolarHBondContact OD1-O 3.28Å; N21-T30 PolarHBondContact ND2-OG1 3.37Å; N21-D31 PolarHBondContact ND2-O 3.42Å; N21-P32 CarbonylContact C-O 3.56Å; N21-P32 VanDerWaalsContact C-O 3.26Å; N21-P32 VanDerWaalsContact O-O 3.05Å; N21-S34 WeakPolarHBondContact CB-O 3.34Å; N21-Y36 HydrophobicContact CB-CD2 4.13Å; N21-Y36 HydrophobicContact CB-CE2 3.88Å
22	R	77.2	Confident	75.4	Confident	154 Å²	154	49 Å²	49	58%	0.581	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-48.3	134.2	173.2	-79.6	179.9	-166.1	-175.1	2.3	109.9	N20 G24 P32	N20-R22 WeakPolarHBondContact OD1-CA 3.31Å; N20-R22 WeakPolarHBondContact OD1-CB 3.43Å; N20-R22 WeakPolarHBondContact OD1-CG 3.21Å; N20-R22 PolarHBondContact OD1-N 2.96Å; R22-G24 PolarHBondContact O-N 3.45Å; R22-P32 WeakPolarHBondContact CA-O 3.45Å; R22-P32 PolarHBondContact N-O 2.87Å
23	Y	78.3	Confident	75.7	Confident	112 Å²	112	57.7 Å²	57.7	44%	0.439	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	67.4	8.7	-177.3	-44.1	-81.3	0	0	0	114.5	N21 R58 S333	N21-Y23 PolarHBondContact O-N 3.29Å; Y23-R58 HydrophobicContact CD2-CB 4.29Å; Y23-R58 HydrophobicContact CD2-CG 4.14Å; Y23-R58 HydrophobicContact CE2-CB 4.47Å; Y23-R58 HydrophobicContact CE2-CG 3.85Å; Y23-S333 VanDerWaalsContact CB-CB 3.47Å; Y23-S333 WeakPolarHBondContact CB-OG 3.47Å; Y23-S333 WeakPolarHBondContact O-CB 3.23Å; Y23-S333 PolarHBondContact O-OG 2.87Å
24	G	77.6	Confident	76.3	Confident	4 Å²	4	58.7 Å²	58.7	4%	0.041	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	75.9	23.5	176.9	0	0	0	0	0	114.1	N21 R22 I26	N21-G24 WeakPolarHBondContact O-CA 3.28Å; N21-G24 PolarHBondContact O-N 2.87Å; N21-G24 WeakPolarHBondContact OD1-CA 2.81Å; R22-G24 PolarHBondContact O-N 3.45Å; G24-I26 PolarHBondContact O-N 2.9Å
25	K	74.7	Confident	76.7	Confident	16 Å²	16	60.3 Å²	60.3	7%	0.07	29%	0.287	C	S	.	.	S	Bend	trans	-67.6	-19.2	-176.9	66.9	-178.4	177.1	175.8	0	114.7	N20 N21 G57	N20-K25 WeakPolarHBondContact O-CE 3.35Å; N21-K25 PolarHBondContact OD1-N 3.44Å; K25-G57 PolarHBondContact NZ-O 2.68Å
26	I	76.9	Confident	76.8	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	29%	0.292	C	S	.	.	S	Bend	trans	-97.4	-55.1	173.7	-64.5	171.4	0	0	0	109.1	M1 L17 W18 G19 N20 N21 G24 Y36 V42	M1-I26 HydrophobicContact CE-CD1 4.36Å; M1-I26 HydrophobicContact CE-CG1 3.82Å; L17-I26 HydrophobicContact CB-CB 4.28Å; L17-I26 HydrophobicContact CB-CG1 4.06Å; L17-I26 HydrophobicContact CB-CG2 3.73Å; W18-I26 VanDerWaalsContact C-CD1 3.48Å; G19-I26 WeakPolarHBondContact O-CD1 3.44Å; N20-I26 WeakPolarHBondContact O-CD1 3.47Å; N21-I26 HydrophobicContact CB-CB 4.36Å; N21-I26 HydrophobicContact CB-CD1 4.43Å; N21-I26 WeakPolarHBondContact OD1-CA 3.33Å; N21-I26 VanDerWaalsContact OD1-CB 3.31Å; N21-I26 WeakPolarHBondContact OD1-CB 3.5Å; N21-I26 PolarHBondContact OD1-N 3.28Å; G24-I26 PolarHBondContact O-N 2.9Å; I26-Y36 HydrophobicContact CB-CD2 4.12Å; I26-Y36 HydrophobicContact CB-CE2 4.3Å; I26-Y36 HydrophobicContact CD1-CD2 3.94Å; I26-Y36 HydrophobicContact CG2-CD2 3.63Å; I26-Y36 HydrophobicContact CG2-CE2 3.88Å; I26-V42 WeakPolarHBondContact O-CG1 3.41Å
27	D	76.2	Confident	76.9	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.059	32%	0.316	C	S	.	.			trans	-149	116.7	-179	-172.6	-2.2	0	0	0	110.8	N21 S29 T30 K40	N21-D27 PolarHBondContact ND2-O 2.97Å; N21-D27 PolarHBondContact OD1-N 3.24Å; N21-D27 PolarHBondContact OD1-O 3.28Å; D27-S29 VanDerWaalsContact C-N 3.32Å; D27-S29 WeakPolarHBondContact OD1-CB 3.49Å; D27-S29 PolarHBondContact OD1-N 3.44Å; D27-S29 PolarHBondContact OD1-OG 3.22Å; D27-S29 PolarHBondContact OD2-OG 3.16Å; D27-S29 VanDerWaalsContact OD2-OG 3.05Å; D27-T30 PolarHBondContact O-OG1 2.85Å; D27-K40 WeakPolarHBondContact OD2-CE 3.36Å; D27-K40 IonicContact OD2-NZ 3.54Å; D27-K40 PolarHBondContact OD2-NZ 3.49Å
28	R	72	Confident	76.8	Confident	183 Å²	183	73 Å²	73	69%	0.691	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.6	178.3	-162.7	179.5	73.3	168.8	4.1	113	T30	R28-T30 VanDerWaalsContact C-N 3.27Å
29	S	74.4	Confident	76.8	Confident	90 Å²	90	73.1 Å²	73.1	63%	0.629	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.8	178.9	69.7	0	0	0	0	112.5	D27	D27-S29 VanDerWaalsContact C-N 3.32Å; D27-S29 WeakPolarHBondContact OD1-CB 3.49Å; D27-S29 PolarHBondContact OD1-N 3.44Å; D27-S29 PolarHBondContact OD1-OG 3.22Å; D27-S29 PolarHBondContact OD2-OG 3.16Å; D27-S29 VanDerWaalsContact OD2-OG 3.05Å
30	T	71.6	Confident	76.6	Confident	38 Å²	38	74.5 Å²	74.5	23%	0.233	36%	0.356	C	S	.	.	S	Bend	trans	-100.7	164.5	179.5	54.4	0	0	0	0	112.5	N21 D27 R28 Y36 K40	N21-T30 PolarHBondContact ND2-OG1 3.37Å; D27-T30 PolarHBondContact O-OG1 2.85Å; R28-T30 VanDerWaalsContact C-N 3.27Å; T30-Y36 WeakPolarHBondContact CB-OH 3.41Å; T30-Y36 WeakPolarHBondContact CG2-OH 3.4Å; T30-Y36 PolarHBondContact OG1-OH 3.04Å; T30-K40 VanDerWaalsContact CG2-NZ 3.3Å
31	D	75.2	Confident	76.7	Confident	84 Å²	84	75.2 Å²	75.2	45%	0.449	36%	0.36	S	S	.	.			trans	-51.8	126.8	176.9	-177.3	-11.7	0	0	0	110.2	N21 R33 S34	N21-D31 PolarHBondContact ND2-O 3.42Å; D31-R33 PolarHBondContact O-N 2.99Å; D31-R33 WeakPolarHBondContact OD1-CB 3.37Å; D31-R33 PolarHBondContact OD1-N 3.45Å; D31-S34 WeakPolarHBondContact O-CB 3.5Å; D31-S34 PolarHBondContact O-N 2.73Å; D31-S34 PolarHBondContact O-OG 3.3Å
32	P	67.1	Low	76.6	Confident	69 Å²	69	75.4 Å²	75.4	45%	0.448	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-10.8	175	25	-36.3	0	0	0	113.6	N21 R22	N21-P32 CarbonylContact C-O 3.56Å; N21-P32 VanDerWaalsContact C-O 3.26Å; N21-P32 VanDerWaalsContact O-O 3.05Å; R22-P32 WeakPolarHBondContact CA-O 3.45Å; R22-P32 PolarHBondContact N-O 2.87Å
33	R	67	Low	76.8	Confident	204 Å²	204	74.7 Å²	74.7	77%	0.77	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.5	174.3	-62.3	178.7	-178.2	148.7	0.5	113.9	D31 N35	D31-R33 PolarHBondContact O-N 2.99Å; D31-R33 WeakPolarHBondContact OD1-CB 3.37Å; D31-R33 PolarHBondContact OD1-N 3.45Å; R33-N35 PolarHBondContact O-N 3.36Å
34	S	76.8	Confident	76.7	Confident	43 Å²	43	75.2 Å²	75.2	30%	0.301	37%	0.365	S	S	.	.			trans	-71.9	115.5	-178.1	-59.6	0	0	0	0	111.5	N21 D31	N21-S34 WeakPolarHBondContact CB-O 3.34Å; D31-S34 WeakPolarHBondContact O-CB 3.5Å; D31-S34 PolarHBondContact O-N 2.73Å; D31-S34 PolarHBondContact O-OG 3.3Å
35	N	81.7	Confident	76.7	Confident	67 Å²	67	75.3 Å²	75.3	36%	0.358	36%	0.364	S	S	.	.			trans	-86.6	140.2	168.1	-65	-27.4	0	0	0	109.8	G19 N20 R33 Y37	G19-N35 CarbonylContact O-C 3.26Å; G19-N35 WeakPolarHBondContact O-CA 3.47Å; N20-N35 WeakPolarHBondContact CA-OD1 3.39Å; R33-N35 PolarHBondContact O-N 3.36Å; N35-Y37 HydrophobicContact CB-CD2 4.48Å; N35-Y37 HydrophobicContact CB-CE1 4.48Å; N35-Y37 HydrophobicContact CB-CE2 3.66Å; N35-Y37 PolarHBondContact ND2-OH 3.25Å
36	Y	78	Confident	76.8	Confident	36 Å²	36	75.9 Å²	75.9	14%	0.141	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.5	176.1	-63.7	-68.1	0	0	0	109.7	G19 N21 I26 T30 K40	G19-Y36 VanDerWaalsContact CA-O 3.26Å; G19-Y36 WeakPolarHBondContact CA-O 3.07Å; G19-Y36 PolarHBondContact N-O 3.09Å; G19-Y36 PolarHBondContact O-N 3.25Å; N21-Y36 HydrophobicContact CB-CD2 4.13Å; N21-Y36 HydrophobicContact CB-CE2 3.88Å; I26-Y36 HydrophobicContact CB-CD2 4.12Å; I26-Y36 HydrophobicContact CB-CE2 4.3Å; I26-Y36 HydrophobicContact CD1-CD2 3.94Å; I26-Y36 HydrophobicContact CG2-CD2 3.63Å; I26-Y36 HydrophobicContact CG2-CE2 3.88Å; T30-Y36 WeakPolarHBondContact CB-OH 3.41Å; T30-Y36 WeakPolarHBondContact CG2-OH 3.4Å; T30-Y36 PolarHBondContact OG1-OH 3.04Å; Y36-K40 HydrophobicContact CD1-CB 4.32Å; Y36-K40 HydrophobicContact CD1-CD 3.71Å; Y36-K40 HydrophobicContact CD2-CD 4.29Å; Y36-K40 HydrophobicContact CE1-CD 3.37Å; Y36-K40 HydrophobicContact CE2-CD 3.97Å; Y36-K40 HydrophobicContact CG-CB 4.33Å; Y36-K40 HydrophobicContact CG-CD 4.16Å; Y36-K40 VanDerWaalsContact CZ-CD 3.49Å; Y36-K40 PolarHBondContact OH-NZ 3.13Å
37	Y	82.5	Confident	77	Confident	182 Å²	182	80.2 Å²	80.2	71%	0.714	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	-6.6	177.5	-58.9	-80.4	0	0	0	112.9	N35	N35-Y37 HydrophobicContact CB-CD2 4.48Å; N35-Y37 HydrophobicContact CB-CE1 4.48Å; N35-Y37 HydrophobicContact CB-CE2 3.66Å; N35-Y37 PolarHBondContact ND2-OH 3.25Å
38	V	80.4	Confident	77.2	Confident	110 Å²	110	80.8 Å²	80.8	67%	0.667	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.6	174	179.2	0	0	0	0	108.1	K40	V38-K40 PolarHBondContact O-N 3.28Å; V38-K40 VanDerWaalsContact O-N 3.08Å
39	P	80.9	Confident	77.5	Confident	65 Å²	65	77.2 Å²	77.2	42%	0.422	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.2	115.9	173.4	-20.1	26.5	0	0	0	112	F16 W18	F16-P39 HydrophobicContact CB-CB 4.34Å; F16-P39 HydrophobicContact CD1-CB 4.42Å; W18-P39 HydrophobicContact CD2-CB 4.45Å; W18-P39 HydrophobicContact CD2-CG 4.28Å; W18-P39 VanDerWaalsContact CE3-CA 3.48Å; W18-P39 HydrophobicContact CE3-CB 3.4Å; W18-P39 HydrophobicContact CE3-CG 3.44Å; W18-P39 VanDerWaalsContact CE3-CG 3.44Å; W18-P39 HydrophobicContact CH2-CG 4.1Å; W18-P39 HydrophobicContact CZ3-CB 3.57Å; W18-P39 HydrophobicContact CZ3-CG 3.35Å
40	K	79.6	Confident	77.6	Confident	46 Å²	46	73.9 Å²	73.9	20%	0.2	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.3	177.8	-176.1	175.8	-174.7	-170.5	0	110.4	F16 L17 D27 T30 Y36 V38 V42	F16-K40 CarbonylContact C-O 3.55Å; F16-K40 VanDerWaalsContact CA-O 3.26Å; F16-K40 WeakPolarHBondContact CA-O 3.44Å; L17-K40 PolarHBondContact N-O 2.95Å; L17-K40 WeakPolarHBondContact O-CB 3.23Å; L17-K40 PolarHBondContact O-N 3.31Å; D27-K40 WeakPolarHBondContact OD2-CE 3.36Å; D27-K40 IonicContact OD2-NZ 3.54Å; D27-K40 PolarHBondContact OD2-NZ 3.49Å; T30-K40 VanDerWaalsContact CG2-NZ 3.3Å; Y36-K40 HydrophobicContact CD1-CB 4.32Å; Y36-K40 HydrophobicContact CD1-CD 3.71Å; Y36-K40 HydrophobicContact CD2-CD 4.29Å; Y36-K40 HydrophobicContact CE1-CD 3.37Å; Y36-K40 HydrophobicContact CE2-CD 3.97Å; Y36-K40 HydrophobicContact CG-CB 4.33Å; Y36-K40 HydrophobicContact CG-CD 4.16Å; Y36-K40 VanDerWaalsContact CZ-CD 3.49Å; Y36-K40 PolarHBondContact OH-NZ 3.13Å; V38-K40 PolarHBondContact O-N 3.28Å; V38-K40 VanDerWaalsContact O-N 3.08Å; K40-V42 PolarHBondContact O-N 3.27Å
41	L	80.5	Confident	78	Confident	63 Å²	63	75 Å²	75	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	127.1	169.5	-179.7	64.4	0	0	0	109.9	D14 F16 E43	D14-L41 HydrophobicContact CB-CD1 3.99Å; F16-L41 HydrophobicContact CD1-CB 4.11Å; F16-L41 HydrophobicContact CE1-CB 3.78Å; F16-L41 HydrophobicContact CE1-CD1 4.1Å; F16-L41 HydrophobicContact CE2-CD1 4.3Å; F16-L41 HydrophobicContact CZ-CB 4.45Å; F16-L41 HydrophobicContact CZ-CD1 3.98Å; L41-E43 PolarHBondContact O-N 2.97Å
42	V	81	Confident	78.1	Confident	4 Å²	4	76.5 Å²	76.5	2%	0.024	37%	0.373	C	S	.	.			trans	-85.9	91.6	173.7	-169.8	0	0	0	0	109	L15 L17 I26 K40 R44 Y45	L15-V42 HydrophobicContact CD2-CB 4.3Å; L15-V42 HydrophobicContact CD2-CG2 4.19Å; L15-V42 HydrophobicContact CG-CB 4.33Å; L15-V42 HydrophobicContact CG-CG2 4.04Å; L15-V42 PolarHBondContact O-N 2.9Å; L17-V42 HydrophobicContact CB-CG2 3.9Å; L17-V42 HydrophobicContact CD1-CG2 3.75Å; L17-V42 HydrophobicContact CG-CG2 3.71Å; I26-V42 WeakPolarHBondContact O-CG1 3.41Å; K40-V42 PolarHBondContact O-N 3.27Å; V42-R44 HydrophobicContact CG1-CB 4.46Å; V42-R44 PolarHBondContact O-N 3.41Å; V42-R44 VanDerWaalsContact O-N 3.1Å; V42-Y45 HydrophobicContact CB-CD2 4.18Å; V42-Y45 HydrophobicContact CG1-CD2 3.56Å; V42-Y45 HydrophobicContact CG1-CE2 4.04Å; V42-Y45 PolarHBondContact O-N 2.99Å
43	E	80.1	Confident	78.7	Confident	140 Å²	140	75.1 Å²	75.1	65%	0.654	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-53.7	-34.9	-173.3	-64	-179.5	177.8	0	0	113.9	L41 Y45 A46	L41-E43 PolarHBondContact O-N 2.97Å; E43-Y45 PolarHBondContact O-N 3.5Å; E43-A46 VanDerWaalsContact O-CB 3.3Å; E43-A46 WeakPolarHBondContact O-CB 3.43Å; E43-A46 PolarHBondContact O-N 2.87Å
44	R	76.2	Confident	79.4	Confident	122 Å²	122	68.1 Å²	68.1	46%	0.46	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-54.4	-28.5	175.9	-179.5	-176.8	-65.4	-92	-8.4	113.2	V42	V42-R44 HydrophobicContact CG1-CB 4.46Å; V42-R44 PolarHBondContact O-N 3.41Å; V42-R44 VanDerWaalsContact O-N 3.1Å
45	Y	77.5	Confident	79.5	Confident	6 Å²	6	68.8 Å²	68.8	2%	0.024	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-107.3	7.3	-179.6	-60.3	-76.2	0	0	0	113.4	L15 V42 E43 N47 Y48 K329 I331	L15-Y45 HydrophobicContact CD2-CD2 3.81Å; L15-Y45 HydrophobicContact CD2-CE2 4.35Å; L15-Y45 HydrophobicContact CD2-CG 4.29Å; V42-Y45 HydrophobicContact CB-CD2 4.18Å; V42-Y45 HydrophobicContact CG1-CD2 3.56Å; V42-Y45 HydrophobicContact CG1-CE2 4.04Å; V42-Y45 PolarHBondContact O-N 2.99Å; E43-Y45 PolarHBondContact O-N 3.5Å; Y45-N47 PolarHBondContact O-N 3.06Å; Y45-Y48 HydrophobicContact CD1-CD2 4.42Å; Y45-Y48 PolarHBondContact O-N 2.8Å; Y45-K329 HydrophobicContact CE1-CB 3.93Å; Y45-K329 HydrophobicContact CE1-CD 3.82Å; Y45-K329 WeakPolarHBondContact OH-CB 3.41Å; Y45-I331 HydrophobicContact CE2-CD1 4.12Å
46	A	78.4	Confident	79.3	Confident	28 Å²	28	67.3 Å²	67.3	23%	0.231	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.9	178.1	0	0	0	0	0	113	E43 Y48 R75	E43-A46 VanDerWaalsContact O-CB 3.3Å; E43-A46 WeakPolarHBondContact O-CB 3.43Å; E43-A46 PolarHBondContact O-N 2.87Å; A46-Y48 VanDerWaalsContact C-N 3.28Å; A46-Y48 PolarHBondContact O-N 2.91Å; A46-R75 PolarHBondContact O-NH1 3.48Å
47	N	79.8	Confident	79.2	Confident	94 Å²	94	68.4 Å²	68.4	50%	0.503	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	10.3	176	-63.6	-15.7	0	0	0	113.6	Y45 F67	Y45-N47 PolarHBondContact O-N 3.06Å; N47-F67 VanDerWaalsContact C-CE2 3.48Å; N47-F67 WeakPolarHBondContact O-CD2 3.26Å; N47-F67 PolarHBondContact O-N 3.37Å
48	Y	80.8	Confident	78.9	Confident	22 Å²	22	67 Å²	67	9%	0.086	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.9	-179	-65.2	-97.7	0	0	0	111.5	Y45 A46 V50 A64 K65 R66 F67 E327 K329	Y45-Y48 HydrophobicContact CD1-CD2 4.42Å; Y45-Y48 PolarHBondContact O-N 2.8Å; A46-Y48 VanDerWaalsContact C-N 3.28Å; A46-Y48 PolarHBondContact O-N 2.91Å; Y48-V50 PolarHBondContact O-N 2.83Å; Y48-A64 HydrophobicContact CD1-CB 4.2Å; Y48-A64 HydrophobicContact CG-CB 4.33Å; Y48-K65 CarbonylContact C-O 3.55Å; Y48-K65 WeakPolarHBondContact CA-O 3.32Å; Y48-R66 HydrophobicContact CD1-CB 3.91Å; Y48-R66 HydrophobicContact CD1-CG 4.37Å; Y48-R66 HydrophobicContact CE1-CB 3.74Å; Y48-R66 HydrophobicContact CE1-CG 4.05Å; Y48-F67 VanDerWaalsContact C-CZ 3.44Å; Y48-F67 VanDerWaalsContact N-CE2 3.33Å; Y48-F67 WeakPolarHBondContact O-CE2 3.44Å; Y48-E327 HydrophobicContact CE1-CB 4.07Å; Y48-E327 HydrophobicContact CE1-CG 4.13Å; Y48-E327 VanDerWaalsContact CE1-OE2 3.26Å; Y48-E327 WeakPolarHBondContact CE1-OE2 3.3Å; Y48-E327 VanDerWaalsContact CZ-OE2 3.26Å; Y48-E327 PolarHBondContact OH-OE1 3.16Å; Y48-E327 PolarHBondContact OH-OE2 3.44Å; Y48-K329 PolarHBondContact OH-NZ 3.11Å
49	K	78.9	Confident	78.7	Confident	108 Å²	108	64.3 Å²	64.3	47%	0.47	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	106	166.4	-168.7	173.2	-176.9	171.3	0	108.8	T51 A64 K65 F67	K49-T51 PolarHBondContact O-N 2.93Å; K49-A64 CarbonylContact O-C 3.59Å; K49-A64 VanDerWaalsContact O-CA 3.28Å; K49-A64 WeakPolarHBondContact O-CA 3.21Å; K49-K65 PolarHBondContact N-O 3.25Å; K49-K65 PolarHBondContact O-N 2.72Å; K49-F67 VanDerWaalsContact CA-CZ 3.48Å; K49-F67 HydrophobicContact CB-CE1 3.62Å; K49-F67 HydrophobicContact CB-CZ 3.52Å; K49-F67 HydrophobicContact CD-CE1 4.49Å; K49-F67 HydrophobicContact CG-CE1 4.34Å; K49-F67 HydrophobicContact CG-CZ 4.33Å
50	V	76.6	Confident	78.4	Confident	20 Å²	20	61.3 Å²	61.3	12%	0.121	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	121.5	176.4	-178.2	0	0	0	0	109.8	G13 L15 Y48 A62 A64	G13-V50 PolarHBondContact O-N 2.99Å; L15-V50 HydrophobicContact CB-CG2 3.94Å; L15-V50 HydrophobicContact CD2-CG2 4.35Å; Y48-V50 PolarHBondContact O-N 2.83Å; V50-A62 HydrophobicContact CG1-CB 4.27Å; V50-A64 HydrophobicContact CB-CB 4.5Å; V50-A64 HydrophobicContact CG2-CB 3.99Å
51	T	78.4	Confident	78.4	Confident	63 Å²	63	61.9 Å²	61.9	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-39	-179	57.8	0	0	0	0	111.7	K5 K49 V63	K5-T51 PolarHBondContact NZ-O 2.92Å; K49-T51 PolarHBondContact O-N 2.93Å; T51-V63 PolarHBondContact N-O 3.42Å; T51-V63 PolarHBondContact OG1-O 2.95Å
52	Q	77.5	Confident	78.4	Confident	114 Å²	114	58.9 Å²	58.9	53%	0.533	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.8	179.5	-52.9	-178.9	10	0	0	110.6	A62 V63	Q52-A62 WeakPolarHBondContact O-CA 3.31Å; Q52-V63 HydrophobicContact CB-CB 4.02Å; Q52-V63 HydrophobicContact CB-CG2 4.15Å; Q52-V63 PolarHBondContact N-O 3.38Å; Q52-V63 PolarHBondContact O-N 3.36Å
53	L	80.8	Confident	78.3	Confident	41 Å²	41	60.3 Å²	60.3	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	130.1	-177.4	-176.5	71.2	0	0	0	108.8	L3 L15 L17 L55 T60 I61 A62	L3-L53 HydrophobicContact CD1-CD2 3.45Å; L3-L53 VanDerWaalsContact CD1-CD2 3.45Å; L3-L53 HydrophobicContact CD1-CG 4.09Å; L3-L53 HydrophobicContact CD2-CD2 3.27Å; L3-L53 HydrophobicContact CG-CD2 3.98Å; L15-L53 HydrophobicContact CD1-CD1 4.28Å; L15-L53 HydrophobicContact CD1-CD2 3.6Å; L15-L53 HydrophobicContact CD2-CD1 4.48Å; L17-L53 HydrophobicContact CD2-CD2 4.09Å; L53-L55 HydrophobicContact CD1-CD2 4.41Å; L53-L55 HydrophobicContact CD2-CD2 4.41Å; L53-L55 HydrophobicContact CG-CD2 4.24Å; L53-T60 HydrophobicContact CD1-CG2 3.87Å; L53-I61 CarbonylContact C-O 3.6Å; L53-I61 WeakPolarHBondContact CA-O 3.24Å; L53-I61 WeakPolarHBondContact CD1-O 3.45Å; L53-A62 HydrophobicContact CD1-CB 3.83Å
54	A	80.5	Confident	78.2	Confident	56 Å²	56	53.8 Å²	53.8	46%	0.463	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.9	172.9	0	0	0	0	0	109.1	I61	A54-I61 HydrophobicContact CB-CB 4.42Å; A54-I61 PolarHBondContact N-O 2.92Å; A54-I61 PolarHBondContact O-N 3.29Å
55	L	79.5	Confident	78.5	Confident	57 Å²	57	52.1 Å²	52.1	30%	0.298	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.9	-178.6	-58.9	179.4	0	0	0	109.5	M1 L3 L17 L53 T60	M1-L55 HydrophobicContact CB-CD1 4.08Å; M1-L55 HydrophobicContact CE-CD1 4.22Å; M1-L55 HydrophobicContact CE-CD2 3.86Å; M1-L55 HydrophobicContact CG-CD1 3.61Å; M1-L55 HydrophobicContact SD-CB 4.36Å; M1-L55 HydrophobicContact SD-CD1 3.62Å; M1-L55 HydrophobicContact SD-CD2 3.99Å; M1-L55 HydrophobicContact SD-CG 4.21Å; L3-L55 HydrophobicContact CD1-CD1 3.23Å; L3-L55 HydrophobicContact CD1-CD2 4.33Å; L3-L55 HydrophobicContact CD1-CG 3.64Å; L3-L55 HydrophobicContact CG-CD1 3.63Å; L3-L55 HydrophobicContact CG-CG 4.48Å; L17-L55 HydrophobicContact CD2-CD2 4.46Å; L53-L55 HydrophobicContact CD1-CD2 4.41Å; L53-L55 HydrophobicContact CD2-CD2 4.41Å; L53-L55 HydrophobicContact CG-CD2 4.24Å; L55-T60 HydrophobicContact CD2-CG2 3.63Å; L55-T60 WeakPolarHBondContact CD2-OG1 3.28Å
56	G	77.4	Confident	78.7	Confident	36 Å²	36	58.7 Å²	58.7	37%	0.371	31%	0.313	S	S	.	.			trans	-111	173.6	168.5	0	0	0	0	0	111.4	R58 H59	G56-R58 VanDerWaalsContact C-N 3.29Å; G56-R58 PolarHBondContact O-N 3.2Å; G56-H59 WeakPolarHBondContact CA-O 3.2Å; G56-H59 PolarHBondContact N-O 2.87Å
57	G	75.7	Confident	78.7	Confident	60 Å²	60	58.3 Å²	58.3	62%	0.619	31%	0.306	S	S	*	.	S	Bend	trans	-58.2	-41.9	176.9	0	0	0	0	0	112.7	K25	K25-G57 PolarHBondContact NZ-O 2.68Å
58	R	77	Confident	78.6	Confident	152 Å²	152	56.9 Å²	56.9	57%	0.574	30%	0.301	S	S	*	.	S	Bend	trans	-116.7	-2.7	-178.9	-62.7	-174	-178.5	166	1.3	114.6	Y23 G56 S333	Y23-R58 HydrophobicContact CD2-CB 4.29Å; Y23-R58 HydrophobicContact CD2-CG 4.14Å; Y23-R58 HydrophobicContact CE2-CB 4.47Å; Y23-R58 HydrophobicContact CE2-CG 3.85Å; G56-R58 VanDerWaalsContact C-N 3.29Å; G56-R58 PolarHBondContact O-N 3.2Å; R58-S333 PolarHBondContact O-OG 3.48Å
59	H	74.7	Confident	78.3	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.25	32%	0.319	C	S	.	.			trans	-136	157	-171.3	-47.5	-52.7	0	0	0	111.5	G56 H158 S333	G56-H59 WeakPolarHBondContact CA-O 3.2Å; G56-H59 PolarHBondContact N-O 2.87Å; H59-H158 AromaticContact NE2-NE2 3.9Å; H59-S333 PolarHBondContact CE1-O 3.37Å; H59-S333 PolarHBondContact ND1-O 3.46Å
60	T	75.6	Confident	78.2	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.012	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	131.4	175.3	-69.2	0	0	0	0	109.3	L17 L53 L55 I331	L17-T60 HydrophobicContact CD1-CG2 4.3Å; L53-T60 HydrophobicContact CD1-CG2 3.87Å; L55-T60 HydrophobicContact CD2-CG2 3.63Å; L55-T60 WeakPolarHBondContact CD2-OG1 3.28Å; T60-I331 HydrophobicContact CG2-CD1 4.45Å; T60-I331 PolarHBondContact N-O 3.36Å; T60-I331 WeakPolarHBondContact O-CA 3.48Å; T60-I331 VanDerWaalsContact O-CB 3.27Å; T60-I331 WeakPolarHBondContact O-CB 3.47Å; T60-I331 PolarHBondContact O-N 2.82Å
61	I	80	Confident	78	Confident	57 Å²	57	64.7 Å²	64.7	29%	0.292	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.6	-175.2	-46.5	-175.5	0	0	0	108.3	L53 A54 L330	L53-I61 CarbonylContact C-O 3.6Å; L53-I61 WeakPolarHBondContact CA-O 3.24Å; L53-I61 WeakPolarHBondContact CD1-O 3.45Å; A54-I61 HydrophobicContact CB-CB 4.42Å; A54-I61 PolarHBondContact N-O 2.92Å; A54-I61 PolarHBondContact O-N 3.29Å; I61-L330 HydrophobicContact CB-CD1 4.34Å; I61-L330 HydrophobicContact CD1-CD1 3.42Å; I61-L330 VanDerWaalsContact CD1-CD1 3.42Å; I61-L330 HydrophobicContact CG1-CD1 3.59Å; I61-L330 HydrophobicContact CG2-CD1 3.99Å
62	A	79.9	Confident	77.7	Confident	1 Å²	1	65 Å²	65	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.7	177	0	0	0	0	0	110.8	V50 Q52 L53 K329	V50-A62 HydrophobicContact CG1-CB 4.27Å; Q52-A62 WeakPolarHBondContact O-CA 3.31Å; L53-A62 HydrophobicContact CD1-CB 3.83Å; A62-K329 PolarHBondContact N-O 2.83Å; A62-K329 PolarHBondContact O-N 3.05Å
63	V	79.1	Confident	77.5	Confident	34 Å²	34	66.2 Å²	66.2	21%	0.206	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	120.8	165.1	-176.5	0	0	0	0	107.1	T51 Q52 I326 V328	T51-V63 PolarHBondContact N-O 3.42Å; T51-V63 PolarHBondContact OG1-O 2.95Å; Q52-V63 HydrophobicContact CB-CB 4.02Å; Q52-V63 HydrophobicContact CB-CG2 4.15Å; Q52-V63 PolarHBondContact N-O 3.38Å; Q52-V63 PolarHBondContact O-N 3.36Å; V63-I326 HydrophobicContact CG1-CG2 3.83Å; V63-V328 HydrophobicContact CG2-CG2 4.43Å
64	A	79.1	Confident	77.1	Confident	2 Å²	2	67.7 Å²	67.7	2%	0.017	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.8	-177	0	0	0	0	0	112.1	Y48 K49 V50 E327	Y48-A64 HydrophobicContact CD1-CB 4.2Å; Y48-A64 HydrophobicContact CG-CB 4.33Å; K49-A64 CarbonylContact O-C 3.59Å; K49-A64 VanDerWaalsContact O-CA 3.28Å; K49-A64 WeakPolarHBondContact O-CA 3.21Å; V50-A64 HydrophobicContact CB-CB 4.5Å; V50-A64 HydrophobicContact CG2-CB 3.99Å; A64-E327 PolarHBondContact N-O 3.45Å; A64-E327 PolarHBondContact O-N 3.28Å; A64-E327 VanDerWaalsContact O-N 3.14Å
65	K	82	Confident	76.6	Confident	87 Å²	87	67.1 Å²	67.1	38%	0.378	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.6	173.6	-178.8	176.3	171.2	174.4	0	108.3	Y48 K49 P324	Y48-K65 CarbonylContact C-O 3.55Å; Y48-K65 WeakPolarHBondContact CA-O 3.32Å; K49-K65 PolarHBondContact N-O 3.25Å; K49-K65 PolarHBondContact O-N 2.72Å; K65-P324 HydrophobicContact CD-CB 4.23Å; K65-P324 VanDerWaalsContact CE-CB 3.45Å
66	R	82.2	Confident	76.3	Confident	145 Å²	145	70.8 Å²	70.8	55%	0.547	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	140.6	175.6	-166.4	176	174.9	175.8	-1.7	110.2	Y48	Y48-R66 HydrophobicContact CD1-CB 3.91Å; Y48-R66 HydrophobicContact CD1-CG 4.37Å; Y48-R66 HydrophobicContact CE1-CB 3.74Å; Y48-R66 HydrophobicContact CE1-CG 4.05Å
67	F	77.8	Confident	76.2	Confident	19 Å²	19	73.2 Å²	73.2	8%	0.083	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-63.4	137.5	169.9	-66.2	-63.8	0	0	0	110.2	H12 N47 Y48 K49 D71 E72 R75	H12-F67 VanDerWaalsContact O-CZ 3.32Å; H12-F67 WeakPolarHBondContact O-CZ 3.16Å; N47-F67 VanDerWaalsContact C-CE2 3.48Å; N47-F67 WeakPolarHBondContact O-CD2 3.26Å; N47-F67 PolarHBondContact O-N 3.37Å; Y48-F67 VanDerWaalsContact C-CZ 3.44Å; Y48-F67 VanDerWaalsContact N-CE2 3.33Å; Y48-F67 WeakPolarHBondContact O-CE2 3.44Å; K49-F67 VanDerWaalsContact CA-CZ 3.48Å; K49-F67 HydrophobicContact CB-CE1 3.62Å; K49-F67 HydrophobicContact CB-CZ 3.52Å; K49-F67 HydrophobicContact CD-CE1 4.49Å; K49-F67 HydrophobicContact CG-CE1 4.34Å; K49-F67 HydrophobicContact CG-CZ 4.33Å; F67-D71 HydrophobicContact CB-CB 4.1Å; F67-D71 HydrophobicContact CD1-CB 3.76Å; F67-D71 HydrophobicContact CG-CB 4.37Å; F67-E72 HydrophobicContact CB-CG 4.12Å; F67-R75 VanDerWaalsContact CD2-CZ 3.45Å
68	T	77.9	Confident	75.9	Confident	64 Å²	64	76.1 Å²	76.1	39%	0.393	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-83.9	160.5	166.5	63.2	0	0	0	0	109.4	K70 D71 E72	T68-K70 PolarHBondContact O-N 2.98Å; T68-K70 VanDerWaalsContact O-N 3.1Å; T68-D71 PolarHBondContact N-OD2 2.88Å; T68-D71 WeakPolarHBondContact O-CA 3.31Å; T68-D71 WeakPolarHBondContact O-CB 3.46Å; T68-D71 PolarHBondContact O-N 2.91Å; T68-D71 PolarHBondContact OG1-N 2.69Å; T68-D71 PolarHBondContact OG1-OD2 2.78Å; T68-E72 PolarHBondContact O-N 3.05Å
69	Q	74.1	Confident	75.7	Confident	101 Å²	101	73.1 Å²	73.1	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-54.8	-31.3	174.1	-73.5	-177.4	22.4	0	0	112.5	E72 K73 E320	Q69-E72 PolarHBondContact O-N 3.23Å; Q69-K73 WeakPolarHBondContact O-CG 3.31Å; Q69-K73 PolarHBondContact O-N 3.12Å; Q69-E320 PolarHBondContact NE2-OE1 3.33Å; Q69-E320 PolarHBondContact OE1-OE1 3.1Å
70	K	75.5	Confident	75.8	Confident	156 Å²	156	74 Å²	74	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-63.9	-43.6	173.3	-173.5	178.1	-179.4	177.8	0	111.4	T68 E72 K73 I74	T68-K70 PolarHBondContact O-N 2.98Å; T68-K70 VanDerWaalsContact O-N 3.1Å; K70-E72 VanDerWaalsContact C-N 3.34Å; K70-K73 PolarHBondContact O-N 3.42Å; K70-I74 HydrophobicContact CG-CD1 4.18Å; K70-I74 WeakPolarHBondContact O-CD1 3.44Å; K70-I74 VanDerWaalsContact O-CG1 3.23Å; K70-I74 WeakPolarHBondContact O-CG1 3.44Å; K70-I74 PolarHBondContact O-N 3.03Å; K70-I74 VanDerWaalsContact O-N 3.11Å
71	D	73.4	Confident	75.8	Confident	57 Å²	57	77.3 Å²	77.3	31%	0.305	37%	0.369	S	S	.	.	H	α-helix	trans	-67.7	-35.4	176.9	-57.8	-50.3	0	0	0	111.8	F67 T68 I74 R75	F67-D71 HydrophobicContact CB-CB 4.1Å; F67-D71 HydrophobicContact CD1-CB 3.76Å; F67-D71 HydrophobicContact CG-CB 4.37Å; T68-D71 PolarHBondContact N-OD2 2.88Å; T68-D71 WeakPolarHBondContact O-CA 3.31Å; T68-D71 WeakPolarHBondContact O-CB 3.46Å; T68-D71 PolarHBondContact O-N 2.91Å; T68-D71 PolarHBondContact OG1-N 2.69Å; T68-D71 PolarHBondContact OG1-OD2 2.78Å; D71-I74 PolarHBondContact O-N 3.4Å; D71-R75 WeakPolarHBondContact O-CB 3.48Å; D71-R75 WeakPolarHBondContact O-CG 3.3Å; D71-R75 PolarHBondContact O-N 3.4Å
72	E	71.2	Confident	75.5	Confident	70 Å²	70	78.6 Å²	78.6	33%	0.327	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-48	174.7	-69.8	176.7	174.4	0	0	111.4	F67 T68 Q69 K70 I74 R75 F76	F67-E72 HydrophobicContact CB-CG 4.12Å; T68-E72 PolarHBondContact O-N 3.05Å; Q69-E72 PolarHBondContact O-N 3.23Å; K70-E72 VanDerWaalsContact C-N 3.34Å; E72-I74 VanDerWaalsContact C-N 3.31Å; E72-I74 PolarHBondContact O-N 3.36Å; E72-R75 WeakPolarHBondContact O-CA 3.28Å; E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 3.34Å; E72-F76 HydrophobicContact CB-CE2 4.32Å; E72-F76 WeakPolarHBondContact O-CD2 3.32Å; E72-F76 PolarHBondContact O-N 2.96Å
73	K	73.7	Confident	75.1	Confident	140 Å²	140	82.3 Å²	82.3	61%	0.609	40%	0.396	S	S	*	.	H	α-helix	trans	-56.2	-45.7	174.4	-73.3	176.3	-177.1	178.7	0	111.5	Q69 K70 R75 F76 T77	Q69-K73 WeakPolarHBondContact O-CG 3.31Å; Q69-K73 PolarHBondContact O-N 3.12Å; K70-K73 PolarHBondContact O-N 3.42Å; K73-R75 VanDerWaalsContact C-N 3.3Å; K73-R75 PolarHBondContact O-N 3.39Å; K73-F76 PolarHBondContact O-N 2.85Å; K73-T77 PolarHBondContact O-N 3.44Å; K73-T77 PolarHBondContact O-OG1 2.81Å
74	I	73.6	Confident	75	Confident	72 Å²	72	86.4 Å²	86.4	37%	0.369	41%	0.413	S	S	.	.	H	α-helix	trans	-61.5	-39.2	176.6	-66.1	163.6	0	0	0	111.2	K70 D71 E72 R78	K70-I74 HydrophobicContact CG-CD1 4.18Å; K70-I74 WeakPolarHBondContact O-CD1 3.44Å; K70-I74 VanDerWaalsContact O-CG1 3.23Å; K70-I74 WeakPolarHBondContact O-CG1 3.44Å; K70-I74 PolarHBondContact O-N 3.03Å; K70-I74 VanDerWaalsContact O-N 3.11Å; D71-I74 PolarHBondContact O-N 3.4Å; E72-I74 VanDerWaalsContact C-N 3.31Å; E72-I74 PolarHBondContact O-N 3.36Å; I74-R78 WeakPolarHBondContact O-CG 3.2Å; I74-R78 PolarHBondContact O-N 3.28Å; I74-R78 VanDerWaalsContact O-N 3.09Å
75	R	69.3	Low	75	Confident	44 Å²	44	92 Å²	92	17%	0.166	44%	0.437	C	S	.	.	H	α-helix	trans	-62.7	-49.2	174.4	-79.6	172.8	156.3	-142.2	-14.1	111.4	H12 D14 A46 F67 D71 E72 K73 T77 R78 M79	H12-R75 VanDerWaalsContact CB-NH2 3.32Å; H12-R75 PolarHBondContact O-NH2 3.5Å; D14-R75 IonicContact OD1-CZ 2.67Å; D14-R75 IonicContact OD1-NH2 3.94Å; D14-R75 PolarHBondContact OD1-NH2 3.47Å; A46-R75 PolarHBondContact O-NH1 3.48Å; F67-R75 VanDerWaalsContact CD2-CZ 3.45Å; D71-R75 WeakPolarHBondContact O-CB 3.48Å; D71-R75 WeakPolarHBondContact O-CG 3.3Å; D71-R75 PolarHBondContact O-N 3.4Å; E72-R75 WeakPolarHBondContact O-CA 3.28Å; E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 3.34Å; K73-R75 VanDerWaalsContact C-N 3.3Å; K73-R75 PolarHBondContact O-N 3.39Å; R75-T77 PolarHBondContact O-N 2.72Å; R75-R78 PolarHBondContact O-N 2.89Å; R75-M79 WeakPolarHBondContact O-CG 3.34Å; R75-M79 PolarHBondContact O-N 3.35Å
76	F	73.1	Confident	74.5	Confident	133 Å²	133	93 Å²	93	58%	0.583	45%	0.445	S	S	*	.	H	α-helix	trans	-59.1	-48.2	178.8	-75.9	-68.1	0	0	0	111.7	E72 K73 R78 M79 T80	E72-F76 HydrophobicContact CB-CE2 4.32Å; E72-F76 WeakPolarHBondContact O-CD2 3.32Å; E72-F76 PolarHBondContact O-N 2.96Å; K73-F76 PolarHBondContact O-N 2.85Å; F76-R78 VanDerWaalsContact C-N 3.3Å; F76-R78 PolarHBondContact O-N 3.24Å; F76-M79 PolarHBondContact O-N 3.16Å; F76-T80 WeakPolarHBondContact O-CG2 3.4Å; F76-T80 PolarHBondContact O-N 2.82Å; F76-T80 PolarHBondContact O-OG1 3.48Å
77	T	75.8	Confident	74.4	Confident	87 Å²	87	91.5 Å²	91.5	53%	0.534	45%	0.447	S	S	.	.	H	α-helix	trans	-61.9	-36.3	178.2	-51.2	0	0	0	0	112.5	K73 R75 T80 T81	K73-T77 PolarHBondContact O-N 3.44Å; K73-T77 PolarHBondContact O-OG1 2.81Å; R75-T77 PolarHBondContact O-N 2.72Å; T77-T80 PolarHBondContact O-OG1 2.9Å; T77-T81 WeakPolarHBondContact O-CG2 3.49Å; T77-T81 PolarHBondContact O-N 3.18Å; T77-T81 VanDerWaalsContact O-N 3.16Å; T77-T81 PolarHBondContact O-OG1 2.92Å
78	R	69.3	Low	74	Confident	122 Å²	122	94.5 Å²	94.5	46%	0.46	47%	0.471	S	S	.	.	H	α-helix	trans	-71.2	-41.6	176.5	-75.8	-178.2	-174	-175.8	1.1	112.6	I74 R75 F76 T80 T81 E82	I74-R78 WeakPolarHBondContact O-CG 3.2Å; I74-R78 PolarHBondContact O-N 3.28Å; I74-R78 VanDerWaalsContact O-N 3.09Å; R75-R78 PolarHBondContact O-N 2.89Å; F76-R78 VanDerWaalsContact C-N 3.3Å; F76-R78 PolarHBondContact O-N 3.24Å; R78-T80 VanDerWaalsContact C-N 3.32Å; R78-T80 PolarHBondContact O-N 3.47Å; R78-T81 WeakPolarHBondContact CA-OG1 3.36Å; R78-T81 PolarHBondContact O-N 3.03Å; R78-T81 PolarHBondContact O-OG1 3.37Å; R78-E82 WeakPolarHBondContact O-CG 3.46Å; R78-E82 PolarHBondContact O-N 3.26Å
79	M	72.3	Confident	73.6	Confident	89 Å²	89	97.4 Å²	97.4	44%	0.438	48%	0.479	S	S	.	.	H	α-helix	trans	-63.6	-38	176.8	-71	-154.1	-66	0	0	111.8	R75 F76 E82 T83	R75-M79 WeakPolarHBondContact O-CG 3.34Å; R75-M79 PolarHBondContact O-N 3.35Å; F76-M79 PolarHBondContact O-N 3.16Å; M79-E82 PolarHBondContact O-N 2.68Å; M79-T83 WeakPolarHBondContact O-CB 3.26Å; M79-T83 PolarHBondContact O-N 3.15Å; M79-T83 PolarHBondContact O-OG1 2.83Å
80	T	77	Confident	72.4	Confident	72 Å²	72	99.3 Å²	99.3	44%	0.442	49%	0.489	S	S	.	.	H	α-helix	trans	-63.7	-44.6	173.6	55.6	0	0	0	0	111.1	F76 T77 R78 E82 T83 E84	F76-T80 WeakPolarHBondContact O-CG2 3.4Å; F76-T80 PolarHBondContact O-N 2.82Å; F76-T80 PolarHBondContact O-OG1 3.48Å; T77-T80 PolarHBondContact O-OG1 2.9Å; R78-T80 VanDerWaalsContact C-N 3.32Å; R78-T80 PolarHBondContact O-N 3.47Å; T80-E82 PolarHBondContact O-N 2.89Å; T80-T83 PolarHBondContact O-N 3.47Å; T80-E84 WeakPolarHBondContact O-CB 3.47Å; T80-E84 VanDerWaalsContact O-CG 3.28Å; T80-E84 WeakPolarHBondContact O-CG 3.43Å; T80-E84 PolarHBondContact O-N 3.39Å
81	T	76.3	Confident	71.3	Confident	71 Å²	71	97.1 Å²	97.1	44%	0.436	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-36.4	177.5	56.7	0	0	0	0	113.4	T77 R78 K85	T77-T81 WeakPolarHBondContact O-CG2 3.49Å; T77-T81 PolarHBondContact O-N 3.18Å; T77-T81 VanDerWaalsContact O-N 3.16Å; T77-T81 PolarHBondContact O-OG1 2.92Å; R78-T81 WeakPolarHBondContact CA-OG1 3.36Å; R78-T81 PolarHBondContact O-N 3.03Å; R78-T81 PolarHBondContact O-OG1 3.37Å; T81-K85 VanDerWaalsContact O-CB 3.31Å; T81-K85 WeakPolarHBondContact O-CB 3.39Å; T81-K85 PolarHBondContact O-N 3.21Å
82	E	73.3	Confident	70.1	Confident	85 Å²	85	103.2 Å²	103.2	40%	0.397	52%	0.517	S	S	.	.	H	α-helix	trans	-69.8	-39.5	175	-75.6	176.3	-172	0	0	111.2	R78 M79 T80 K85 I86	R78-E82 WeakPolarHBondContact O-CG 3.46Å; R78-E82 PolarHBondContact O-N 3.26Å; M79-E82 PolarHBondContact O-N 2.68Å; T80-E82 PolarHBondContact O-N 2.89Å; E82-K85 PolarHBondContact O-N 3.39Å; E82-I86 WeakPolarHBondContact O-CD1 3.48Å; E82-I86 VanDerWaalsContact O-CG1 3.23Å; E82-I86 WeakPolarHBondContact O-CG1 3.47Å; E82-I86 PolarHBondContact O-N 3.45Å
83	T	70.6	Confident	68.7	Low	78 Å²	78	108.7 Å²	108.7	48%	0.479	54%	0.542	S	S	.	.	H	α-helix	trans	-64.5	-44.7	176.2	-52.4	0	0	0	0	110.9	M79 T80 K85 I86 I87	M79-T83 WeakPolarHBondContact O-CB 3.26Å; M79-T83 PolarHBondContact O-N 3.15Å; M79-T83 PolarHBondContact O-OG1 2.83Å; T80-T83 PolarHBondContact O-N 3.47Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 2.74Å; T83-I86 PolarHBondContact O-N 3.12Å; T83-I87 HydrophobicContact CG2-CD1 3.94Å; T83-I87 WeakPolarHBondContact O-CB 3.26Å; T83-I87 WeakPolarHBondContact O-CD1 3.49Å; T83-I87 WeakPolarHBondContact O-CG1 3.5Å; T83-I87 PolarHBondContact O-N 3.3Å
84	E	78.4	Confident	67.1	Low	121 Å²	121	107.1 Å²	107.1	57%	0.565	56%	0.555	S	S	*	*	H	α-helix	trans	-61.7	-37.9	174.3	-72.9	166.7	-169.2	0	0	112	T80 S88	T80-E84 WeakPolarHBondContact O-CB 3.47Å; T80-E84 VanDerWaalsContact O-CG 3.28Å; T80-E84 WeakPolarHBondContact O-CG 3.43Å; T80-E84 PolarHBondContact O-N 3.39Å; E84-S88 PolarHBondContact O-N 2.9Å; E84-S88 PolarHBondContact O-OG 3.01Å; E84-S88 VanDerWaalsContact O-OG 3.04Å
85	K	77.7	Confident	65.3	Low	119 Å²	119	108.4 Å²	108.4	52%	0.517	58%	0.577	S	S	.	*	H	α-helix	trans	-66.4	-45	174.6	-175.1	179.9	172.1	-173.6	0	111.9	T81 E82 T83 I87 S88 E89	T81-K85 VanDerWaalsContact O-CB 3.31Å; T81-K85 WeakPolarHBondContact O-CB 3.39Å; T81-K85 PolarHBondContact O-N 3.21Å; E82-K85 PolarHBondContact O-N 3.39Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 2.74Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.15Å; K85-S88 WeakPolarHBondContact CA-OG 3.44Å; K85-S88 PolarHBondContact O-N 3.42Å; K85-S88 PolarHBondContact O-OG 2.87Å; K85-E89 WeakPolarHBondContact CE-OE1 3.3Å; K85-E89 IonicContact NZ-OE1 2.69Å; K85-E89 WeakPolarHBondContact O-CG 3.34Å; K85-E89 PolarHBondContact O-N 3.22Å
86	I	73	Confident	63.5	Low	107 Å²	107	110.4 Å²	110.4	55%	0.549	60%	0.603	S	S	.	*	H	α-helix	trans	-63.7	-41	177.3	-67.4	162.1	0	0	0	110.8	E82 T83 S88 E89 Q90	E82-I86 WeakPolarHBondContact O-CD1 3.48Å; E82-I86 VanDerWaalsContact O-CG1 3.23Å; E82-I86 WeakPolarHBondContact O-CG1 3.47Å; E82-I86 PolarHBondContact O-N 3.45Å; T83-I86 PolarHBondContact O-N 3.12Å; I86-S88 VanDerWaalsContact C-N 3.32Å; I86-S88 PolarHBondContact O-N 2.92Å; I86-E89 PolarHBondContact O-N 3.43Å; I86-Q90 PolarHBondContact O-N 3.45Å
87	I	78.2	Confident	61.6	Low	115 Å²	115	112.2 Å²	112.2	59%	0.59	62%	0.617	S	S	*	*	H	α-helix	trans	-62.7	-38.9	175.6	-68.9	165.5	0	0	0	111	T83 K85	T83-I87 HydrophobicContact CG2-CD1 3.94Å; T83-I87 WeakPolarHBondContact O-CB 3.26Å; T83-I87 WeakPolarHBondContact O-CD1 3.49Å; T83-I87 WeakPolarHBondContact O-CG1 3.5Å; T83-I87 PolarHBondContact O-N 3.3Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.15Å
88	S	70.3	Confident	59.5	Low	82 Å²	82	113.5 Å²	113.5	57%	0.573	63%	0.626	S	S	*	*	H	α-helix	trans	-76.3	-25.4	178.5	57.2	0	0	0	0	114.2	E84 K85 I86	E84-S88 PolarHBondContact O-N 2.9Å; E84-S88 PolarHBondContact O-OG 3.01Å; E84-S88 VanDerWaalsContact O-OG 3.04Å; K85-S88 WeakPolarHBondContact CA-OG 3.44Å; K85-S88 PolarHBondContact O-N 3.42Å; K85-S88 PolarHBondContact O-OG 2.87Å; I86-S88 VanDerWaalsContact C-N 3.32Å; I86-S88 PolarHBondContact O-N 2.92Å
89	E	70.3	Confident	57.7	Low	124 Å²	124	115 Å²	115	58%	0.579	64%	0.643	S	S	*	*	H	α-helix	trans	-85.1	-9.3	176.6	-71.5	177.6	177.7	0	0	114	K85 I86	K85-E89 WeakPolarHBondContact CE-OE1 3.3Å; K85-E89 IonicContact NZ-OE1 2.69Å; K85-E89 WeakPolarHBondContact O-CG 3.34Å; K85-E89 PolarHBondContact O-N 3.22Å; I86-E89 PolarHBondContact O-N 3.43Å
90	Q	48.7	Very low	55.7	Low	142 Å²	142	119 Å²	119	66%	0.664	66%	0.662	S	S	*	*			trans	-125.4	70.9	177.4	-67.7	-94.5	-67.9	0	0	112.9	I86	I86-Q90 PolarHBondContact O-N 3.45Å
91	P	52.4	Low	53.5	Low	109 Å²	109	122.8 Å²	122.8	71%	0.708	68%	0.679	S	S	*	*			trans	-87.3	-8.2	179.2	-8.1	27.2	0	0	0	116.5
92	E	48.1	Very low	51.3	Low	186 Å²	186	123.8 Å²	123.8	87%	0.869	69%	0.694	S	S	*	*	S	Bend	trans	-132.8	44.3	-156.9	-140.7	176.7	-148.6	0	0	117.6
93	Q	41.4	Very low	49.2	Very low	185 Å²	185	128.5 Å²	128.5	86%	0.864	71%	0.714	S	S	*	*	S	Bend	trans	-126.8	15.7	166.9	-74.5	-176.6	-8.8	0	0	115
94	A	39.8	Very low	47.1	Very low	106 Å²	106	130.9 Å²	130.9	88%	0.876	73%	0.728	S	S	*	*	S	Bend	trans	-105.3	2.6	179.3	0	0	0	0	0	115.1
95	A	36.5	Very low	44.6	Very low	100 Å²	100	131.7 Å²	131.7	83%	0.826	73%	0.733	S	S	*	*			trans	-140.5	64.2	-173.2	0	0	0	0	0	113.9
96	A	31	Very low	42.3	Very low	86 Å²	86	131.5 Å²	131.5	71%	0.711	74%	0.742	S	S	*	*			trans	-153.4	94.3	154	0	0	0	0	0	108.8	P98	A96-P98 WeakPolarHBondContact O-CD 3.33Å
97	I	32.9	Very low	40	Very low	171 Å²	171	133.8 Å²	133.8	88%	0.877	76%	0.756	S	S	*	*			trans	-95.9	107.9	156.9	-58.9	172.1	0	0	0	104.6
98	P	32.2	Very low	37.5	Very low	113 Å²	113	135.4 Å²	135.4	73%	0.734	77%	0.765	S	S	*	*			trans	-104.5	141.9	158.6	3.3	17.9	0	0	0	110.1	A96	A96-P98 WeakPolarHBondContact O-CD 3.33Å
99	D	32.4	Very low	35.3	Very low	153 Å²	153	140.3 Å²	140.3	82%	0.818	78%	0.779	S	S	*	*			trans	-57.5	157.4	-166.1	-72.5	-53.2	0	0	0	117	N101	D99-N101 PolarHBondContact O-N 3.36Å
100	E	30	Very low	33.5	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	79%	0.793	S	S	*	*			trans	-40.9	115.7	158.3	-56.9	-171.2	157.4	0	0	112.5
101	N	29.8	Very low	32.5	Very low	150 Å²	150	140 Å²	140	80%	0.802	80%	0.797	S	S	*	*				172	131.7	117.9	-88.4	-41	0	0	0	112.6	D99	D99-N101 PolarHBondContact O-N 3.36Å
102	A	29.6	Very low	31.4	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	80%	0.798	S	S	*	*			trans	64.6	94	150.9	0	0	0	0	0	119
103	F	29	Very low	30.6	Very low	185 Å²	185	139.1 Å²	139.1	81%	0.811	80%	0.801	S	S	*	*				-151.8	97.9	123	-147.2	-107.5	0	0	0	111.4	M105	F103-M105 HydrophobicContact CD1-CB 4.2Å; F103-M105 HydrophobicContact CD1-CG 4.05Å; F103-M105 HydrophobicContact CE1-CB 3.97Å; F103-M105 HydrophobicContact CE1-CG 3.43Å; F103-M105 VanDerWaalsContact CE1-CG 3.43Å; F103-M105 HydrophobicContact CZ-CG 4.09Å; F103-M105 PolarHBondContact O-N 3.41Å
104	V	26.9	Very low	30.1	Very low	128 Å²	128	139 Å²	139	78%	0.776	80%	0.801	S	S	*	*			trans	-70.8	114	158.9	169.8	0	0	0	0	106.8
105	M	27.2	Very low	29.7	Very low	138 Å²	138	137.6 Å²	137.6	68%	0.68	79%	0.789	S	S	*	*			trans	-147.7	105.3	147.1	-83.3	-52.9	171	0	0	109.6	F103	F103-M105 HydrophobicContact CD1-CB 4.2Å; F103-M105 HydrophobicContact CD1-CG 4.05Å; F103-M105 HydrophobicContact CE1-CB 3.97Å; F103-M105 HydrophobicContact CE1-CG 3.43Å; F103-M105 VanDerWaalsContact CE1-CG 3.43Å; F103-M105 HydrophobicContact CZ-CG 4.09Å; F103-M105 PolarHBondContact O-N 3.41Å
106	T	27.8	Very low	29.7	Very low	114 Å²	114	141.2 Å²	141.2	70%	0.699	79%	0.793	S	S	*	*			trans	28.4	119.1	138.5	54.9	0	0	0	0	119.5	D108	T106-D108 PolarHBondContact O-N 2.95Å
107	N	24.9	Very low	29.7	Very low	156 Å²	156	141.4 Å²	141.4	83%	0.834	79%	0.786	S	S	*	*			trans	-25	119.6	142.7	-70.2	-22.4	0	0	0	111.8
108	D	26.2	Very low	29.9	Very low	148 Å²	148	137.9 Å²	137.9	79%	0.791	77%	0.768	S	S	*	*			trans	-169.4	135.5	133.8	-93.5	-31	0	0	0	110	T106	T106-D108 PolarHBondContact O-N 2.95Å
109	Q	25	Very low	30.2	Very low	185 Å²	185	136.5 Å²	136.5	86%	0.864	76%	0.76	S	S	*	*			trans	77.3	83	158.8	-61.2	168.3	-6.5	0	0	118.1
110	V	31	Very low	30.2	Very low	142 Å²	142	134.5 Å²	134.5	86%	0.861	75%	0.749	S	S	*	*			trans	-119.9	134.4	140.1	178.2	0	0	0	0	107.8
111	P	27.9	Very low	30.2	Very low	117 Å²	117	132.9 Å²	132.9	76%	0.76	74%	0.741	S	S	*	*			trans	-73.6	146.1	-158.4	-12.1	28.5	0	0	0	112.6	D113	P111-D113 PolarHBondContact O-N 3.39Å
112	S	28.9	Very low	30.1	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	74%	0.738	S	S	*	*			trans	-29.4	123.8	170.6	-33.5	0	0	0	0	114.1	E114	S112-E114 VanDerWaalsContact C-N 3.27Å; S112-E114 PolarHBondContact O-N 3.47Å
113	D	31.6	Very low	30.2	Very low	174 Å²	174	131 Å²	131	93%	0.93	73%	0.725	S	S	*	*			trans	-44.6	87.7	154.2	-90.2	-43.2	0	0	0	110.7	P111	P111-D113 PolarHBondContact O-N 3.39Å
114	E	32.4	Very low	30.2	Very low	183 Å²	183	125.9 Å²	125.9	86%	0.855	71%	0.712	S	S	*	*			trans	-96.8	111	166.7	-95.2	178.2	162.4	0	0	109.8	S112	S112-E114 VanDerWaalsContact C-N 3.27Å; S112-E114 PolarHBondContact O-N 3.47Å
115	A	30.7	Very low	30.2	Very low	76 Å²	76	124.4 Å²	124.4	63%	0.628	71%	0.707	S	S	*	*			trans	81.6	62.2	157.8	0	0	0	0	0	117.2	T117	A115-T117 PolarHBondContact O-N 3.06Å; A115-T117 PolarHBondContact O-OG1 2.98Å
116	L	35.3	Very low	30.2	Very low	175 Å²	175	121.8 Å²	121.8	92%	0.916	70%	0.703	S	S	*	*			trans	-62.8	78.7	135.7	-170.9	72.1	0	0	0	107.6	D118	L116-D118 PolarHBondContact O-N 3.37Å
117	T	31.8	Very low	30.2	Very low	91 Å²	91	124.2 Å²	124.2	56%	0.558	70%	0.7	S	S	*	*			trans	-61.1	123.2	178.5	-56.4	0	0	0	0	107.8	A115	A115-T117 PolarHBondContact O-N 3.06Å; A115-T117 PolarHBondContact O-OG1 2.98Å
118	D	36.3	Very low	30.3	Very low	96 Å²	96	123.4 Å²	123.4	51%	0.513	70%	0.696	S	S	.	*			trans	-20.1	115.7	177.2	-170.5	-4.9	0	0	0	114.9	L116 D120 Q121	L116-D118 PolarHBondContact O-N 3.37Å; D118-D120 PolarHBondContact O-N 3.17Å; D118-D120 PolarHBondContact OD1-N 3.26Å; D118-Q121 PolarHBondContact O-N 2.96Å; D118-Q121 VanDerWaalsContact O-N 3.16Å
119	P	38.5	Very low	30.2	Very low	84 Å²	84	126.7 Å²	126.7	55%	0.545	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.7	-10.4	-175.6	23.1	-32.6	0	0	0	114.6	Q121 C122 I123	P119-Q121 VanDerWaalsContact C-N 3.26Å; P119-Q121 PolarHBondContact O-N 3.08Å; P119-C122 PolarHBondContact O-N 2.66Å; P119-I123 WeakPolarHBondContact O-CG1 3.5Å
120	D	32.4	Very low	30.2	Very low	111 Å²	111	125.3 Å²	125.3	59%	0.594	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-23.2	174.6	-81.6	-10.6	0	0	0	113.3	D118 I123	D118-D120 PolarHBondContact O-N 3.17Å; D118-D120 PolarHBondContact OD1-N 3.26Å; D120-I123 PolarHBondContact O-N 3.21Å; D120-I123 WeakPolarHBondContact OD1-CD1 3.47Å
121	Q	30.1	Very low	29.9	Very low	141 Å²	141	123.5 Å²	123.5	66%	0.659	69%	0.689	S	S	*	*	H	α-helix	trans	-73.9	-31	176.3	-74.9	-156.8	23.9	0	0	113.7	D118 P119 I123 S124	D118-Q121 PolarHBondContact O-N 2.96Å; D118-Q121 VanDerWaalsContact O-N 3.16Å; P119-Q121 VanDerWaalsContact C-N 3.26Å; P119-Q121 PolarHBondContact O-N 3.08Å; Q121-I123 PolarHBondContact O-N 2.94Å; Q121-S124 PolarHBondContact O-N 3.43Å
122	C	29	Very low	29.9	Very low	108 Å²	108	124 Å²	124	73%	0.73	69%	0.693	S	S	*	*	H	α-helix	trans	-69.9	-15.7	177.2	-66.5	0	0	0	0	113	P119	P119-C122 PolarHBondContact O-N 2.66Å
123	I	32	Very low	29.8	Very low	96 Å²	96	123.3 Å²	123.3	49%	0.492	69%	0.693	S	S	.	*	H	α-helix	trans	-84.4	-23.7	177.9	-22.4	175.2	0	0	0	111.1	P119 D120 Q121 Y127	P119-I123 WeakPolarHBondContact O-CG1 3.5Å; D120-I123 PolarHBondContact O-N 3.21Å; D120-I123 WeakPolarHBondContact OD1-CD1 3.47Å; Q121-I123 PolarHBondContact O-N 2.94Å; I123-Y127 HydrophobicContact CG2-CE2 4.49Å; I123-Y127 VanDerWaalsContact O-CD2 3.24Å; I123-Y127 WeakPolarHBondContact O-CD2 3.46Å
124	S	27.7	Very low	29.6	Very low	76 Å²	76	119.1 Å²	119.1	53%	0.531	68%	0.683	S	S	.	*	H	α-helix	trans	-77.6	-35.4	-173.2	153.6	0	0	0	0	114.2	Q121 S126 Y127	Q121-S124 PolarHBondContact O-N 3.43Å; S124-S126 VanDerWaalsContact C-N 3.26Å; S124-S126 PolarHBondContact O-N 2.9Å; S124-Y127 PolarHBondContact O-N 3.05Å; S124-Y127 VanDerWaalsContact O-N 3.12Å
125	S	27.6	Very low	29.3	Very low	98 Å²	98	119.4 Å²	119.4	69%	0.685	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-5.2	-171.3	68.3	0	0	0	0	115.5
126	S	26.2	Very low	29.1	Very low	83 Å²	83	122.4 Å²	122.4	58%	0.58	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	2	170.5	-61	0	0	0	0	113.4	S124	S124-S126 VanDerWaalsContact C-N 3.26Å; S124-S126 PolarHBondContact O-N 2.9Å
127	Y	27.7	Very low	28.6	Very low	165 Å²	165	123.8 Å²	123.8	65%	0.647	68%	0.678	S	S	*	*			trans	-121.1	32.1	-174.1	-75.3	-73.2	0	0	0	114.8	I123 S124	I123-Y127 HydrophobicContact CG2-CE2 4.49Å; I123-Y127 VanDerWaalsContact O-CD2 3.24Å; I123-Y127 WeakPolarHBondContact O-CD2 3.46Å; S124-Y127 PolarHBondContact O-N 3.05Å; S124-Y127 VanDerWaalsContact O-N 3.12Å
128	D	28.8	Very low	28.2	Very low	139 Å²	139	125.8 Å²	125.8	74%	0.743	69%	0.69	S	S	*	*	S	Bend	trans	-96.7	3.5	169.2	-83.4	-15.7	0	0	0	114.7
129	Y	23.4	Very low	27.7	Very low	217 Å²	217	126.8 Å²	126.8	85%	0.851	70%	0.701	S	S	*	*	S	Bend	trans	-120.1	87.5	166.7	-78.2	-86.5	0	0	0	109.7
130	I	25.9	Very low	27	Very low	156 Å²	156	133.3 Å²	133.3	80%	0.8	72%	0.715	S	S	*	*			trans	170.6	71.6	133.2	-71.5	145.1	0	0	0	104.6
131	S	22.8	Very low	26.6	Very low	104 Å²	104	135 Å²	135	73%	0.727	72%	0.724	S	S	*	*			trans	-97.1	105.2	150.8	-73.4	0	0	0	0	105.7	A133	S131-A133 PolarHBondContact O-N 2.91Å
132	P	29.5	Very low	26.6	Very low	128 Å²	128	137.5 Å²	137.5	83%	0.831	74%	0.736	S	S	*	*			trans	-79.1	77.8	171.5	32.6	-28.3	0	0	0	106.8
133	A	25.2	Very low	26.4	Very low	88 Å²	88	139.6 Å²	139.6	73%	0.727	75%	0.745	S	S	*	*			trans	-128.7	77.6	176.8	0	0	0	0	0	108.4	S131	S131-A133 PolarHBondContact O-N 2.91Å
134	A	27.4	Very low	26.3	Very low	87 Å²	87	138.9 Å²	138.9	72%	0.719	75%	0.754	S	S	*	*			trans	178.7	105.2	143.6	0	0	0	0	0	109
135	E	26	Very low	26.4	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	77%	0.771	S	S	*	*			trans	63.7	126.1	137.5	-53.1	-174.6	171	0	0	116.8
136	E	26.7	Very low	26.5	Very low	138 Å²	138	141.1 Å²	141.1	65%	0.645	78%	0.776	S	S	*	*				-173.2	137.8	57.9	-176.5	168.7	-168.9	0	0	110.3
137	R	24.9	Very low	26.7	Very low	205 Å²	205	148 Å²	148	77%	0.774	79%	0.789	S	S	*	*			trans	63.7	99.9	158.4	-71.6	170.6	-151.6	-145	9	119.4	P139	R137-P139 WeakPolarHBondContact O-CD 3.38Å
138	V	23.9	Very low	26.8	Very low	133 Å²	133	147.1 Å²	147.1	81%	0.806	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.4	119	144.3	174.4	0	0	0	0	108.9
139	P	26.5	Very low	27.5	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83.3	123.2	146.5	-4.8	23.8	0	0	0	108.2	R137	R137-P139 WeakPolarHBondContact O-CD 3.38Å
140	R	22.7	Very low	28.3	Very low	221 Å²	221	137 Å²	137	83%	0.834	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-57.5	158	171.1	-102.7	176.1	173.4	170.2	-2.5	111.9
141	N	24.9	Very low	28.8	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	76%	0.756	S	S	*	*			trans	95.5	111.8	171.1	-46.4	-19.5	0	0	0	109.8
142	E	28.9	Very low	29.6	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	75%	0.754	S	S	*	*				-153	150.2	62.4	-76.7	168.5	176.9	0	0	113.3	A144	E142-A144 PolarHBondContact O-N 3.1Å
143	T	25	Very low	30	Very low	151 Å²	151	134.7 Å²	134.7	93%	0.926	74%	0.735	S	S	*	*			trans	-65.4	112.1	174.6	-39.8	0	0	0	0	111.5
144	A	30.9	Very low	31	Very low	82 Å²	82	134.6 Å²	134.6	68%	0.678	73%	0.725	S	S	*	*			trans	-166.1	107	153.2	0	0	0	0	0	110.8	E142 G146	E142-A144 PolarHBondContact O-N 3.1Å; A144-G146 PolarHBondContact O-N 3Å
145	T	29.7	Very low	31.5	Very low	143 Å²	143	136.4 Å²	136.4	88%	0.877	72%	0.722	S	S	*	*			trans	12.4	103.6	144	48.6	0	0	0	0	116.3
146	G	29.7	Very low	32.2	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	70%	0.698	S	S	*	*			trans	-63.9	141.7	169.4	0	0	0	0	0	112.1	A144	A144-G146 PolarHBondContact O-N 3Å
147	R	30.7	Very low	33.1	Very low	228 Å²	228	131.7 Å²	131.7	86%	0.86	69%	0.694	S	S	*	*			trans	-166.6	118	151.1	-152.8	160.9	-126.8	-128.6	1.1	111.9
148	L	29	Very low	33.9	Very low	147 Å²	147	124.9 Å²	124.9	77%	0.77	67%	0.671	S	S	*	*			trans	55.6	88.8	152.3	-58	169.7	0	0	0	117.2	S150	L148-S150 PolarHBondContact O-N 2.81Å; L148-S150 VanDerWaalsContact O-N 3.12Å
149	T	43.6	Very low	34.8	Very low	79 Å²	79	123.6 Å²	123.6	49%	0.485	66%	0.659	S	S	.	*			trans	-61.3	112	152.2	54.1	0	0	0	0	107.7	Q153	T149-Q153 VanDerWaalsContact CG2-OE1 3.28Å
150	S	41.2	Very low	35.6	Very low	65 Å²	65	126.4 Å²	126.4	46%	0.455	66%	0.655	S	S	.	*			trans	-54.4	147.6	177.9	63.7	0	0	0	0	109.8	L148 R152 Q153	L148-S150 PolarHBondContact O-N 2.81Å; L148-S150 VanDerWaalsContact O-N 3.12Å; S150-R152 PolarHBondContact O-N 3.22Å; S150-Q153 PolarHBondContact O-N 3.22Å
151	G	36	Very low	36.6	Very low	61 Å²	61	121 Å²	121	63%	0.629	64%	0.639	S	S	*	*	H	α-helix	trans	-52.2	-23.3	-177.9	0	0	0	0	0	113.9	V154 L155	G151-V154 PolarHBondContact O-N 3.06Å; G151-L155 PolarHBondContact O-N 2.79Å; G151-L155 VanDerWaalsContact O-N 3.16Å
152	R	38.4	Very low	37.4	Very low	183 Å²	183	116.1 Å²	116.1	69%	0.691	61%	0.613	S	S	*	*	H	α-helix	trans	-61.1	-41.9	171.6	-172.2	176.5	178.3	173.3	9.2	113.6	S150 V154 L155 E156	S150-R152 PolarHBondContact O-N 3.22Å; R152-V154 VanDerWaalsContact C-N 3.35Å; R152-V154 PolarHBondContact O-N 3.37Å; R152-L155 PolarHBondContact O-N 2.83Å; R152-E156 HydrophobicContact CG-CG 4.46Å; R152-E156 WeakPolarHBondContact CG-OE1 3.39Å; R152-E156 IonicContact CZ-OE1 3.76Å; R152-E156 IonicContact NE-OE1 2.93Å; R152-E156 PolarHBondContact NE-OE1 3.47Å; R152-E156 IonicContact NH2-OE1 3.85Å; R152-E156 WeakPolarHBondContact O-CB 3.08Å; R152-E156 WeakPolarHBondContact O-CG 3.44Å; R152-E156 PolarHBondContact O-N 3.22Å
153	Q	39.7	Very low	37.9	Very low	94 Å²	94	112.2 Å²	112.2	44%	0.439	60%	0.595	S	S	.	*	H	α-helix	trans	-69.7	-31.6	179.2	-70.6	179.7	-7.5	0	0	112.7	T149 S150 R157	T149-Q153 VanDerWaalsContact CG2-OE1 3.28Å; S150-Q153 PolarHBondContact O-N 3.22Å; Q153-R157 WeakPolarHBondContact O-CB 3.41Å; Q153-R157 PolarHBondContact O-N 3.25Å
154	V	45	Very low	38.8	Very low	86 Å²	86	107.7 Å²	107.7	52%	0.521	57%	0.573	S	S	.	*	H	α-helix	trans	-67.6	-46	174.1	179	0	0	0	0	109.7	G151 R152 R157 H158	G151-V154 PolarHBondContact O-N 3.06Å; R152-V154 VanDerWaalsContact C-N 3.35Å; R152-V154 PolarHBondContact O-N 3.37Å; V154-R157 PolarHBondContact O-N 3.17Å; V154-H158 WeakPolarHBondContact O-CB 3.32Å; V154-H158 PolarHBondContact O-N 3.06Å
155	L	38.2	Very low	39.4	Very low	126 Å²	126	106.2 Å²	106.2	66%	0.66	56%	0.56	S	S	*	*	H	α-helix	trans	-63.3	-44.5	178	-138.8	90	0	0	0	111.9	G151 R152 R157 H158 D159	G151-L155 PolarHBondContact O-N 2.79Å; G151-L155 VanDerWaalsContact O-N 3.16Å; R152-L155 PolarHBondContact O-N 2.83Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 2.9Å; L155-H158 PolarHBondContact O-N 3.01Å; L155-D159 WeakPolarHBondContact O-CB 3.44Å; L155-D159 PolarHBondContact O-N 3.28Å
156	E	41.1	Very low	39.7	Very low	81 Å²	81	102.3 Å²	102.3	38%	0.379	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-35.4	178.6	-76.6	173.6	-172.3	0	0	112.4	R152 R160	R152-E156 HydrophobicContact CG-CG 4.46Å; R152-E156 WeakPolarHBondContact CG-OE1 3.39Å; R152-E156 IonicContact CZ-OE1 3.76Å; R152-E156 IonicContact NE-OE1 2.93Å; R152-E156 PolarHBondContact NE-OE1 3.47Å; R152-E156 IonicContact NH2-OE1 3.85Å; R152-E156 WeakPolarHBondContact O-CB 3.08Å; R152-E156 WeakPolarHBondContact O-CG 3.44Å; R152-E156 PolarHBondContact O-N 3.22Å; E156-R160 WeakPolarHBondContact O-CG 3.12Å; E156-R160 PolarHBondContact O-N 3.45Å; E156-R160 VanDerWaalsContact O-N 3.16Å
157	R	44.9	Very low	40	Very low	146 Å²	146	102.6 Å²	102.6	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-67.3	-41.4	173.7	-158.6	-175.6	-62.4	177	-0.5	110.8	Q153 V154 L155 R160 E161	Q153-R157 WeakPolarHBondContact O-CB 3.41Å; Q153-R157 PolarHBondContact O-N 3.25Å; V154-R157 PolarHBondContact O-N 3.17Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 2.9Å; R157-R160 PolarHBondContact O-N 3.14Å; R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.46Å
158	H	42.2	Very low	40.5	Very low	62 Å²	62	94.8 Å²	94.8	29%	0.287	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-40.3	178.4	-143.5	59.5	0	0	0	112.4	H59 V154 L155 R160 E161 I162	H59-H158 AromaticContact NE2-NE2 3.9Å; V154-H158 WeakPolarHBondContact O-CB 3.32Å; V154-H158 PolarHBondContact O-N 3.06Å; L155-H158 PolarHBondContact O-N 3.01Å; H158-R160 VanDerWaalsContact C-N 3.33Å; H158-R160 PolarHBondContact O-N 3.32Å; H158-E161 IonicContact ND1-OE2 3.5Å; H158-E161 PolarHBondContact O-N 3.28Å; H158-I162 VanDerWaalsContact O-CG1 3.28Å; H158-I162 WeakPolarHBondContact O-CG1 3.47Å; H158-I162 PolarHBondContact O-N 3.48Å
159	D	42.3	Very low	40.8	Very low	106 Å²	106	92.6 Å²	92.6	57%	0.567	49%	0.487	S	S	*	.	H	α-helix	trans	-63.5	-39.4	176.3	-159.3	51	0	0	0	111.3	L155 I162 Q163	L155-D159 WeakPolarHBondContact O-CB 3.44Å; L155-D159 PolarHBondContact O-N 3.28Å; D159-I162 PolarHBondContact O-N 3.19Å; D159-Q163 WeakPolarHBondContact O-CB 3.42Å; D159-Q163 PolarHBondContact O-N 3.33Å
160	R	43	Very low	40.2	Very low	175 Å²	175	95.7 Å²	95.7	66%	0.66	50%	0.496	S	S	*	.	H	α-helix	trans	-64.6	-40.6	172.6	-74.8	-177.2	-169	154.7	6.1	113.2	E156 R157 H158 Q163 A164	E156-R160 WeakPolarHBondContact O-CG 3.12Å; E156-R160 PolarHBondContact O-N 3.45Å; E156-R160 VanDerWaalsContact O-N 3.16Å; R157-R160 PolarHBondContact O-N 3.14Å; H158-R160 VanDerWaalsContact C-N 3.33Å; H158-R160 PolarHBondContact O-N 3.32Å; R160-Q163 PolarHBondContact O-N 3.41Å; R160-A164 WeakPolarHBondContact O-CB 3.07Å; R160-A164 PolarHBondContact O-N 2.97Å
161	E	45.1	Very low	39.8	Very low	107 Å²	107	101.8 Å²	101.8	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-42	176.6	-74.1	167.5	-171.1	0	0	111.3	R157 H158 A164 A165	R157-E161 WeakPolarHBondContact O-CG 3.39Å; R157-E161 PolarHBondContact O-N 3.46Å; H158-E161 IonicContact ND1-OE2 3.5Å; H158-E161 PolarHBondContact O-N 3.28Å; E161-A164 PolarHBondContact O-N 3.33Å; E161-A165 WeakPolarHBondContact O-CB 3.24Å; E161-A165 PolarHBondContact O-N 2.95Å
162	I	41.1	Very low	39.7	Very low	46 Å²	46	104.4 Å²	104.4	24%	0.236	51%	0.508	C	S	.	.	H	α-helix	trans	-62.7	-46.6	174.5	-68	166.3	0	0	0	110.4	H158 D159 A164 A165 C166 L330	H158-I162 VanDerWaalsContact O-CG1 3.28Å; H158-I162 WeakPolarHBondContact O-CG1 3.47Å; H158-I162 PolarHBondContact O-N 3.48Å; D159-I162 PolarHBondContact O-N 3.19Å; I162-A164 VanDerWaalsContact C-N 3.3Å; I162-A164 PolarHBondContact O-N 2.98Å; I162-A165 PolarHBondContact O-N 3.29Å; I162-C166 WeakPolarHBondContact O-CB 2.75Å; I162-C166 PolarHBondContact O-N 2.87Å; I162-C166 PolarHBondContact O-SG 3.47Å; I162-C166 VanDerWaalsContact O-SG 3.39Å; I162-L330 HydrophobicContact CD1-CD2 4.11Å
163	Q	40.3	Very low	39.3	Very low	112 Å²	112	101.7 Å²	101.7	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-38.4	179.7	-154.6	175.8	24.1	0	0	111.4	D159 R160 Q167	D159-Q163 WeakPolarHBondContact O-CB 3.42Å; D159-Q163 PolarHBondContact O-N 3.33Å; R160-Q163 PolarHBondContact O-N 3.41Å; Q163-Q167 WeakPolarHBondContact O-CB 3.45Å; Q163-Q167 WeakPolarHBondContact O-CG 3.45Å; Q163-Q167 PolarHBondContact O-N 3.03Å
164	A	43.9	Very low	38.6	Very low	56 Å²	56	108.1 Å²	108.1	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-42.3	174.8	0	0	0	0	0	112.5	R160 E161 I162 Q167 S168	R160-A164 WeakPolarHBondContact O-CB 3.07Å; R160-A164 PolarHBondContact O-N 2.97Å; E161-A164 PolarHBondContact O-N 3.33Å; I162-A164 VanDerWaalsContact C-N 3.3Å; I162-A164 PolarHBondContact O-N 2.98Å; A164-Q167 PolarHBondContact O-N 2.92Å; A164-S168 WeakPolarHBondContact O-CB 3.49Å; A164-S168 PolarHBondContact O-N 3.26Å
165	A	42.1	Very low	37.9	Very low	51 Å²	51	111.4 Å²	111.4	42%	0.421	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-45.5	176.1	0	0	0	0	0	111.6	E161 I162 Q167 S168 I169	E161-A165 WeakPolarHBondContact O-CB 3.24Å; E161-A165 PolarHBondContact O-N 2.95Å; I162-A165 PolarHBondContact O-N 3.29Å; A165-Q167 PolarHBondContact O-N 3.31Å; A165-S168 WeakPolarHBondContact O-CB 3.5Å; A165-S168 PolarHBondContact O-N 2.86Å; A165-I169 VanDerWaalsContact O-CG1 3.3Å; A165-I169 WeakPolarHBondContact O-CG1 3.48Å; A165-I169 PolarHBondContact O-N 2.66Å
166	C	36.4	Very low	37.3	Very low	60 Å²	60	111.2 Å²	111.2	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-61.8	-42.2	175	-71.2	0	0	0	0	112	I162 I169 H170	I162-C166 WeakPolarHBondContact O-CB 2.75Å; I162-C166 PolarHBondContact O-N 2.87Å; I162-C166 PolarHBondContact O-SG 3.47Å; I162-C166 VanDerWaalsContact O-SG 3.39Å; C166-I169 PolarHBondContact O-N 2.89Å; C166-H170 PolarHBondContact O-CD2 2.67Å; C166-H170 PolarHBondContact O-N 2.71Å
167	Q	36.7	Very low	36.5	Very low	83 Å²	83	112.7 Å²	112.7	39%	0.388	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-36	175.9	-74.9	177.2	16.2	0	0	112.5	Q163 A164 A165 I169 H170 R171	Q163-Q167 WeakPolarHBondContact O-CB 3.45Å; Q163-Q167 WeakPolarHBondContact O-CG 3.45Å; Q163-Q167 PolarHBondContact O-N 3.03Å; A164-Q167 PolarHBondContact O-N 2.92Å; A165-Q167 PolarHBondContact O-N 3.31Å; Q167-I169 VanDerWaalsContact C-N 3.35Å; Q167-H170 PolarHBondContact O-N 3.05Å; Q167-R171 WeakPolarHBondContact O-CB 3.43Å; Q167-R171 WeakPolarHBondContact O-CG 3.22Å; Q167-R171 PolarHBondContact O-N 3.24Å
168	S	40.1	Very low	35.6	Very low	64 Å²	64	117.5 Å²	117.5	45%	0.448	58%	0.577	S	S	.	*	H	α-helix	trans	-63.6	-41.6	174	-175.2	0	0	0	0	111.4	A164 A165 H170 R171 N172	A164-S168 WeakPolarHBondContact O-CB 3.49Å; A164-S168 PolarHBondContact O-N 3.26Å; A165-S168 WeakPolarHBondContact O-CB 3.5Å; A165-S168 PolarHBondContact O-N 2.86Å; S168-H170 VanDerWaalsContact C-N 3.34Å; S168-H170 PolarHBondContact O-N 3.35Å; S168-R171 PolarHBondContact O-N 3.48Å; S168-N172 PolarHBondContact O-N 3.41Å; S168-N172 PolarHBondContact O-ND2 2.91Å
169	I	35.9	Very low	34.6	Very low	101 Å²	101	124.2 Å²	124.2	52%	0.518	61%	0.605	S	S	.	*	H	α-helix	trans	-63	-40.8	174.3	-65.3	163.9	0	0	0	111	A165 C166 Q167	A165-I169 VanDerWaalsContact O-CG1 3.3Å; A165-I169 WeakPolarHBondContact O-CG1 3.48Å; A165-I169 PolarHBondContact O-N 2.66Å; C166-I169 PolarHBondContact O-N 2.89Å; Q167-I169 VanDerWaalsContact C-N 3.35Å
170	H	30.7	Very low	33.6	Very low	144 Å²	144	130 Å²	130	67%	0.667	62%	0.619	S	S	*	*	H	α-helix	trans	-72.6	-35.2	178.6	-81.5	-65.7	0	0	0	114	C166 Q167 S168 N172	C166-H170 PolarHBondContact O-CD2 2.67Å; C166-H170 PolarHBondContact O-N 2.71Å; Q167-H170 PolarHBondContact O-N 3.05Å; S168-H170 VanDerWaalsContact C-N 3.34Å; S168-H170 PolarHBondContact O-N 3.35Å; H170-N172 VanDerWaalsContact C-N 3.34Å
171	R	32.4	Very low	32.7	Very low	194 Å²	194	127 Å²	127	73%	0.732	63%	0.625	S	S	*	*	H	α-helix	trans	-71.3	-28.7	179.9	-75.5	-179.6	-167.2	170.2	7.2	113.2	Q167 S168 H173	Q167-R171 WeakPolarHBondContact O-CB 3.43Å; Q167-R171 WeakPolarHBondContact O-CG 3.22Å; Q167-R171 PolarHBondContact O-N 3.24Å; S168-R171 PolarHBondContact O-N 3.48Å; R171-H173 VanDerWaalsContact C-N 3.27Å; R171-H173 PolarHBondContact O-N 2.82Å
172	N	33.4	Very low	31.8	Very low	115 Å²	115	127.2 Å²	127.2	62%	0.615	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	11.6	-178.4	-64	-22	0	0	0	113.2	S168 H170 W174	S168-N172 PolarHBondContact O-N 3.41Å; S168-N172 PolarHBondContact O-ND2 2.91Å; H170-N172 VanDerWaalsContact C-N 3.34Å; N172-W174 PolarHBondContact O-N 3.31Å
173	H	31.6	Very low	30.9	Very low	127 Å²	127	132.2 Å²	132.2	59%	0.588	66%	0.664	S	S	*	*			trans	-97.4	43.4	-170.8	-133.8	-68.1	0	0	0	113.9	R171	R171-H173 VanDerWaalsContact C-N 3.27Å; R171-H173 PolarHBondContact O-N 2.82Å
174	W	24.6	Very low	30.2	Very low	229 Å²	229	131.9 Å²	131.9	87%	0.867	67%	0.672	S	S	*	*	S	Bend	trans	-141.8	117.6	159.1	-64.2	95.8	0	0	0	107.8	N172	N172-W174 PolarHBondContact O-N 3.31Å
175	D	29.9	Very low	29.1	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	69%	0.69	S	S	*	*	S	Bend	trans	66	65.1	168.8	-59.5	-27.1	0	0	0	119.8
176	V	25.6	Very low	27.9	Very low	123 Å²	123	142.8 Å²	142.8	75%	0.745	71%	0.709	S	S	*	*			trans	-145.8	118.1	144.5	-133.9	0	0	0	0	111.9	W178	V176-W178 PolarHBondContact O-N 2.94Å
177	P	25.2	Very low	27.1	Very low	111 Å²	111	145.5 Å²	145.5	72%	0.721	73%	0.727	S	S	*	*			trans	-72.3	115.4	174.2	27.5	-28.9	0	0	0	109.2	K179	P177-K179 PolarHBondContact O-N 3.4Å
178	W	24.2	Very low	26.4	Very low	248 Å²	248	149.4 Å²	149.4	94%	0.939	75%	0.746	S	S	*	*			trans	-5.2	84	163	-55.1	78.3	0	0	0	114.9	V176 R180	V176-W178 PolarHBondContact O-N 2.94Å; W178-R180 PolarHBondContact O-N 3.34Å
179	K	21.4	Very low	25.4	Very low	203 Å²	203	156 Å²	156	88%	0.883	77%	0.766	S	S	*	*			trans	-70.4	113	161.9	-85	-169.3	177	-177.7	0	107.3	P177 S181	P177-K179 PolarHBondContact O-N 3.4Å; K179-S181 PolarHBondContact O-N 3.16Å
180	R	22.4	Very low	24.8	Very low	228 Å²	228	161.5 Å²	161.5	86%	0.86	78%	0.782	S	S	*	*			trans	-55.9	104.5	173.2	-64.3	179	-178.1	-149.5	1.8	109.8	W178	W178-R180 PolarHBondContact O-N 3.34Å
181	S	24	Very low	24.3	Very low	112 Å²	112	160.2 Å²	160.2	78%	0.783	78%	0.784	S	S	*	*			trans	-112.1	124.3	145.9	64.7	0	0	0	0	104.5	K179	K179-S181 PolarHBondContact O-N 3.16Å
182	S	25.7	Very low	24	Very low	111 Å²	111	156.8 Å²	156.8	78%	0.776	79%	0.787	S	S	*	*			cis	-158.5	118.9	31.9	36.1	0	0	0	0	106
183	L	23.1	Very low	23.5	Very low	150 Å²	150	160.1 Å²	160.1	79%	0.785	80%	0.796	S	S	*	*			trans	-78.8	133.5	166.2	-76.7	166.1	0	0	0	107.8
184	P	23.9	Very low	23.2	Very low	105 Å²	105	161.3 Å²	161.3	68%	0.682	81%	0.806	S	S	*	*			trans	-74.6	125.7	164.2	30.8	-27.6	0	0	0	108.4	C186	P184-C186 PolarHBondContact O-N 2.97Å
185	Y	21.1	Very low	23.2	Very low	217 Å²	217	158 Å²	158	85%	0.851	81%	0.806	S	S	*	*			trans	10.8	99.4	155.1	-88.9	-103.5	0	0	0	116.2	C187	Y185-C187 PolarHBondContact O-N 3.39Å
186	C	18.5	Very low	23	Very low	119 Å²	119	157 Å²	157	80%	0.804	81%	0.805	S	S	*	*			trans	-73.5	106.8	143.1	-80.2	0	0	0	0	106.8	P184 E188	P184-C186 PolarHBondContact O-N 2.97Å; C186-E188 PolarHBondContact O-N 3.42Å
187	C	18.6	Very low	23.1	Very low	118 Å²	118	158.9 Å²	158.9	80%	0.797	81%	0.81	S	S	*	*			trans	-68.6	81	162.5	-69.1	0	0	0	0	108.4	Y185	Y185-C187 PolarHBondContact O-N 3.39Å
188	E	21.6	Very low	23	Very low	165 Å²	165	160.1 Å²	160.1	77%	0.771	82%	0.82	S	S	*	*			trans	-94.5	114.1	168.3	-134.8	166.9	-163	0	0	108	C186 Y190	C186-E188 PolarHBondContact O-N 3.42Å; E188-Y190 PolarHBondContact O-N 3.31Å
189	K	20.3	Very low	23.1	Very low	203 Å²	203	153 Å²	153	88%	0.883	81%	0.814	S	S	*	*			trans	-52.6	94.1	175.5	-71.3	174.3	175.2	176.3	0	109.6
190	Y	21.9	Very low	23.2	Very low	216 Å²	216	150.3 Å²	150.3	85%	0.847	81%	0.81	S	S	*	*			trans	-94.7	99.3	168.5	-129.8	-95.1	0	0	0	108.9	E188 P192	E188-Y190 PolarHBondContact O-N 3.31Å; Y190-P192 WeakPolarHBondContact O-CD 3.37Å
191	V	21.8	Very low	23.4	Very low	116 Å²	116	144.6 Å²	144.6	70%	0.703	80%	0.802	S	S	*	*			trans	-63.7	118.1	171.3	176.7	0	0	0	0	107.8	K193	V191-K193 PolarHBondContact O-N 2.69Å; V191-K193 VanDerWaalsContact O-N 3.13Å
192	P	24.4	Very low	23.3	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	80%	0.803	S	S	*	*			trans	-69.9	113.3	179.2	-13.8	28.5	0	0	0	109.3	Y190	Y190-P192 WeakPolarHBondContact O-CD 3.37Å
193	K	22.8	Very low	23.4	Very low	185 Å²	185	150.3 Å²	150.3	80%	0.804	81%	0.808	S	S	*	*			trans	-80.5	142.3	157.1	-73.2	-177.6	176.7	-180	0	107.6	V191	V191-K193 PolarHBondContact O-N 2.69Å; V191-K193 VanDerWaalsContact O-N 3.13Å
194	D	25.3	Very low	23.4	Very low	151 Å²	151	150.5 Å²	150.5	81%	0.807	81%	0.808	S	S	*	*	S	Bend	trans	90.2	86.7	170.5	-50.9	-22.8	0	0	0	116.1	T196	D194-T196 PolarHBondContact O-N 3.43Å
195	N	25.6	Very low	23.4	Very low	161 Å²	161	152.6 Å²	152.6	86%	0.861	81%	0.814	S	S	*	*			trans	3.9	100.7	134.8	-78.3	-2	0	0	0	115.3
196	T	25.8	Very low	23.7	Very low	131 Å²	131	151 Å²	151	80%	0.804	82%	0.819	S	S	*	*				-170.1	109.1	127	21.5	0	0	0	0	108.8	D194	D194-T196 PolarHBondContact O-N 3.43Å
197	L	27.1	Very low	24	Very low	164 Å²	164	149.8 Å²	149.8	86%	0.859	82%	0.818	S	S	*	*			trans	32.9	95.8	150.3	-65.6	162.4	0	0	0	117.4
198	C	24	Very low	24.4	Very low	136 Å²	136	148.6 Å²	148.6	92%	0.919	82%	0.816	S	S	*	*				-160	93.8	129.4	-99.8	0	0	0	0	107.7
199	A	26	Very low	24.7	Very low	99 Å²	99	149.8 Å²	149.8	82%	0.818	83%	0.827	S	S	*	*			trans	-70.6	130.6	178.6	0	0	0	0	0	111.1
200	N	23.5	Very low	24.8	Very low	147 Å²	147	142.8 Å²	142.8	79%	0.786	81%	0.812	S	S	*	*			trans	72.6	118.4	151.6	-85.5	-18.2	0	0	0	121.6
201	P	26.3	Very low	25	Very low	107 Å²	107	140.7 Å²	140.7	70%	0.695	81%	0.81	S	S	*	*			trans	-92	101.1	171.2	35.7	-26.7	0	0	0	110.4
202	Y	22	Very low	25.2	Very low	209 Å²	209	143.1 Å²	143.1	82%	0.82	81%	0.814	S	S	*	*			trans	-150.8	117.1	153.8	-82.6	-74.9	0	0	0	108.5	I204	Y202-I204 PolarHBondContact O-N 3.35Å
203	P	27.4	Very low	25.3	Very low	135 Å²	135	141.1 Å²	141.1	88%	0.877	82%	0.815	S	S	*	*			trans	-70.8	106.7	175.7	27.2	-29.6	0	0	0	109.2
204	I	24.3	Very low	25.3	Very low	153 Å²	153	138.6 Å²	138.6	79%	0.785	82%	0.815	S	S	*	*			trans	-59.4	135.1	167	-69.6	168.9	0	0	0	108.8	Y202 L206	Y202-I204 PolarHBondContact O-N 3.35Å; I204-L206 PolarHBondContact O-N 2.8Å
205	N	23.9	Very low	25.2	Very low	150 Å²	150	142.6 Å²	142.6	80%	0.802	82%	0.819	S	S	*	*			trans	-35.3	119.6	173.8	-90.2	-56.9	0	0	0	113.4	A207	N205-A207 PolarHBondContact O-N 3.38Å
206	L	26.5	Very low	25.1	Very low	183 Å²	183	144.4 Å²	144.4	96%	0.958	82%	0.819	S	S	*	*	S	Bend	trans	-77.2	66.6	175.4	-140.1	89	0	0	0	110.3	I204	I204-L206 PolarHBondContact O-N 2.8Å
207	A	25.2	Very low	24.8	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	82%	0.818	S	S	*	*			trans	-140.7	51.9	170.2	0	0	0	0	0	110.3	N205	N205-A207 PolarHBondContact O-N 3.38Å
208	A	26.6	Very low	24.7	Very low	92 Å²	92	140.9 Å²	140.9	76%	0.76	82%	0.816	S	S	*	*			trans	-163.3	61.8	166.5	0	0	0	0	0	110.5	G210	A208-G210 VanDerWaalsContact C-N 3.34Å
209	L	27.5	Very low	24.5	Very low	191 Å²	191	143 Å²	143	100%	1	81%	0.813	S	S	*	*			trans	-100.2	71.4	156.3	-140.5	107.2	0	0	0	107.7
210	G	22.4	Very low	24.4	Very low	56 Å²	56	147.4 Å²	147.4	58%	0.577	82%	0.816	S	S	*	*			trans	-120.7	138	163.3	0	0	0	0	0	107.7	A208	A208-G210 VanDerWaalsContact C-N 3.34Å
211	Q	26.2	Very low	24.4	Very low	172 Å²	172	145.4 Å²	145.4	80%	0.804	82%	0.82	S	S	*	*			trans	83.5	118.1	176.9	-40.2	-162.3	4.2	0	0	112.6
212	H	25.7	Very low	24.3	Very low	167 Å²	167	144.1 Å²	144.1	77%	0.773	83%	0.826	S	S	*	*			cis	-150.1	130.1	42.5	-72.1	-93.5	0	0	0	112.3
213	G	27.3	Very low	24.3	Very low	80 Å²	80	140.3 Å²	140.3	83%	0.825	83%	0.829	S	S	*	*			trans	-152.8	72.5	166.1	0	0	0	0	0	108.2	R215	G213-R215 PolarHBondContact O-N 2.81Å
214	T	23.1	Very low	24.4	Very low	132 Å²	132	143 Å²	143	81%	0.81	83%	0.83	S	S	*	*			trans	-65.7	113.1	-179.7	47.3	0	0	0	0	111.3
215	R	23.2	Very low	24.7	Very low	236 Å²	236	145 Å²	145	89%	0.891	83%	0.833	S	S	*	*			trans	-158.5	104.8	146.5	-146.3	172.9	-177.7	-171.8	-0.9	113.2	G213	G213-R215 PolarHBondContact O-N 2.81Å
216	K	22.3	Very low	24.8	Very low	199 Å²	199	144.4 Å²	144.4	87%	0.865	83%	0.829	S	S	*	*			trans	46.5	122.4	152.3	-68.3	-168	174	-171.9	0	121.3
217	A	20.2	Very low	25	Very low	94 Å²	94	143.2 Å²	143.2	78%	0.777	82%	0.824	S	S	*	*			trans	-59.8	155.5	157.9	0	0	0	0	0	113.1
218	P	24.3	Very low	25.4	Very low	126 Å²	126	148.2 Å²	148.2	82%	0.818	83%	0.828	S	S	*	*				-127.7	163.3	101.4	36.6	-28.1	0	0	0	114.2
219	E	19.8	Very low	25.9	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	82%	0.823	S	S	*	*			trans	-58.7	145.8	-178.7	-62.4	162.8	137.6	0	0	114.1
220	E	24.3	Very low	26.1	Very low	190 Å²	190	144.3 Å²	144.3	89%	0.888	81%	0.806	S	S	*	*				176.6	134.8	113.1	-94	-176.8	-176.3	0	0	113.3
221	A	24.1	Very low	27	Very low	106 Å²	106	147.9 Å²	147.9	88%	0.876	81%	0.808	S	S	*	*			trans	11.9	137	158.5	0	0	0	0	0	123.3
222	G	24.7	Very low	28.4	Very low	79 Å²	79	144.4 Å²	144.4	81%	0.814	80%	0.8	S	S	*	*			trans	152.4	72.3	148	0	0	0	0	0	116.6
223	C	20.6	Very low	29.4	Very low	130 Å²	130	140.9 Å²	140.9	88%	0.878	79%	0.79	S	S	*	*			trans	-91.3	112.3	169.3	-176.5	0	0	0	0	110.1
224	Q	31.3	Very low	30.7	Very low	191 Å²	191	143.2 Å²	143.2	89%	0.893	78%	0.78	S	S	*	*			trans	-139.6	110.2	162.4	-75.1	-165.6	-0.7	0	0	112.5
225	K	28.7	Very low	32.5	Very low	196 Å²	196	144.4 Å²	144.4	85%	0.852	77%	0.774	S	S	*	*			trans	26.6	125.6	141.4	-65	-178.1	179	179.1	0	121.3
226	N	26.6	Very low	34.5	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	76%	0.76	S	S	*	*			trans	-54.9	129.3	169	-48.8	-34.2	0	0	0	115	F228	N226-F228 HydrophobicContact CB-CD2 4.29Å; N226-F228 HydrophobicContact CB-CE2 4.21Å
227	D	31	Very low	36.5	Very low	159 Å²	159	135.6 Å²	135.6	85%	0.85	75%	0.747	S	S	*	*			trans	-126.6	102.7	151.9	-86.9	-30.4	0	0	0	108.6	T229	D227-T229 PolarHBondContact O-N 2.94Å
228	F	34.6	Very low	38.6	Very low	198 Å²	198	137.2 Å²	137.2	87%	0.868	74%	0.738	S	S	*	*			trans	-75.3	87.7	176.9	-81	-86.2	0	0	0	110.2	N226 C230	N226-F228 HydrophobicContact CB-CD2 4.29Å; N226-F228 HydrophobicContact CB-CE2 4.21Å; F228-C230 PolarHBondContact O-N 2.88Å
229	T	35.6	Very low	40.9	Very low	105 Å²	105	135.1 Å²	135.1	64%	0.644	72%	0.719	S	S	*	*			trans	-87.7	100.6	165.2	-52.3	0	0	0	0	108.6	D227 H231	D227-T229 PolarHBondContact O-N 2.94Å; T229-H231 PolarHBondContact O-CD2 3.12Å; T229-H231 PolarHBondContact O-N 3.18Å; T229-H231 VanDerWaalsContact O-N 3.16Å
230	C	33.1	Very low	43	Very low	96 Å²	96	132.3 Å²	132.3	65%	0.649	71%	0.706	S	S	*	*			trans	-61.1	113.5	177.9	178.6	0	0	0	0	110.2	F228	F228-C230 PolarHBondContact O-N 2.88Å
231	H	40.2	Very low	44.4	Very low	132 Å²	132	132.1 Å²	132.1	61%	0.611	70%	0.697	S	S	*	*			trans	-73	142.2	-171.9	-68.7	-76.6	0	0	0	112.6	T229 T233 E234	T229-H231 PolarHBondContact O-CD2 3.12Å; T229-H231 PolarHBondContact O-N 3.18Å; T229-H231 VanDerWaalsContact O-N 3.16Å; H231-T233 PolarHBondContact O-N 3.3Å; H231-E234 PolarHBondContact O-N 3.41Å
232	P	55.9	Low	45.7	Very low	99 Å²	99	132.8 Å²	132.8	64%	0.643	68%	0.682	S	S	*	*	H	α-helix	trans	-52	-21	-179.9	-26.1	31.6	0	0	0	115.8	E234 K235 L236	P232-E234 PolarHBondContact O-N 2.93Å; P232-K235 PolarHBondContact O-N 3.26Å; P232-L236 PolarHBondContact O-N 3.39Å
233	T	45.6	Very low	47.6	Very low	92 Å²	92	134.7 Å²	134.7	56%	0.564	67%	0.668	S	S	*	*	H	α-helix	trans	-66.8	-28.2	-176.5	6.8	0	0	0	0	113.9	H231 K237	H231-T233 PolarHBondContact O-N 3.3Å; T233-K237 PolarHBondContact O-N 2.87Å
234	E	56.3	Low	49.1	Very low	130 Å²	130	132.5 Å²	132.5	61%	0.607	65%	0.648	S	S	*	*	H	α-helix	trans	-74	-39.8	176.2	-91.7	-172.4	147.3	0	0	112.7	H231 P232 L236 K237 Q238	H231-E234 PolarHBondContact O-N 3.41Å; P232-E234 PolarHBondContact O-N 2.93Å; E234-L236 VanDerWaalsContact C-N 3.29Å; E234-L236 PolarHBondContact O-N 3.25Å; E234-K237 PolarHBondContact O-N 3.48Å; E234-K237 VanDerWaalsContact O-N 3.15Å; E234-Q238 PolarHBondContact O-N 2.92Å
235	K	59.2	Low	50.3	Low	156 Å²	156	128.1 Å²	128.1	68%	0.678	63%	0.634	S	S	*	*	H	α-helix	trans	-59.1	-40.8	176	-75.4	-172.9	177.3	-179.5	0	111.8	P232 Q238 I239	P232-K235 PolarHBondContact O-N 3.26Å; K235-Q238 PolarHBondContact O-N 2.67Å; K235-I239 WeakPolarHBondContact O-CG1 3.39Å; K235-I239 PolarHBondContact O-N 2.98Å
236	L	65.6	Low	51.3	Low	114 Å²	114	124.9 Å²	124.9	60%	0.597	62%	0.622	S	S	*	*	H	α-helix	trans	-63.6	-41.9	175.8	-92.7	159.5	0	0	0	112.7	P232 E234 Q238 I239 Q240	P232-L236 PolarHBondContact O-N 3.39Å; E234-L236 VanDerWaalsContact C-N 3.29Å; E234-L236 PolarHBondContact O-N 3.25Å; L236-Q238 VanDerWaalsContact C-N 3.3Å; L236-Q238 PolarHBondContact O-N 2.91Å; L236-I239 PolarHBondContact O-N 3.36Å; L236-Q240 WeakPolarHBondContact O-CB 3.44Å; L236-Q240 PolarHBondContact O-N 3.31Å
237	K	64.1	Low	52.9	Low	137 Å²	137	125.5 Å²	125.5	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-63.2	-37	175.8	-73.2	178.9	-179.5	178.1	0	111.6	T233 E234 Q240 R241	T233-K237 PolarHBondContact O-N 2.87Å; E234-K237 PolarHBondContact O-N 3.48Å; E234-K237 VanDerWaalsContact O-N 3.15Å; K237-Q240 PolarHBondContact O-N 2.96Å; K237-R241 WeakPolarHBondContact O-CG 3.34Å; K237-R241 PolarHBondContact O-N 3.36Å
238	Q	65.9	Low	53.5	Low	128 Å²	128	127.1 Å²	127.1	60%	0.598	61%	0.612	S	S	*	*	H	α-helix	trans	-71	-41.5	178.7	-166.9	158	-11.4	0	0	112.6	E234 K235 L236 Q240 R241 Q242	E234-Q238 PolarHBondContact O-N 2.92Å; K235-Q238 PolarHBondContact O-N 2.67Å; L236-Q238 VanDerWaalsContact C-N 3.3Å; L236-Q238 PolarHBondContact O-N 2.91Å; Q238-Q240 VanDerWaalsContact C-N 3.32Å; Q238-Q240 PolarHBondContact O-N 3.43Å; Q238-R241 PolarHBondContact O-N 3.03Å; Q238-Q242 PolarHBondContact O-N 3.42Å
239	I	71.3	Confident	54.8	Low	82 Å²	82	120.8 Å²	120.8	42%	0.421	59%	0.593	S	S	.	*	H	α-helix	trans	-61.7	-41	173.4	-66.6	165.2	0	0	0	110.8	K235 L236 R241 Q242 K243	K235-I239 WeakPolarHBondContact O-CG1 3.39Å; K235-I239 PolarHBondContact O-N 2.98Å; L236-I239 PolarHBondContact O-N 3.36Å; I239-R241 VanDerWaalsContact C-N 3.34Å; I239-R241 PolarHBondContact O-N 3.41Å; I239-Q242 PolarHBondContact O-N 2.98Å; I239-K243 HydrophobicContact CG2-CD 4.39Å; I239-K243 WeakPolarHBondContact O-CG 3.36Å; I239-K243 PolarHBondContact O-N 3.32Å
240	Q	64.1	Low	56.4	Low	123 Å²	123	119.2 Å²	119.2	58%	0.575	59%	0.586	S	S	*	*	H	α-helix	trans	-63.4	-39.5	176.5	-163.8	102.6	-29.6	0	0	111.7	L236 K237 Q238 N244	L236-Q240 WeakPolarHBondContact O-CB 3.44Å; L236-Q240 PolarHBondContact O-N 3.31Å; K237-Q240 PolarHBondContact O-N 2.96Å; Q238-Q240 VanDerWaalsContact C-N 3.32Å; Q238-Q240 PolarHBondContact O-N 3.43Å; Q240-N244 PolarHBondContact O-N 2.99Å; Q240-N244 VanDerWaalsContact O-N 3.1Å
241	R	53	Low	58	Low	185 Å²	185	118.4 Å²	118.4	70%	0.698	58%	0.581	S	S	*	*	H	α-helix	trans	-63.9	-45.1	175.7	-75.3	175.9	179.7	-172.1	0.2	111.6	K237 Q238 I239 N244 V245	K237-R241 WeakPolarHBondContact O-CG 3.34Å; K237-R241 PolarHBondContact O-N 3.36Å; Q238-R241 PolarHBondContact O-N 3.03Å; I239-R241 VanDerWaalsContact C-N 3.34Å; I239-R241 PolarHBondContact O-N 3.41Å; R241-N244 PolarHBondContact O-N 2.93Å; R241-V245 WeakPolarHBondContact O-CG2 3.41Å; R241-V245 PolarHBondContact O-N 3.21Å
242	Q	52.4	Low	59	Low	120 Å²	120	118.1 Å²	118.1	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-60.7	-46.2	176.5	-79.5	178.1	-32.6	0	0	112.1	Q238 I239 N244 V245 E246	Q238-Q242 PolarHBondContact O-N 3.42Å; I239-Q242 PolarHBondContact O-N 2.98Å; Q242-N244 VanDerWaalsContact C-N 3.26Å; Q242-N244 PolarHBondContact O-N 3.3Å; Q242-V245 PolarHBondContact O-N 2.89Å; Q242-V245 VanDerWaalsContact O-N 3.12Å; Q242-E246 PolarHBondContact O-N 3.31Å
243	K	65.2	Low	59.6	Low	120 Å²	120	116.8 Å²	116.8	52%	0.522	57%	0.572	S	S	.	*	H	α-helix	trans	-60	-34.5	175.9	-72.6	-178.8	178.7	-177.9	0	113.1	I239 K247	I239-K243 HydrophobicContact CG2-CD 4.39Å; I239-K243 WeakPolarHBondContact O-CG 3.36Å; I239-K243 PolarHBondContact O-N 3.32Å; K243-K247 WeakPolarHBondContact O-CB 3.39Å; K243-K247 WeakPolarHBondContact O-CG 3.4Å; K243-K247 PolarHBondContact O-N 3.48Å; K243-K247 VanDerWaalsContact O-N 3.1Å
244	N	50.6	Low	60.9	Low	83 Å²	83	115.8 Å²	115.8	44%	0.444	57%	0.566	S	S	.	*	H	α-helix	trans	-72.5	-36.7	176.7	-74.8	-15.2	0	0	0	112.3	Q240 R241 Q242 R248	Q240-N244 PolarHBondContact O-N 2.99Å; Q240-N244 VanDerWaalsContact O-N 3.1Å; R241-N244 PolarHBondContact O-N 2.93Å; Q242-N244 VanDerWaalsContact C-N 3.26Å; Q242-N244 PolarHBondContact O-N 3.3Å; N244-R248 WeakPolarHBondContact O-CG 3.36Å; N244-R248 PolarHBondContact O-N 2.95Å; N244-R248 VanDerWaalsContact O-N 3.09Å
245	V	56.6	Low	60.9	Low	99 Å²	99	111.7 Å²	111.7	60%	0.6	55%	0.554	S	S	*	*	H	α-helix	trans	-66.9	-44.1	174.4	174.5	0	0	0	0	110.7	R241 Q242 K247 R248 S249	R241-V245 WeakPolarHBondContact O-CG2 3.41Å; R241-V245 PolarHBondContact O-N 3.21Å; Q242-V245 PolarHBondContact O-N 2.89Å; Q242-V245 VanDerWaalsContact O-N 3.12Å; V245-K247 PolarHBondContact O-N 2.99Å; V245-R248 PolarHBondContact O-N 3.24Å; V245-S249 PolarHBondContact O-N 2.9Å
246	E	50.8	Low	60.8	Low	129 Å²	129	109.5 Å²	109.5	60%	0.603	55%	0.549	S	S	*	.	H	α-helix	trans	-59.8	-45.7	175.4	-79.9	176	169.4	0	0	112.1	Q242 R248 S249 S250	Q242-E246 PolarHBondContact O-N 3.31Å; E246-R248 VanDerWaalsContact C-N 3.31Å; E246-R248 PolarHBondContact O-N 3.01Å; E246-S249 PolarHBondContact O-N 2.78Å; E246-S249 VanDerWaalsContact O-N 3.15Å; E246-S249 PolarHBondContact O-OG 3.25Å; E246-S250 PolarHBondContact O-N 2.8Å
247	K	60.7	Low	61.1	Low	149 Å²	149	110 Å²	110	65%	0.648	55%	0.55	S	S	*	.	H	α-helix	trans	-59	-40.6	175	-80.1	-179.7	179.7	-178.2	0	112.6	K243 V245 S251	K243-K247 WeakPolarHBondContact O-CB 3.39Å; K243-K247 WeakPolarHBondContact O-CG 3.4Å; K243-K247 PolarHBondContact O-N 3.48Å; K243-K247 VanDerWaalsContact O-N 3.1Å; V245-K247 PolarHBondContact O-N 2.99Å; K247-S251 WeakPolarHBondContact O-CB 2.81Å; K247-S251 PolarHBondContact O-N 3.17Å
248	R	42.4	Very low	61.4	Low	192 Å²	192	109.5 Å²	109.5	73%	0.725	55%	0.55	S	S	*	.	H	α-helix	trans	-65.4	-41.5	175.4	-75.1	177.1	177.1	-171.5	-2.7	111.2	N244 V245 E246 S251 M252	N244-R248 WeakPolarHBondContact O-CG 3.36Å; N244-R248 PolarHBondContact O-N 2.95Å; N244-R248 VanDerWaalsContact O-N 3.09Å; V245-R248 PolarHBondContact O-N 3.24Å; E246-R248 VanDerWaalsContact C-N 3.31Å; E246-R248 PolarHBondContact O-N 3.01Å; R248-S251 PolarHBondContact O-N 3.43Å; R248-M252 WeakPolarHBondContact O-CB 3.31Å; R248-M252 PolarHBondContact O-N 3.16Å
249	S	62.2	Low	60.8	Low	66 Å²	66	109.1 Å²	109.1	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-45.6	177	82.7	0	0	0	0	112	V245 E246 S251 M252 T253	V245-S249 PolarHBondContact O-N 2.9Å; E246-S249 PolarHBondContact O-N 2.78Å; E246-S249 VanDerWaalsContact O-N 3.15Å; E246-S249 PolarHBondContact O-OG 3.25Å; S249-S251 PolarHBondContact O-N 3.28Å; S249-M252 PolarHBondContact O-N 2.9Å; S249-M252 VanDerWaalsContact O-N 3.14Å; S249-T253 PolarHBondContact O-N 3.41Å; S249-T253 PolarHBondContact O-OG1 3.38Å
250	S	68.6	Low	60.7	Low	71 Å²	71	109.1 Å²	109.1	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-41.4	178.1	166.5	0	0	0	0	112.1	E246 M252 T253 T254	E246-S250 PolarHBondContact O-N 2.8Å; S250-M252 VanDerWaalsContact C-N 3.33Å; S250-M252 PolarHBondContact O-N 3.24Å; S250-T253 PolarHBondContact O-N 2.9Å; S250-T254 WeakPolarHBondContact O-CB 3.35Å; S250-T254 PolarHBondContact O-N 2.93Å; S250-T254 PolarHBondContact O-OG1 2.91Å
251	S	68.1	Low	61	Low	79 Å²	79	106.2 Å²	106.2	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-64	-38.9	174.8	-172.7	0	0	0	0	111.9	K247 R248 S249 T254 A255	K247-S251 WeakPolarHBondContact O-CB 2.81Å; K247-S251 PolarHBondContact O-N 3.17Å; R248-S251 PolarHBondContact O-N 3.43Å; S249-S251 PolarHBondContact O-N 3.28Å; S251-T254 PolarHBondContact O-N 3.39Å; S251-A255 WeakPolarHBondContact O-CB 3.14Å; S251-A255 PolarHBondContact O-N 2.79Å
252	M	59.8	Low	61	Low	127 Å²	127	99.9 Å²	99.9	63%	0.626	53%	0.532	S	S	*	.	H	α-helix	trans	-69.3	-43.5	178.4	-166.3	-177.4	-72.3	0	0	111.2	R248 S249 S250 T254 A255 L256	R248-M252 WeakPolarHBondContact O-CB 3.31Å; R248-M252 PolarHBondContact O-N 3.16Å; S249-M252 PolarHBondContact O-N 2.9Å; S249-M252 VanDerWaalsContact O-N 3.14Å; S250-M252 VanDerWaalsContact C-N 3.33Å; S250-M252 PolarHBondContact O-N 3.24Å; M252-T254 VanDerWaalsContact C-N 3.31Å; M252-T254 PolarHBondContact O-N 2.9Å; M252-A255 PolarHBondContact O-N 2.95Å; M252-L256 HydrophobicContact CG-CD1 4.49Å; M252-L256 WeakPolarHBondContact O-CG 3.44Å; M252-L256 PolarHBondContact O-N 2.98Å
253	T	68.4	Low	61.1	Low	71 Å²	71	96.6 Å²	96.6	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-41.4	174.1	-53	0	0	0	0	111.6	S249 S250 L256 M257	S249-T253 PolarHBondContact O-N 3.41Å; S249-T253 PolarHBondContact O-OG1 3.38Å; S250-T253 PolarHBondContact O-N 2.9Å; T253-L256 PolarHBondContact O-N 3.4Å; T253-M257 HydrophobicContact CG2-CE 4.1Å; T253-M257 WeakPolarHBondContact O-CG 3.09Å; T253-M257 PolarHBondContact O-N 2.98Å
254	T	73	Confident	61.3	Low	71 Å²	71	96.2 Å²	96.2	44%	0.436	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-43.2	177	-53	0	0	0	0	111.3	S250 S251 M252 M257 Q258	S250-T254 WeakPolarHBondContact O-CB 3.35Å; S250-T254 PolarHBondContact O-N 2.93Å; S250-T254 PolarHBondContact O-OG1 2.91Å; S251-T254 PolarHBondContact O-N 3.39Å; M252-T254 VanDerWaalsContact C-N 3.31Å; M252-T254 PolarHBondContact O-N 2.9Å; T254-M257 PolarHBondContact O-N 3.49Å; T254-Q258 WeakPolarHBondContact O-CG 3.12Å; T254-Q258 PolarHBondContact O-N 2.87Å
255	A	56.5	Low	61.7	Low	44 Å²	44	98.9 Å²	98.9	36%	0.364	53%	0.534	S	S	.	.	H	α-helix	trans	-64	-40.9	177.4	0	0	0	0	0	112.1	S251 M252 Q258 L259	S251-A255 WeakPolarHBondContact O-CB 3.14Å; S251-A255 PolarHBondContact O-N 2.79Å; M252-A255 PolarHBondContact O-N 2.95Å; A255-Q258 PolarHBondContact O-N 3.38Å; A255-L259 WeakPolarHBondContact O-CG 3.49Å; A255-L259 PolarHBondContact O-N 3.23Å
256	L	58.6	Low	61.3	Low	109 Å²	109	97.5 Å²	97.5	57%	0.571	53%	0.529	S	S	*	.	H	α-helix	trans	-65	-42.1	175.9	-71.3	171.7	0	0	0	112.1	M252 T253 Q258 L259 D260	M252-L256 HydrophobicContact CG-CD1 4.49Å; M252-L256 WeakPolarHBondContact O-CG 3.44Å; M252-L256 PolarHBondContact O-N 2.98Å; T253-L256 PolarHBondContact O-N 3.4Å; L256-Q258 VanDerWaalsContact C-N 3.29Å; L256-Q258 PolarHBondContact O-N 2.94Å; L256-L259 PolarHBondContact O-N 3.4Å; L256-D260 PolarHBondContact O-N 3.04Å
257	M	70.5	Confident	61.5	Low	124 Å²	124	98 Å²	98	61%	0.611	53%	0.531	S	S	*	.	H	α-helix	trans	-62.4	-36.2	174.4	-74.2	-178.9	172.8	0	0	112.4	T253 T254 S261	T253-M257 HydrophobicContact CG2-CE 4.1Å; T253-M257 WeakPolarHBondContact O-CG 3.09Å; T253-M257 PolarHBondContact O-N 2.98Å; T254-M257 PolarHBondContact O-N 3.49Å; M257-S261 WeakPolarHBondContact O-CB 3.44Å; M257-S261 PolarHBondContact O-N 3.14Å; M257-S261 PolarHBondContact O-OG 3.48Å
258	Q	72	Confident	61.3	Low	128 Å²	128	96.2 Å²	96.2	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-69.4	-40.6	176	-74.6	-178.6	-32.6	0	0	112.4	T254 A255 L256 S261 A262	T254-Q258 WeakPolarHBondContact O-CG 3.12Å; T254-Q258 PolarHBondContact O-N 2.87Å; A255-Q258 PolarHBondContact O-N 3.38Å; L256-Q258 VanDerWaalsContact C-N 3.29Å; L256-Q258 PolarHBondContact O-N 2.94Å; Q258-S261 PolarHBondContact O-N 2.98Å; Q258-A262 WeakPolarHBondContact O-CB 2.93Å; Q258-A262 PolarHBondContact O-N 2.83Å
259	L	52.1	Low	61.3	Low	120 Å²	120	94.9 Å²	94.9	63%	0.628	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-41.9	175.7	-72.7	170.9	0	0	0	111.9	A255 L256 A262 A263	A255-L259 WeakPolarHBondContact O-CG 3.49Å; A255-L259 PolarHBondContact O-N 3.23Å; L256-L259 PolarHBondContact O-N 3.4Å; L259-A262 PolarHBondContact O-N 3.02Å; L259-A263 WeakPolarHBondContact O-CB 3.27Å; L259-A263 PolarHBondContact O-N 3.04Å
260	D	70.5	Confident	60.8	Low	82 Å²	82	95.6 Å²	95.6	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-38.9	176.4	-173.8	54.1	0	0	0	111.9	L256 A263 K264	L256-D260 PolarHBondContact O-N 3.04Å; D260-A263 PolarHBondContact O-N 2.85Å; D260-K264 WeakPolarHBondContact O-CG 3.36Å; D260-K264 PolarHBondContact O-N 3.46Å; D260-K264 IonicContact OD1-NZ 2.71Å; D260-K264 WeakPolarHBondContact OD2-CE 3.35Å; D260-K264 IonicContact OD2-NZ 2.92Å; D260-K264 PolarHBondContact OD2-NZ 3.03Å
261	S	70.1	Confident	60	Low	62 Å²	62	95.1 Å²	95.1	43%	0.434	53%	0.526	S	S	.	.	H	α-helix	trans	-64.7	-43.5	174.2	-57.7	0	0	0	0	111.8	M257 Q258 A263 K264 E265	M257-S261 WeakPolarHBondContact O-CB 3.44Å; M257-S261 PolarHBondContact O-N 3.14Å; M257-S261 PolarHBondContact O-OG 3.48Å; Q258-S261 PolarHBondContact O-N 2.98Å; S261-A263 PolarHBondContact O-N 3.24Å; S261-K264 PolarHBondContact O-N 3.2Å; S261-E265 WeakPolarHBondContact O-CG 3.42Å; S261-E265 PolarHBondContact O-N 3.37Å
262	A	51.4	Low	59.3	Low	52 Å²	52	97.7 Å²	97.7	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-65.8	-36.1	176.9	0	0	0	0	0	112.6	Q258 L259 E265 S266	Q258-A262 WeakPolarHBondContact O-CB 2.93Å; Q258-A262 PolarHBondContact O-N 2.83Å; L259-A262 PolarHBondContact O-N 3.02Å; A262-E265 PolarHBondContact O-N 3.45Å; A262-S266 WeakPolarHBondContact O-CB 3.38Å; A262-S266 PolarHBondContact O-N 3.16Å
263	A	55.2	Low	58.4	Low	50 Å²	50	97.3 Å²	97.3	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-42.7	174.3	0	0	0	0	0	111.6	L259 D260 S261 S266 Q267	L259-A263 WeakPolarHBondContact O-CB 3.27Å; L259-A263 PolarHBondContact O-N 3.04Å; D260-A263 PolarHBondContact O-N 2.85Å; S261-A263 PolarHBondContact O-N 3.24Å; A263-S266 PolarHBondContact O-N 3.32Å; A263-Q267 WeakPolarHBondContact O-CG 3.41Å; A263-Q267 PolarHBondContact O-N 2.99Å
264	K	69.4	Low	57.2	Low	112 Å²	112	100 Å²	100	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-40.3	174.2	-73.5	166.7	177.8	163.8	0	112.4	D260 S261 Q267 N268	D260-K264 WeakPolarHBondContact O-CG 3.36Å; D260-K264 PolarHBondContact O-N 3.46Å; D260-K264 IonicContact OD1-NZ 2.71Å; D260-K264 WeakPolarHBondContact OD2-CE 3.35Å; D260-K264 IonicContact OD2-NZ 2.92Å; D260-K264 PolarHBondContact OD2-NZ 3.03Å; S261-K264 PolarHBondContact O-N 3.2Å; K264-Q267 PolarHBondContact O-N 3.5Å; K264-N268 WeakPolarHBondContact O-CB 3.28Å; K264-N268 PolarHBondContact O-N 3.02Å
265	E	58.1	Low	55.7	Low	139 Å²	139	100.9 Å²	100.9	65%	0.65	54%	0.542	S	S	*	.	H	α-helix	trans	-63.5	-41.7	174	-76.2	179.6	-174.5	0	0	112	S261 A262 N268 W269	S261-E265 WeakPolarHBondContact O-CG 3.42Å; S261-E265 PolarHBondContact O-N 3.37Å; A262-E265 PolarHBondContact O-N 3.45Å; E265-N268 PolarHBondContact O-N 2.83Å; E265-W269 WeakPolarHBondContact O-CB 3.35Å; E265-W269 PolarHBondContact O-N 3.42Å
266	S	48.6	Very low	54.4	Low	71 Å²	71	103.1 Å²	103.1	50%	0.497	56%	0.555	S	S	.	*	H	α-helix	trans	-62.8	-43.8	175.5	-176.7	0	0	0	0	111.9	A262 A263 W269 V270	A262-S266 WeakPolarHBondContact O-CB 3.38Å; A262-S266 PolarHBondContact O-N 3.16Å; A263-S266 PolarHBondContact O-N 3.32Å; S266-W269 PolarHBondContact O-N 3.15Å; S266-V270 WeakPolarHBondContact O-CG2 3.38Å; S266-V270 PolarHBondContact O-N 2.91Å
267	Q	55.1	Low	53.1	Low	140 Å²	140	104.1 Å²	104.1	65%	0.654	56%	0.56	S	S	*	*	H	α-helix	trans	-62.2	-43.2	174.9	-76	-179.9	-15.4	0	0	112.2	A263 K264 W269 V270 A271	A263-Q267 WeakPolarHBondContact O-CG 3.41Å; A263-Q267 PolarHBondContact O-N 2.99Å; K264-Q267 PolarHBondContact O-N 3.5Å; Q267-W269 VanDerWaalsContact C-N 3.34Å; Q267-W269 PolarHBondContact O-N 2.78Å; Q267-V270 PolarHBondContact O-N 2.9Å; Q267-A271 WeakPolarHBondContact O-CB 3.5Å; Q267-A271 PolarHBondContact O-N 3.47Å
268	N	57.3	Low	51.3	Low	111 Å²	111	107 Å²	107	59%	0.594	57%	0.569	S	S	*	*	H	α-helix	trans	-64.2	-37.2	175	-78.8	-19.2	0	0	0	112.4	K264 E265 A271 N272	K264-N268 WeakPolarHBondContact O-CB 3.28Å; K264-N268 PolarHBondContact O-N 3.02Å; E265-N268 PolarHBondContact O-N 2.83Å; N268-A271 PolarHBondContact O-N 3.19Å; N268-N272 PolarHBondContact O-N 3.03Å
269	W	42.4	Very low	49.5	Very low	163 Å²	163	110 Å²	110	62%	0.617	58%	0.58	S	S	*	*	H	α-helix	trans	-65.7	-40.3	176.1	-169.5	88.7	0	0	0	112	E265 S266 Q267 K273	E265-W269 WeakPolarHBondContact O-CB 3.35Å; E265-W269 PolarHBondContact O-N 3.42Å; S266-W269 PolarHBondContact O-N 3.15Å; Q267-W269 VanDerWaalsContact C-N 3.34Å; Q267-W269 PolarHBondContact O-N 2.78Å; W269-K273 HydrophobicContact CH2-CD 4.14Å; W269-K273 HydrophobicContact CZ2-CD 4.33Å; W269-K273 HydrophobicContact CZ3-CD 4.46Å
270	V	50.8	Low	48.4	Very low	81 Å²	81	110.2 Å²	110.2	49%	0.491	59%	0.586	S	S	.	*	H	α-helix	trans	-66.6	-41.5	174.8	173.8	0	0	0	0	111.2	S266 Q267 N272 K273	S266-V270 WeakPolarHBondContact O-CG2 3.38Å; S266-V270 PolarHBondContact O-N 2.91Å; Q267-V270 PolarHBondContact O-N 2.9Å; V270-N272 PolarHBondContact O-N 3.47Å; V270-K273 PolarHBondContact O-N 3.39Å
271	A	51.9	Low	46.4	Very low	62 Å²	62	113.7 Å²	113.7	51%	0.512	60%	0.604	S	S	.	*	H	α-helix	trans	-62.9	-40.2	177.9	0	0	0	0	0	112.6	Q267 N268 K273 Q274	Q267-A271 WeakPolarHBondContact O-CB 3.5Å; Q267-A271 PolarHBondContact O-N 3.47Å; N268-A271 PolarHBondContact O-N 3.19Å; A271-K273 VanDerWaalsContact C-N 3.32Å; A271-K273 PolarHBondContact O-N 3.03Å; A271-Q274 PolarHBondContact O-N 3.12Å
272	N	54	Low	44.4	Very low	133 Å²	133	119.3 Å²	119.3	71%	0.711	62%	0.623	S	S	*	*	H	α-helix	trans	-73	-15.9	-178.8	-93.6	-13.2	0	0	0	114.8	N268 V270 P275	N268-N272 PolarHBondContact O-N 3.03Å; V270-N272 PolarHBondContact O-N 3.47Å; N272-P275 WeakPolarHBondContact O-CD 3.44Å
273	K	41.3	Very low	43.3	Very low	118 Å²	118	122.5 Å²	122.5	51%	0.513	64%	0.642	S	S	.	*	H	α-helix	trans	-88.4	-15.8	175.4	-87.9	-159.3	176.6	-173.5	0	114.7	W269 V270 A271 P275 C276	W269-K273 HydrophobicContact CH2-CD 4.14Å; W269-K273 HydrophobicContact CZ2-CD 4.33Å; W269-K273 HydrophobicContact CZ3-CD 4.46Å; V270-K273 PolarHBondContact O-N 3.39Å; A271-K273 VanDerWaalsContact C-N 3.32Å; A271-K273 PolarHBondContact O-N 3.03Å; K273-P275 VanDerWaalsContact C-CD 3.5Å; K273-C276 PolarHBondContact O-N 3.09Å
274	Q	42.7	Very low	41.9	Very low	127 Å²	127	124.5 Å²	124.5	59%	0.593	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-14.2	-177.1	-76.6	-73	-9.6	0	0	116.5	A271	A271-Q274 PolarHBondContact O-N 3.12Å
275	P	41.3	Very low	39.9	Very low	90 Å²	90	124.9 Å²	124.9	58%	0.584	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-16.1	169	-12.2	29.3	0	0	0	114.4	N272 K273	N272-P275 WeakPolarHBondContact O-CD 3.44Å; K273-P275 VanDerWaalsContact C-CD 3.5Å
276	C	30.3	Very low	38.6	Very low	92 Å²	92	130.1 Å²	130.1	62%	0.622	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-88.7	-12.9	-172.9	-57.1	0	0	0	0	113.7	K273	K273-C276 PolarHBondContact O-N 3.09Å
277	L	30.5	Very low	37.4	Very low	129 Å²	129	134 Å²	134	68%	0.675	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-89.5	-4.1	179.3	-76	170	0	0	0	114.2
278	K	32.4	Very low	36	Very low	184 Å²	184	130.6 Å²	130.6	80%	0.8	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-102.6	9.4	179.6	-72.6	-168.7	178.6	-175.7	0	115.6
279	K	34.4	Very low	34.5	Very low	193 Å²	193	129.8 Å²	129.8	84%	0.839	71%	0.707	S	S	*	*	S	Bend	trans	-121.3	7.9	-178.6	-71.9	-168.9	179.1	-177.4	0	116.9
280	T	29.9	Very low	33.6	Very low	123 Å²	123	129.7 Å²	129.7	76%	0.755	72%	0.718	S	S	*	*	S	Bend	trans	-122.9	11	-176	-3.6	0	0	0	0	115.6
281	L	28.4	Very low	32.3	Very low	156 Å²	156	133.9 Å²	133.9	82%	0.817	73%	0.732	S	S	*	*	S	Bend	trans	-116.8	13.5	-179.4	-91.2	160	0	0	0	115.5
282	H	26.4	Very low	30.8	Very low	179 Å²	179	140.6 Å²	140.6	83%	0.829	75%	0.75	S	S	*	*			trans	-128.1	133.8	169.9	-70.1	-60.7	0	0	0	112
283	S	28.4	Very low	29.3	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	75%	0.752	S	S	*	*			trans	80.7	125.8	-177.3	90.4	0	0	0	0	115.5
284	S	27.3	Very low	28.5	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	76%	0.762	S	S	*	*			cis	-170.5	134.5	-8.1	50.6	0	0	0	0	108.1
285	T	26	Very low	27.7	Very low	121 Å²	121	140.2 Å²	140.2	74%	0.742	77%	0.774	S	S	*	*			trans	24.7	96.2	137.9	-8.1	0	0	0	0	117.3	D287	T285-D287 HydrophobicContact CG2-CB 4.33Å
286	Y	30.4	Very low	26.9	Very low	249 Å²	249	143.9 Å²	143.9	98%	0.976	78%	0.784	S	S	*	*			trans	-108.5	70.8	148.9	-110.1	-86.2	0	0	0	107.3
287	D	25.1	Very low	26.6	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	80%	0.796	S	S	*	*			trans	-132.7	108.7	167.2	-148.1	-0.5	0	0	0	104.5	T285	T285-D287 HydrophobicContact CG2-CB 4.33Å
288	G	24.5	Very low	26.3	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	80%	0.802	S	S	*	*			trans	165	98.2	-173.2	0	0	0	0	0	115.7
289	A	25.6	Very low	26	Very low	93 Å²	93	144.9 Å²	144.9	77%	0.769	80%	0.801	S	S	*	*			trans	71.4	108.5	148.5	0	0	0	0	0	118.2
290	L	24.1	Very low	25.6	Very low	161 Å²	161	146.6 Å²	146.6	84%	0.843	80%	0.802	S	S	*	*				65.4	132.5	73.9	-84.1	166.9	0	0	0	115.8
291	Q	22.5	Very low	25.4	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	80%	0.804	S	S	*	*			trans	90.8	104.9	150.9	-74.5	174.8	-12.8	0	0	120.3
292	F	20.6	Very low	25.4	Very low	204 Å²	204	147.5 Å²	147.5	90%	0.895	80%	0.8	S	S	*	*				24	116.8	119.7	-91.4	-94.7	0	0	0	117.7
293	S	22.9	Very low	25.5	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	80%	0.796	S	S	*	*				-160.1	119	121.6	66	0	0	0	0	110.4
294	S	23.9	Very low	25.6	Very low	105 Å²	105	147.9 Å²	147.9	73%	0.734	79%	0.791	S	S	*	*			trans	-49.1	132.4	154.3	43.9	0	0	0	0	111
295	N	25.9	Very low	25.8	Very low	158 Å²	158	151.1 Å²	151.1	85%	0.845	80%	0.796	S	S	*	*			trans	-152	150.6	150.6	-100.2	-13.8	0	0	0	110.6
296	E	25.8	Very low	26.4	Very low	166 Å²	166	151.4 Å²	151.4	78%	0.776	79%	0.789	S	S	*	*			trans	-83.3	161.4	-152.9	-55.9	174.4	120.8	0	0	114.4
297	K	23.9	Very low	26.6	Very low	205 Å²	205	147.6 Å²	147.6	89%	0.891	78%	0.777	S	S	*	*			trans	33.5	107.9	143.9	-71.6	173.9	176.6	169.6	0	117.4
298	G	24.8	Very low	27.4	Very low	76 Å²	76	142.3 Å²	142.3	78%	0.784	76%	0.755	S	S	*	*			trans	-156.5	130.7	161.2	0	0	0	0	0	110.3
299	D	24.4	Very low	28.1	Very low	146 Å²	146	145.1 Å²	145.1	78%	0.781	75%	0.75	S	S	*	*			trans	-65.3	146.8	-162.2	-76.9	-61.5	0	0	0	117.3
300	R	26.1	Very low	29	Very low	229 Å²	229	146.1 Å²	146.1	86%	0.864	74%	0.741	S	S	*	*			trans	11.5	109.9	138.2	-62.9	174	170.2	177.9	-1.6	115.9
301	I	26.2	Very low	30.1	Very low	157 Å²	157	142.3 Å²	142.3	81%	0.805	73%	0.725	S	S	*	*			trans	-162.2	112.4	146.4	-92.5	140.1	0	0	0	109.1
302	L	27.8	Very low	31.2	Very low	141 Å²	141	141 Å²	141	74%	0.738	72%	0.716	S	S	*	*			trans	72.2	73	149.6	-58.7	170.7	0	0	0	121.1	F304	L302-F304 PolarHBondContact O-N 3.38Å; L302-F304 VanDerWaalsContact O-N 3.12Å
303	D	28.3	Very low	32.2	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	70%	0.697	S	S	*	*			trans	-79.9	75.5	157.4	-68.4	-38.5	0	0	0	111.8
304	F	31.8	Very low	33.3	Very low	170 Å²	170	136.6 Å²	136.6	75%	0.746	69%	0.688	S	S	*	*			trans	-104.4	-3.1	163.1	-95.2	-80.5	0	0	0	113.6	L302	L302-F304 PolarHBondContact O-N 3.38Å; L302-F304 VanDerWaalsContact O-N 3.12Å
305	H	32.1	Very low	34.4	Very low	159 Å²	159	137.3 Å²	137.3	74%	0.736	68%	0.68	S	S	*	*	S	Bend	trans	-95	-21	178.6	-106.5	-90.7	0	0	0	114.8	A308 E309	H305-A308 PolarHBondContact O-N 3.06Å; H305-E309 PolarHBondContact O-N 3.36Å
306	E	37.3	Very low	35.3	Very low	128 Å²	128	134 Å²	134	60%	0.598	66%	0.661	S	S	*	*	H	α-helix	trans	-72.9	-32.8	-177.6	-160.1	177.5	-169.2	0	0	112.8	A308 E309 L310	E306-A308 VanDerWaalsContact C-N 3.31Å; E306-A308 PolarHBondContact O-N 2.91Å; E306-E309 PolarHBondContact O-N 3.45Å; E306-L310 PolarHBondContact O-N 3.01Å
307	K	34.6	Very low	36	Very low	168 Å²	168	128.3 Å²	128.3	73%	0.73	64%	0.643	S	S	*	*	H	α-helix	trans	-68.5	-28.4	175.9	-77.8	-176.6	178.9	174.5	0	113.5	T311	K307-T311 PolarHBondContact O-N 3.04Å; K307-T311 VanDerWaalsContact O-N 3.16Å; K307-T311 PolarHBondContact O-OG1 3.49Å
308	A	42.1	Very low	37	Very low	42 Å²	42	124.4 Å²	124.4	35%	0.347	63%	0.628	S	S	.	*	H	α-helix	trans	-75.3	-35.1	177.9	0	0	0	0	0	111.9	H305 E306 T311 K312	H305-A308 PolarHBondContact O-N 3.06Å; E306-A308 VanDerWaalsContact C-N 3.31Å; E306-A308 PolarHBondContact O-N 2.91Å; A308-T311 PolarHBondContact O-OG1 3.1Å; A308-K312 WeakPolarHBondContact O-CG 3.49Å; A308-K312 PolarHBondContact O-N 2.94Å; A308-K312 VanDerWaalsContact O-N 3.17Å
309	E	39.9	Very low	38	Very low	127 Å²	127	130.7 Å²	130.7	59%	0.593	63%	0.628	S	S	*	*	H	α-helix	trans	-71.7	-40.4	172.2	-74.3	-135.3	145.9	0	0	111.9	H305 E306 T311 K312 N313	H305-E309 PolarHBondContact O-N 3.36Å; E306-E309 PolarHBondContact O-N 3.45Å; E309-T311 VanDerWaalsContact C-N 3.3Å; E309-T311 PolarHBondContact O-N 3.21Å; E309-K312 PolarHBondContact O-N 3.37Å; E309-N313 VanDerWaalsContact O-CB 3.31Å; E309-N313 WeakPolarHBondContact O-CB 3.42Å; E309-N313 VanDerWaalsContact O-CG 3.23Å; E309-N313 PolarHBondContact O-N 3.49Å; E309-N313 PolarHBondContact O-ND2 3.16Å
310	L	43.4	Very low	39.1	Very low	114 Å²	114	128.4 Å²	128.4	60%	0.597	61%	0.612	S	S	*	*	H	α-helix	trans	-63	-35.3	177.4	-116	142.2	0	0	0	112.6	E306 K314	E306-L310 PolarHBondContact O-N 3.01Å; L310-K314 WeakPolarHBondContact O-CB 3.01Å; L310-K314 PolarHBondContact O-N 3.43Å
311	T	48.1	Very low	39.8	Very low	81 Å²	81	124.6 Å²	124.6	50%	0.497	61%	0.609	S	S	.	*	H	α-helix	trans	-74.1	-37.7	174.5	24.6	0	0	0	0	112.9	K307 A308 E309 K314 Q315	K307-T311 PolarHBondContact O-N 3.04Å; K307-T311 VanDerWaalsContact O-N 3.16Å; K307-T311 PolarHBondContact O-OG1 3.49Å; A308-T311 PolarHBondContact O-OG1 3.1Å; E309-T311 VanDerWaalsContact C-N 3.3Å; E309-T311 PolarHBondContact O-N 3.21Å; T311-K314 PolarHBondContact O-N 2.81Å; T311-Q315 WeakPolarHBondContact O-CB 3.46Å; T311-Q315 WeakPolarHBondContact O-CG 3.39Å; T311-Q315 PolarHBondContact O-N 3.27Å
312	K	46.1	Very low	40.7	Very low	141 Å²	141	120.3 Å²	120.3	61%	0.613	60%	0.597	S	S	*	*	H	α-helix	trans	-64.9	-44.5	173.3	-75.9	177.9	-178.4	177.5	0	111.5	A308 E309 K314 Q315 I316	A308-K312 WeakPolarHBondContact O-CG 3.49Å; A308-K312 PolarHBondContact O-N 2.94Å; A308-K312 VanDerWaalsContact O-N 3.17Å; E309-K312 PolarHBondContact O-N 3.37Å; K312-K314 VanDerWaalsContact C-N 3.35Å; K312-K314 PolarHBondContact O-N 2.93Å; K312-Q315 PolarHBondContact O-N 3.22Å; K312-I316 WeakPolarHBondContact O-CB 3.34Å; K312-I316 WeakPolarHBondContact O-CD1 3.4Å; K312-I316 WeakPolarHBondContact O-CG1 3.33Å; K312-I316 PolarHBondContact O-N 3.1Å
313	N	39.9	Very low	41.4	Very low	91 Å²	91	122.4 Å²	122.4	49%	0.487	60%	0.6	S	S	.	*	H	α-helix	trans	-67.4	-36.1	179	-68.9	-18.9	0	0	0	111.7	E309 I316 A317	E309-N313 VanDerWaalsContact O-CB 3.31Å; E309-N313 WeakPolarHBondContact O-CB 3.42Å; E309-N313 VanDerWaalsContact O-CG 3.23Å; E309-N313 PolarHBondContact O-N 3.49Å; E309-N313 PolarHBondContact O-ND2 3.16Å; N313-I316 PolarHBondContact O-N 3.06Å; N313-A317 VanDerWaalsContact O-CB 3.24Å; N313-A317 WeakPolarHBondContact O-CB 3.48Å; N313-A317 PolarHBondContact O-N 2.87Å
314	K	47	Very low	42.2	Very low	129 Å²	129	119.6 Å²	119.6	56%	0.561	59%	0.59	S	S	*	*	H	α-helix	trans	-68.2	-39.4	173.4	-162.9	177	-177.9	-175.5	0	112.4	L310 T311 K312 A317 E318	L310-K314 WeakPolarHBondContact O-CB 3.01Å; L310-K314 PolarHBondContact O-N 3.43Å; T311-K314 PolarHBondContact O-N 2.81Å; K312-K314 VanDerWaalsContact C-N 3.35Å; K312-K314 PolarHBondContact O-N 2.93Å; K314-A317 PolarHBondContact O-N 3.48Å; K314-E318 VanDerWaalsContact CE-OE1 3.31Å; K314-E318 WeakPolarHBondContact CE-OE1 3.35Å; K314-E318 VanDerWaalsContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CB 3.39Å; K314-E318 VanDerWaalsContact O-CG 3.3Å; K314-E318 WeakPolarHBondContact O-CG 3.42Å; K314-E318 PolarHBondContact O-N 3.03Å
315	Q	46.6	Very low	42.9	Very low	120 Å²	120	116.1 Å²	116.1	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-68.6	-33.5	174.4	-75	-177.1	7.4	0	0	113	T311 K312 R319	T311-Q315 WeakPolarHBondContact O-CB 3.46Å; T311-Q315 WeakPolarHBondContact O-CG 3.39Å; T311-Q315 PolarHBondContact O-N 3.27Å; K312-Q315 PolarHBondContact O-N 3.22Å; Q315-R319 WeakPolarHBondContact O-CB 3.49Å; Q315-R319 WeakPolarHBondContact O-CG 3.36Å; Q315-R319 PolarHBondContact O-N 3.29Å; Q315-R319 VanDerWaalsContact O-N 3.15Å
316	I	44.5	Very low	43.7	Very low	87 Å²	87	114.3 Å²	114.3	45%	0.446	58%	0.576	S	S	.	*	H	α-helix	trans	-68.6	-46.1	172.8	-67.1	163.6	0	0	0	109.6	K312 N313 E318 R319 E320	K312-I316 WeakPolarHBondContact O-CB 3.34Å; K312-I316 WeakPolarHBondContact O-CD1 3.4Å; K312-I316 WeakPolarHBondContact O-CG1 3.33Å; K312-I316 PolarHBondContact O-N 3.1Å; N313-I316 PolarHBondContact O-N 3.06Å; I316-E318 PolarHBondContact O-N 3.45Å; I316-R319 PolarHBondContact O-N 3.02Å; I316-E320 HydrophobicContact CG2-CG 4.47Å; I316-E320 VanDerWaalsContact CG2-OE1 3.28Å; I316-E320 WeakPolarHBondContact CG2-OE1 3.42Å; I316-E320 WeakPolarHBondContact O-CB 3.38Å; I316-E320 VanDerWaalsContact O-CG 3.31Å; I316-E320 WeakPolarHBondContact O-CG 3.34Å; I316-E320 PolarHBondContact O-N 3.43Å
317	A	41.1	Very low	44.4	Very low	48 Å²	48	110.5 Å²	110.5	40%	0.397	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-36.9	177.9	0	0	0	0	0	113.4	N313 K314 E320 N321	N313-A317 VanDerWaalsContact O-CB 3.24Å; N313-A317 WeakPolarHBondContact O-CB 3.48Å; N313-A317 PolarHBondContact O-N 2.87Å; K314-A317 PolarHBondContact O-N 3.48Å; A317-E320 PolarHBondContact O-N 3.15Å; A317-N321 PolarHBondContact O-N 3.36Å; A317-N321 VanDerWaalsContact O-N 3.12Å
318	E	44.5	Very low	45	Very low	123 Å²	123	106.9 Å²	106.9	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-70.7	-32	175.7	-76.9	175.1	-174.3	0	0	112.1	K314 I316	K314-E318 VanDerWaalsContact CE-OE1 3.31Å; K314-E318 WeakPolarHBondContact CE-OE1 3.35Å; K314-E318 VanDerWaalsContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CB 3.39Å; K314-E318 VanDerWaalsContact O-CG 3.3Å; K314-E318 WeakPolarHBondContact O-CG 3.42Å; K314-E318 PolarHBondContact O-N 3.03Å; I316-E318 PolarHBondContact O-N 3.45Å
319	R	46.3	Very low	45.5	Very low	207 Å²	207	108.1 Å²	108.1	78%	0.781	55%	0.548	S	S	*	.	H	α-helix	trans	-74	-32	171.1	-76.9	-179.2	176.5	-179.6	1.1	112.7	Q315 I316 A322	Q315-R319 WeakPolarHBondContact O-CB 3.49Å; Q315-R319 WeakPolarHBondContact O-CG 3.36Å; Q315-R319 PolarHBondContact O-N 3.29Å; Q315-R319 VanDerWaalsContact O-N 3.15Å; I316-R319 PolarHBondContact O-N 3.02Å; R319-A322 WeakPolarHBondContact O-CB 3.36Å; R319-A322 PolarHBondContact O-N 3.35Å
320	E	46.7	Very low	45.7	Very low	99 Å²	99	105.2 Å²	105.2	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-74.5	-26.3	178.8	-76.9	177.7	-170	0	0	113.5	Q69 I316 A317 A322	Q69-E320 PolarHBondContact NE2-OE1 3.33Å; Q69-E320 PolarHBondContact OE1-OE1 3.1Å; I316-E320 HydrophobicContact CG2-CG 4.47Å; I316-E320 VanDerWaalsContact CG2-OE1 3.28Å; I316-E320 WeakPolarHBondContact CG2-OE1 3.42Å; I316-E320 WeakPolarHBondContact O-CB 3.38Å; I316-E320 VanDerWaalsContact O-CG 3.31Å; I316-E320 WeakPolarHBondContact O-CG 3.34Å; I316-E320 PolarHBondContact O-N 3.43Å; A317-E320 PolarHBondContact O-N 3.15Å; E320-A322 VanDerWaalsContact C-N 3.33Å
321	N	41.6	Very low	46.1	Very low	149 Å²	149	101.2 Å²	101.2	80%	0.797	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	5.3	174.1	-97.6	-17.8	0	0	0	114.4	A317 K323	A317-N321 PolarHBondContact O-N 3.36Å; A317-N321 VanDerWaalsContact O-N 3.12Å; N321-K323 PolarHBondContact O-N 3.5Å
322	A	45.2	Very low	45.4	Very low	67 Å²	67	101.8 Å²	101.8	55%	0.554	52%	0.515	S	S	*	.	S	Bend	trans	-63.5	122.3	170.2	0	0	0	0	0	109.2	R319 E320	R319-A322 WeakPolarHBondContact O-CB 3.36Å; R319-A322 PolarHBondContact O-N 3.35Å; E320-A322 VanDerWaalsContact C-N 3.33Å
323	K	42	Very low	45.1	Very low	184 Å²	184	98.5 Å²	98.5	80%	0.8	51%	0.509	S	S	*	.			trans	-38.6	140.3	178.2	-68.4	177	-179.9	177.6	0	110.9	N321 V325	N321-K323 PolarHBondContact O-N 3.5Å; K323-V325 PolarHBondContact O-N 3.45Å
324	P	44.9	Very low	45.3	Very low	78 Å²	78	98.9 Å²	98.9	51%	0.506	51%	0.511	S	S	.	.			trans	-56.1	109.1	-174.1	24.5	-34.7	0	0	0	110	K65 I326	K65-P324 HydrophobicContact CD-CB 4.23Å; K65-P324 VanDerWaalsContact CE-CB 3.45Å; P324-I326 PolarHBondContact O-N 3.02Å
325	V	47.8	Very low	45.2	Very low	97 Å²	97	97.3 Å²	97.3	59%	0.588	51%	0.508	S	S	*	.			trans	-66.5	108.2	177	-178	0	0	0	0	106.6	K323 E327	K323-V325 PolarHBondContact O-N 3.45Å; V325-E327 HydrophobicContact CG1-CG 4.01Å; V325-E327 PolarHBondContact O-N 3.12Å; V325-E327 VanDerWaalsContact O-N 3.17Å
326	I	48.7	Very low	45.1	Very low	120 Å²	120	96 Å²	96	62%	0.615	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	104.7	166.5	-60.9	173.7	0	0	0	105.1	V63 P324 V328	V63-I326 HydrophobicContact CG1-CG2 3.83Å; P324-I326 PolarHBondContact O-N 3.02Å; I326-V328 HydrophobicContact CG2-CG2 4.24Å; I326-V328 PolarHBondContact O-N 3.44Å
327	E	51.8	Low	45.2	Very low	48 Å²	48	96.5 Å²	96.5	22%	0.224	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	108.1	172.6	-79.3	-170.7	-147.2	0	0	108.4	Y48 A64 V325 K329	Y48-E327 HydrophobicContact CE1-CB 4.07Å; Y48-E327 HydrophobicContact CE1-CG 4.13Å; Y48-E327 VanDerWaalsContact CE1-OE2 3.26Å; Y48-E327 WeakPolarHBondContact CE1-OE2 3.3Å; Y48-E327 VanDerWaalsContact CZ-OE2 3.26Å; Y48-E327 PolarHBondContact OH-OE1 3.16Å; Y48-E327 PolarHBondContact OH-OE2 3.44Å; A64-E327 PolarHBondContact N-O 3.45Å; A64-E327 PolarHBondContact O-N 3.28Å; A64-E327 VanDerWaalsContact O-N 3.14Å; V325-E327 HydrophobicContact CG1-CG 4.01Å; V325-E327 PolarHBondContact O-N 3.12Å; V325-E327 VanDerWaalsContact O-N 3.17Å; E327-K329 PolarHBondContact O-N 2.9Å; E327-K329 WeakPolarHBondContact OE2-CE 3.45Å; E327-K329 IonicContact OE2-NZ 3.91Å; E327-K329 PolarHBondContact OE2-NZ 3.02Å
328	V	47.5	Very low	45.4	Very low	93 Å²	93	99.6 Å²	99.6	56%	0.564	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	101.3	164.7	-176.8	0	0	0	0	106.6	V63 I326	V63-V328 HydrophobicContact CG2-CG2 4.43Å; I326-V328 HydrophobicContact CG2-CG2 4.24Å; I326-V328 PolarHBondContact O-N 3.44Å
329	K	52.9	Low	45.5	Very low	67 Å²	67	98 Å²	98	29%	0.291	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.3	175.8	-88.4	174.2	170.2	149.4	0	109	Y45 Y48 A62 E327	Y45-K329 HydrophobicContact CE1-CB 3.93Å; Y45-K329 HydrophobicContact CE1-CD 3.82Å; Y45-K329 WeakPolarHBondContact OH-CB 3.41Å; Y48-K329 PolarHBondContact OH-NZ 3.11Å; A62-K329 PolarHBondContact N-O 2.83Å; A62-K329 PolarHBondContact O-N 3.05Å; E327-K329 PolarHBondContact O-N 2.9Å; E327-K329 WeakPolarHBondContact OE2-CE 3.45Å; E327-K329 IonicContact OE2-NZ 3.91Å; E327-K329 PolarHBondContact OE2-NZ 3.02Å
330	L	43.4	Very low	45.4	Very low	67 Å²	67	90.2 Å²	90.2	35%	0.351	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	113.5	173	-167	78.8	0	0	0	108.2	I61 I162 L332	I61-L330 HydrophobicContact CB-CD1 4.34Å; I61-L330 HydrophobicContact CD1-CD1 3.42Å; I61-L330 VanDerWaalsContact CD1-CD1 3.42Å; I61-L330 HydrophobicContact CG1-CD1 3.59Å; I61-L330 HydrophobicContact CG2-CD1 3.99Å; I162-L330 HydrophobicContact CD1-CD2 4.11Å; L330-L332 VanDerWaalsContact C-N 3.27Å; L330-L332 HydrophobicContact CD1-CD2 4.43Å; L330-L332 HydrophobicContact CD2-CD1 3.42Å; L330-L332 VanDerWaalsContact CD2-CD1 3.42Å; L330-L332 HydrophobicContact CD2-CD2 3.53Å; L330-L332 HydrophobicContact CD2-CG 3.25Å; L330-L332 HydrophobicContact CG-CD1 4.31Å; L330-L332 HydrophobicContact CG-CD2 3.79Å; L330-L332 HydrophobicContact CG-CG 3.61Å; L330-L332 PolarHBondContact O-N 3.49Å; L330-L332 VanDerWaalsContact O-N 3.16Å
331	I	52.1	Low	45.4	Very low	30 Å²	30	89.5 Å²	89.5	15%	0.154	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	83.7	166	-50.9	176.6	0	0	0	106.1	Y45 T60	Y45-I331 HydrophobicContact CE2-CD1 4.12Å; T60-I331 HydrophobicContact CG2-CD1 4.45Å; T60-I331 PolarHBondContact N-O 3.36Å; T60-I331 WeakPolarHBondContact O-CA 3.48Å; T60-I331 VanDerWaalsContact O-CB 3.27Å; T60-I331 WeakPolarHBondContact O-CB 3.47Å; T60-I331 PolarHBondContact O-N 2.82Å
332	L	32.2	Very low	45.7	Very low	92 Å²	92	84.6 Å²	84.6	48%	0.482	47%	0.469	S	S	.	.			trans	-77	132.9	163.3	-67.7	177	0	0	0	108.2	L330	L330-L332 VanDerWaalsContact C-N 3.27Å; L330-L332 HydrophobicContact CD1-CD2 4.43Å; L330-L332 HydrophobicContact CD2-CD1 3.42Å; L330-L332 VanDerWaalsContact CD2-CD1 3.42Å; L330-L332 HydrophobicContact CD2-CD2 3.53Å; L330-L332 HydrophobicContact CD2-CG 3.25Å; L330-L332 HydrophobicContact CG-CD1 4.31Å; L330-L332 HydrophobicContact CG-CD2 3.79Å; L330-L332 HydrophobicContact CG-CG 3.61Å; L330-L332 PolarHBondContact O-N 3.49Å; L330-L332 VanDerWaalsContact O-N 3.16Å
333	S	39.4	Very low	45.7	Very low	72 Å²	72	86.2 Å²	86.2	50%	0.503	46%	0.462	S	S	.	.			trans	-151.2	0	172.9	65.1	0	0	0	0	110.6	Y23 R58 H59	Y23-S333 VanDerWaalsContact CB-CB 3.47Å; Y23-S333 WeakPolarHBondContact CB-OG 3.47Å; Y23-S333 WeakPolarHBondContact O-CB 3.23Å; Y23-S333 PolarHBondContact O-OG 2.87Å; R58-S333 PolarHBondContact O-OG 3.48Å; H59-S333 PolarHBondContact CE1-O 3.37Å; H59-S333 PolarHBondContact ND1-O 3.46Å

Retrieved 333 of 333 residues in 360.8 ms (Link to these results)

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