A0A023GS48_SOYBN Loading...

CONSTANS-like zinc finger protein

AlphaFold DB (I1N7Y1), UniProt , Accession A0A023GS48, Species SOYBN (Glycine max, Soybean), Gene COL17, Length 385 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	79	Confident	92	Very high	102 Å²	102	76.3 Å²	76.3	50%	0.502	41%	0.406	S	S	.	.				0	158.4	0	-59.9	-171.7	-137.2	0	0	109.2	P11 L133 A136 R137	M1-P11 HydrophobicContact CB-CB 4.04Å; M1-P11 HydrophobicContact SD-CB 3.96Å; M1-P11 HydrophobicContact SD-CG 4.31Å; M1-L133 HydrophobicContact CE-CD2 4.19Å; M1-L133 HydrophobicContact SD-CD2 3.53Å; M1-L133 VanDerWaalsContact SD-CD2 3.53Å; M1-A136 HydrophobicContact CE-CB 4.43Å; M1-A136 HydrophobicContact SD-CB 4.29Å; M1-R137 HydrophobicContact CE-CG 3.39Å
2	L	89.2	Confident	92.1	Very high	60 Å²	60	70.5 Å²	70.5	31%	0.314	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-91.5	147.1	176.6	-70.8	179	0	0	0	110.9	P11 A12 K22 K51	L2-P11 CarbonylContact O-C 3.45Å; L2-P11 VanDerWaalsContact O-CA 3.27Å; L2-P11 WeakPolarHBondContact O-CA 3.39Å; L2-A12 PolarHBondContact O-N 2.77Å; L2-K22 HydrophobicContact CD1-CD 3.63Å; L2-K51 HydrophobicContact CD1-CB 3.7Å; L2-K51 HydrophobicContact CD1-CD 4.46Å; L2-K51 HydrophobicContact CG-CB 4.43Å; L2-K51 HydrophobicContact CG-CD 4.31Å
3	P	94	Very high	92	Very high	69 Å²	69	66.4 Å²	66.4	45%	0.448	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-71.1	156.3	171.9	31.2	-34.3	0	0	0	111.3
4	C	95.5	Very high	92.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-70.8	126.4	171.5	176.6	0	0	0	0	110.9	Y6 C7 D8 K10 C24 C27	C4-Y6 PolarHBondContact O-N 2.91Å; C4-C7 PolarHBondContact O-N 2.98Å; C4-D8 WeakPolarHBondContact O-CA 3.37Å; C4-D8 PolarHBondContact O-N 3.27Å; C4-K10 WeakPolarHBondContact CB-O 3.48Å; C4-K10 PolarHBondContact N-O 3.24Å; C4-C24 HydrophobicContact CB-CB 3.98Å; C4-C24 PolarHBondContact SG-N 3.22Å; C4-C27 VanDerWaalsContact SG-SG 3.66Å
5	D	95.6	Very high	92.3	Very high	87 Å²	87	58.7 Å²	58.7	47%	0.465	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.4	-178.5	-64.5	-18.1	0	0	0	114	A21 K22	D5-A21 WeakPolarHBondContact OD2-CA 3.49Å; D5-K22 PolarHBondContact N-O 3.49Å; D5-K22 PolarHBondContact OD2-N 3.17Å
6	Y	93.4	Very high	92.3	Very high	159 Å²	159	55.2 Å²	55.2	62%	0.624	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-40.2	-179.1	-172.9	-93.7	0	0	0	113.8	C4 C27	C4-Y6 PolarHBondContact O-N 2.91Å; Y6-C27 HydrophobicContact CD1-CB 4.34Å; Y6-C27 VanDerWaalsContact CD1-SG 3.6Å
7	C	94.6	Very high	92.3	Very high	40 Å²	40	62.4 Å²	62.4	27%	0.27	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-9.6	-171.9	74.5	0	0	0	0	114.6	C4 S9	C4-C7 PolarHBondContact O-N 2.98Å; C7-S9 WeakPolarHBondContact O-CB 3.24Å; C7-S9 PolarHBondContact O-N 3.4Å; C7-S9 PolarHBondContact O-OG 3.22Å; C7-S9 PolarHBondContact SG-OG 3.49Å
8	D	93.8	Very high	92.4	Very high	122 Å²	122	62.4 Å²	62.4	65%	0.652	33%	0.328	S	S	*	.	S	Bend	trans	52.2	-2.1	179.7	-61.6	-44.2	0	0	0	117.1	C4	C4-D8 WeakPolarHBondContact O-CA 3.37Å; C4-D8 PolarHBondContact O-N 3.27Å
9	S	91.9	Very high	92.4	Very high	95 Å²	95	63.1 Å²	63.1	66%	0.664	33%	0.331	S	S	*	.	S	Bend	trans	-103.3	-35.4	-170.9	42.9	0	0	0	0	112.7	C7	C7-S9 WeakPolarHBondContact O-CB 3.24Å; C7-S9 PolarHBondContact O-N 3.4Å; C7-S9 PolarHBondContact O-OG 3.22Å; C7-S9 PolarHBondContact SG-OG 3.49Å
10	K	92.3	Very high	92.4	Very high	73 Å²	73	64.3 Å²	64.3	32%	0.317	35%	0.345	S	S	.	.	S	Bend	trans	-105.6	137.5	-177.1	-75.7	-170.7	-177.5	-168.7	0	109.8	C4 C24 Y129	C4-K10 WeakPolarHBondContact CB-O 3.48Å; C4-K10 PolarHBondContact N-O 3.24Å; K10-C24 HydrophobicContact CB-CB 3.68Å; K10-Y129 WeakPolarHBondContact CB-OH 3.49Å
11	P	92.7	Very high	92.5	Very high	32 Å²	32	62.1 Å²	62.1	21%	0.208	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-56.4	137.4	171.5	16.3	-31.8	0	0	0	113.2	M1 L2 C24 Y129 L133	M1-P11 HydrophobicContact CB-CB 4.04Å; M1-P11 HydrophobicContact SD-CB 3.96Å; M1-P11 HydrophobicContact SD-CG 4.31Å; L2-P11 CarbonylContact O-C 3.45Å; L2-P11 VanDerWaalsContact O-CA 3.27Å; L2-P11 WeakPolarHBondContact O-CA 3.39Å; P11-C24 VanDerWaalsContact O-CB 3.29Å; P11-C24 WeakPolarHBondContact O-CB 3.07Å; P11-Y129 WeakPolarHBondContact CD-OH 3.46Å; P11-Y129 WeakPolarHBondContact CG-OH 3.29Å; P11-L133 HydrophobicContact CB-CD2 3.86Å; P11-L133 HydrophobicContact CG-CD1 3.83Å; P11-L133 HydrophobicContact CG-CD2 3.28Å; P11-L133 HydrophobicContact CG-CG 4.21Å
12	A	93.6	Very high	93.3	Very high	7 Å²	7	58.8 Å²	58.8	6%	0.058	32%	0.319	C	S	.	.			trans	-73.5	133.9	171.6	0	0	0	0	0	110.2	L2 K22 I46	L2-A12 PolarHBondContact O-N 2.77Å; A12-K22 HydrophobicContact CB-CB 3.75Å; A12-I46 HydrophobicContact CB-CD1 3.67Å; A12-I46 WeakPolarHBondContact O-CD1 3.42Å
13	L	91	Very high	93.5	Very high	17 Å²	17	56.2 Å²	56.2	9%	0.089	31%	0.306	C	S	.	.			trans	-118.9	-30.1	179.1	-66.8	177.3	0	0	0	111.7	L23 L25 I46 Y129 V132 L133	L13-L23 PolarHBondContact N-O 3.47Å; L13-L25 HydrophobicContact CD1-CD1 4.23Å; L13-L25 HydrophobicContact CD1-CG 4.05Å; L13-I46 PolarHBondContact O-N 2.82Å; L13-Y129 HydrophobicContact CD1-CD2 3.56Å; L13-Y129 HydrophobicContact CD1-CE2 3.72Å; L13-Y129 HydrophobicContact CG-CE2 4.39Å; L13-V132 HydrophobicContact CD1-CB 3.99Å; L13-V132 HydrophobicContact CD1-CG1 3.67Å; L13-V132 HydrophobicContact CD2-CG1 3.68Å; L13-V132 HydrophobicContact CG-CG1 4.19Å; L13-L133 HydrophobicContact CD1-CD2 4.43Å; L13-L133 HydrophobicContact CD2-CD2 3.89Å; L13-L133 HydrophobicContact CG-CD2 4.44Å
14	L	92.8	Very high	93.5	Very high	2 Å²	2	53 Å²	53	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.2	-176.6	-62.8	178	0	0	0	111	K22 L23 L25 D28 F44 L95 L108	L14-K22 CarbonylContact O-C 3.59Å; L14-K22 WeakPolarHBondContact O-CA 3.22Å; L14-L23 PolarHBondContact N-O 2.78Å; L14-L23 VanDerWaalsContact N-O 3.09Å; L14-L23 PolarHBondContact O-N 2.94Å; L14-L25 HydrophobicContact CD1-CD2 3.66Å; L14-L25 HydrophobicContact CG-CD2 4.08Å; L14-D28 HydrophobicContact CD1-CB 4.11Å; L14-F44 CarbonylContact C-O 3.57Å; L14-F44 VanDerWaalsContact CA-O 3.31Å; L14-F44 WeakPolarHBondContact CA-O 3.27Å; L14-L95 HydrophobicContact CD1-CD1 4.02Å; L14-L95 HydrophobicContact CD2-CD1 4Å; L14-L108 HydrophobicContact CD2-CD2 4.05Å
15	F	94.5	Very high	93.3	Very high	16 Å²	16	53 Å²	53	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.1	171.3	-175.2	-119	0	0	0	110	A21 K22 R43 F44 I46 T54	F15-A21 WeakPolarHBondContact CA-O 3.4Å; F15-A21 WeakPolarHBondContact CD2-O 3.47Å; F15-K22 HydrophobicContact CD2-CG 3.69Å; F15-K22 HydrophobicContact CE2-CG 4.24Å; F15-R43 WeakPolarHBondContact O-CA 3.3Å; F15-F44 PolarHBondContact N-O 3.36Å; F15-F44 PolarHBondContact O-N 3.47Å; F15-I46 HydrophobicContact CB-CG1 3.94Å; F15-T54 HydrophobicContact CD1-CG2 3.46Å; F15-T54 VanDerWaalsContact CD1-CG2 3.46Å; F15-T54 HydrophobicContact CE1-CG2 4.08Å; F15-T54 HydrophobicContact CG-CG2 4.5Å
16	C	93.7	Very high	93.1	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	111.8	171.1	178.8	0	0	0	0	109	A18 D19 S20 A21 H32 R43	C16-A18 VanDerWaalsContact C-N 3.32Å; C16-A18 PolarHBondContact O-N 2.65Å; C16-D19 HydrophobicContact CB-CB 4.38Å; C16-D19 PolarHBondContact SG-N 3.49Å; C16-D19 PolarHBondContact SG-OD2 3.48Å; C16-S20 VanDerWaalsContact O-CA 3.27Å; C16-S20 WeakPolarHBondContact O-CA 3.42Å; C16-S20 PolarHBondContact O-N 3.37Å; C16-A21 PolarHBondContact N-O 3.3Å; C16-A21 PolarHBondContact O-N 3.48Å; C16-H32 PolarHBondContact SG-NE2 3.38Å; C16-H32 VanDerWaalsContact SG-NE2 3.37Å; C16-R43 HydrophobicContact CB-CG 4.16Å
17	R	92.3	Very high	93.1	Very high	177 Å²	177	43.3 Å²	43.3	67%	0.668	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.5	179.9	-176.3	174.2	172.3	176.8	-0.6	112.7	T54	R17-T54 HydrophobicContact CB-CG2 4.11Å
18	A	92.8	Very high	93	Very high	63 Å²	63	41.5 Å²	41.5	52%	0.521	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-41.5	-178.7	0	0	0	0	0	112.1	C16 H41	C16-A18 VanDerWaalsContact C-N 3.32Å; C16-A18 PolarHBondContact O-N 2.65Å; A18-H41 HydrophobicContact CB-CB 4.04Å; A18-H41 VanDerWaalsContact CB-CG 3.48Å
19	D	92.3	Very high	92.9	Very high	75 Å²	75	40 Å²	40	40%	0.401	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.2	178.2	-60.8	-48.3	0	0	0	113	C16 A21 H32 H41	C16-D19 HydrophobicContact CB-CB 4.38Å; C16-D19 PolarHBondContact SG-N 3.49Å; C16-D19 PolarHBondContact SG-OD2 3.48Å; D19-A21 HydrophobicContact CB-CB 4.07Å; D19-A21 PolarHBondContact O-N 2.97Å; D19-H32 IonicContact OD2-NE2 3.44Å; D19-H41 IonicContact OD1-CE1 3.47Å; D19-H41 PolarHBondContact OD1-CE1 2.71Å; D19-H41 IonicContact OD1-ND1 3.43Å; D19-H41 IonicContact OD2-CE1 3.75Å; D19-H41 PolarHBondContact OD2-CE1 3.3Å; D19-H41 VanDerWaalsContact OD2-CE1 3.28Å; D19-H41 IonicContact OD2-ND1 2.93Å; D19-H41 PolarHBondContact OD2-ND1 2.79Å
20	S	93.5	Very high	92.9	Very high	87 Å²	87	39.9 Å²	39.9	61%	0.608	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	38.8	-172.2	-58.3	0	0	0	0	112.8	C16	C16-S20 VanDerWaalsContact O-CA 3.27Å; C16-S20 WeakPolarHBondContact O-CA 3.42Å; C16-S20 PolarHBondContact O-N 3.37Å
21	A	94	Very high	92.9	Very high	19 Å²	19	38.3 Å²	38.3	16%	0.157	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.4	-170.9	0	0	0	0	0	112.3	D5 F15 C16 D19 L23	D5-A21 WeakPolarHBondContact OD2-CA 3.49Å; F15-A21 WeakPolarHBondContact CA-O 3.4Å; F15-A21 WeakPolarHBondContact CD2-O 3.47Å; C16-A21 PolarHBondContact N-O 3.3Å; C16-A21 PolarHBondContact O-N 3.48Å; D19-A21 HydrophobicContact CB-CB 4.07Å; D19-A21 PolarHBondContact O-N 2.97Å; A21-L23 HydrophobicContact CB-CD2 4.39Å; A21-L23 HydrophobicContact CB-CG 4.39Å
22	K	95.1	Very high	92.9	Very high	33 Å²	33	36.8 Å²	36.8	14%	0.143	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	114.3	177.6	-60.2	173.5	-158.8	-58.7	0	108.6	L2 D5 A12 L14 F15 I46 K51 S52	L2-K22 HydrophobicContact CD1-CD 3.63Å; D5-K22 PolarHBondContact N-O 3.49Å; D5-K22 PolarHBondContact OD2-N 3.17Å; A12-K22 HydrophobicContact CB-CB 3.75Å; L14-K22 CarbonylContact O-C 3.59Å; L14-K22 WeakPolarHBondContact O-CA 3.22Å; F15-K22 HydrophobicContact CD2-CG 3.69Å; F15-K22 HydrophobicContact CE2-CG 4.24Å; K22-I46 HydrophobicContact CB-CD1 4.23Å; K22-I46 HydrophobicContact CG-CD1 4.36Å; K22-K51 WeakPolarHBondContact CE-O 3.3Å; K22-K51 PolarHBondContact NZ-O 3.49Å; K22-S52 PolarHBondContact NZ-O 2.95Å
23	L	94	Very high	92.7	Very high	6 Å²	6	39 Å²	39	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.7	-169.4	-58.2	175.1	0	0	0	111.4	L13 L14 A21 C27 D28 V31	L13-L23 PolarHBondContact N-O 3.47Å; L14-L23 PolarHBondContact N-O 2.78Å; L14-L23 VanDerWaalsContact N-O 3.09Å; L14-L23 PolarHBondContact O-N 2.94Å; A21-L23 HydrophobicContact CB-CD2 4.39Å; A21-L23 HydrophobicContact CB-CG 4.39Å; L23-C27 HydrophobicContact CB-CB 4.42Å; L23-C27 HydrophobicContact CD2-CB 4.24Å; L23-D28 HydrophobicContact CB-CB 4.37Å; L23-V31 HydrophobicContact CD1-CB 4.13Å; L23-V31 HydrophobicContact CD1-CG1 4.32Å; L23-V31 HydrophobicContact CD1-CG2 4.17Å
24	C	93.7	Very high	92.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.			trans	-73.2	164.2	162.1	72.5	0	0	0	0	109.9	C4 K10 P11 V26 C27 D28 Y129	C4-C24 HydrophobicContact CB-CB 3.98Å; C4-C24 PolarHBondContact SG-N 3.22Å; K10-C24 HydrophobicContact CB-CB 3.68Å; P11-C24 VanDerWaalsContact O-CB 3.29Å; P11-C24 WeakPolarHBondContact O-CB 3.07Å; C24-V26 PolarHBondContact O-N 3.2Å; C24-C27 PolarHBondContact O-N 3.19Å; C24-C27 PolarHBondContact SG-N 3.2Å; C24-C27 VanDerWaalsContact SG-N 3.42Å; C24-C27 PolarHBondContact SG-SG 3.17Å; C24-D28 WeakPolarHBondContact O-CB 3.28Å; C24-D28 PolarHBondContact O-N 3.41Å; C24-Y129 HydrophobicContact CB-CE2 4.13Å
25	L	91	Very high	92.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-29.8	-176.9	-68.9	-179.7	0	0	0	113.5	L13 L14 Q29 I104 R125 V128 Y129	L13-L25 HydrophobicContact CD1-CD1 4.23Å; L13-L25 HydrophobicContact CD1-CG 4.05Å; L14-L25 HydrophobicContact CD1-CD2 3.66Å; L14-L25 HydrophobicContact CG-CD2 4.08Å; L25-Q29 PolarHBondContact O-N 2.9Å; L25-I104 HydrophobicContact CD1-CG2 4.25Å; L25-I104 HydrophobicContact CD2-CG2 4.03Å; L25-R125 VanDerWaalsContact O-CZ 3.25Å; L25-R125 PolarHBondContact O-NE 3.29Å; L25-R125 PolarHBondContact O-NH2 3.12Å; L25-V128 HydrophobicContact CD1-CG1 4.25Å; L25-Y129 HydrophobicContact CB-CD2 4.05Å; L25-Y129 HydrophobicContact CD1-CD2 4.03Å; L25-Y129 HydrophobicContact CD1-CG 4.49Å; L25-Y129 HydrophobicContact CG-CD2 4.02Å
26	V	91.4	Very high	92.2	Very high	37 Å²	37	47.4 Å²	47.4	22%	0.224	28%	0.279	C	S	.	.	H	α-helix	trans	-73.4	-49.7	178.5	-179.9	0	0	0	0	110.8	C24 D28 Q29 H30	C24-V26 PolarHBondContact O-N 3.2Å; V26-D28 VanDerWaalsContact C-N 3.28Å; V26-D28 PolarHBondContact O-N 3.08Å; V26-Q29 PolarHBondContact O-N 3.3Å; V26-H30 PolarHBondContact O-N 2.82Å
27	C	93.7	Very high	92.1	Very high	6 Å²	6	53.4 Å²	53.4	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-34.3	177.4	-65.8	0	0	0	0	111.9	C4 Y6 L23 C24 Q29 H30 V31	C4-C27 VanDerWaalsContact SG-SG 3.66Å; Y6-C27 HydrophobicContact CD1-CB 4.34Å; Y6-C27 VanDerWaalsContact CD1-SG 3.6Å; L23-C27 HydrophobicContact CB-CB 4.42Å; L23-C27 HydrophobicContact CD2-CB 4.24Å; C24-C27 PolarHBondContact O-N 3.19Å; C24-C27 PolarHBondContact SG-N 3.2Å; C24-C27 VanDerWaalsContact SG-N 3.42Å; C24-C27 PolarHBondContact SG-SG 3.17Å; C27-Q29 VanDerWaalsContact C-N 3.32Å; C27-Q29 PolarHBondContact O-N 2.85Å; C27-H30 PolarHBondContact O-N 3.31Å; C27-V31 WeakPolarHBondContact O-CB 3.23Å; C27-V31 VanDerWaalsContact O-CG2 3.26Å; C27-V31 WeakPolarHBondContact O-CG2 3.32Å; C27-V31 PolarHBondContact O-N 2.72Å
28	D	93.2	Very high	92.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-53	-50.2	173.1	179	59.7	0	0	0	111.7	L14 L23 C24 V26 V31 H32 R43 R125	L14-D28 HydrophobicContact CD1-CB 4.11Å; L23-D28 HydrophobicContact CB-CB 4.37Å; C24-D28 WeakPolarHBondContact O-CB 3.28Å; C24-D28 PolarHBondContact O-N 3.41Å; V26-D28 VanDerWaalsContact C-N 3.28Å; V26-D28 PolarHBondContact O-N 3.08Å; D28-V31 PolarHBondContact O-N 2.72Å; D28-H32 WeakPolarHBondContact O-CB 3.33Å; D28-H32 PolarHBondContact O-N 2.93Å; D28-H32 PolarHBondContact O-ND1 3.15Å; D28-H32 IonicContact OD1-CE1 3.21Å; D28-H32 PolarHBondContact OD1-CE1 3.43Å; D28-H32 IonicContact OD1-CG 3.3Å; D28-H32 IonicContact OD1-ND1 3.9Å; D28-H32 PolarHBondContact OD1-ND1 3.43Å; D28-R43 WeakPolarHBondContact OD1-CD 3.29Å; D28-R43 IonicContact OD1-CZ 2.88Å; D28-R43 IonicContact OD1-NE 3.8Å; D28-R43 PolarHBondContact OD1-NE 3.36Å; D28-R43 IonicContact OD2-CZ 3.28Å; D28-R43 IonicContact OD2-NE 3.97Å; D28-R43 PolarHBondContact OD2-NE 3.14Å; D28-R43 IonicContact OD2-NH2 3.14Å; D28-R125 IonicContact OD2-NH2 3.7Å; D28-R125 PolarHBondContact OD2-NH2 2.78Å
29	Q	91.1	Very high	92	Very high	90 Å²	90	45.5 Å²	45.5	42%	0.421	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-46.9	179.1	-176.3	174.7	2.5	0	0	111	L25 V26 C27 V31 A33	L25-Q29 PolarHBondContact O-N 2.9Å; V26-Q29 PolarHBondContact O-N 3.3Å; C27-Q29 VanDerWaalsContact C-N 3.32Å; C27-Q29 PolarHBondContact O-N 2.85Å; Q29-V31 PolarHBondContact O-N 3.47Å; Q29-A33 WeakPolarHBondContact O-CB 3.39Å; Q29-A33 PolarHBondContact O-N 2.81Å
30	H	91.4	Very high	92	Very high	93 Å²	93	49 Å²	49	43%	0.431	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-42.4	-179.9	-65.3	163.5	0	0	0	112.6	V26 C27 A34	V26-H30 PolarHBondContact O-N 2.82Å; C27-H30 PolarHBondContact O-N 3.31Å; H30-A34 WeakPolarHBondContact O-CB 3.39Å; H30-A34 PolarHBondContact O-N 3.47Å
31	V	92.5	Very high	92.1	Very high	40 Å²	40	46.8 Å²	46.8	24%	0.242	27%	0.265	C	S	.	.	H	α-helix	trans	-71.4	-43.9	-178.4	173	0	0	0	0	111.5	L23 C27 D28 Q29 S38	L23-V31 HydrophobicContact CD1-CB 4.13Å; L23-V31 HydrophobicContact CD1-CG1 4.32Å; L23-V31 HydrophobicContact CD1-CG2 4.17Å; C27-V31 WeakPolarHBondContact O-CB 3.23Å; C27-V31 VanDerWaalsContact O-CG2 3.26Å; C27-V31 WeakPolarHBondContact O-CG2 3.32Å; C27-V31 PolarHBondContact O-N 2.72Å; D28-V31 PolarHBondContact O-N 2.72Å; Q29-V31 PolarHBondContact O-N 3.47Å; V31-S38 WeakPolarHBondContact O-CB 3.16Å; V31-S38 PolarHBondContact O-OG 3.26Å
32	H	92.9	Very high	92	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-88.1	-16.8	-173.3	-61.6	88.5	0	0	0	113.7	C16 D19 D28 S38 L39 R43	C16-H32 PolarHBondContact SG-NE2 3.38Å; C16-H32 VanDerWaalsContact SG-NE2 3.37Å; D19-H32 IonicContact OD2-NE2 3.44Å; D28-H32 WeakPolarHBondContact O-CB 3.33Å; D28-H32 PolarHBondContact O-N 2.93Å; D28-H32 PolarHBondContact O-ND1 3.15Å; D28-H32 IonicContact OD1-CE1 3.21Å; D28-H32 PolarHBondContact OD1-CE1 3.43Å; D28-H32 IonicContact OD1-CG 3.3Å; D28-H32 IonicContact OD1-ND1 3.9Å; D28-H32 PolarHBondContact OD1-ND1 3.43Å; H32-S38 PolarHBondContact CD2-O 2.69Å; H32-S38 VanDerWaalsContact CD2-O 3.27Å; H32-L39 VanDerWaalsContact O-CA 3.27Å; H32-L39 WeakPolarHBondContact O-CA 3.17Å; H32-L39 WeakPolarHBondContact O-CB 3.35Å; H32-L39 PolarHBondContact O-N 3.38Å; H32-R43 PolarHBondContact CD2-NH1 3.07Å; H32-R43 WeakPolarHBondContact CE1-CD 3.29Å; H32-R43 WeakPolarHBondContact ND1-CD 3.14Å; H32-R43 WeakPolarHBondContact NE2-CD 3.47Å
33	A	90.5	Very high	91.9	Very high	54 Å²	54	47.6 Å²	47.6	45%	0.446	27%	0.27	S	S	.	.	H	α-helix	trans	-85.6	-18.2	168.8	0	0	0	0	0	113.2	Q29 N35	Q29-A33 WeakPolarHBondContact O-CB 3.39Å; Q29-A33 PolarHBondContact O-N 2.81Å; A33-N35 VanDerWaalsContact C-N 3.31Å; A33-N35 PolarHBondContact O-N 3.28Å
34	A	89.7	Confident	91.8	Very high	55 Å²	55	49.4 Å²	49.4	46%	0.455	28%	0.278	S	S	.	.	S	Bend	trans	-64.1	-30.7	-173.6	0	0	0	0	0	114.2	H30	H30-A34 WeakPolarHBondContact O-CB 3.39Å; H30-A34 PolarHBondContact O-N 3.47Å
35	N	87.1	Confident	91.8	Very high	80 Å²	80	50 Å²	50	43%	0.428	28%	0.281	S	S	.	.			trans	-151.6	154.1	-178.9	70.1	69.9	0	0	0	113.1	A33 L37 S38 L39	A33-N35 VanDerWaalsContact C-N 3.31Å; A33-N35 PolarHBondContact O-N 3.28Å; N35-L37 PolarHBondContact O-N 3.42Å; N35-L37 VanDerWaalsContact O-N 3.12Å; N35-L37 WeakPolarHBondContact OD1-CA 3.31Å; N35-L37 WeakPolarHBondContact OD1-CB 3.33Å; N35-L37 PolarHBondContact OD1-N 3.44Å; N35-S38 VanDerWaalsContact CG-OG 3.23Å; N35-S38 PolarHBondContact ND2-OG 2.83Å; N35-S38 PolarHBondContact O-N 3Å; N35-S38 PolarHBondContact O-OG 2.87Å; N35-S38 VanDerWaalsContact O-OG 3.08Å; N35-S38 WeakPolarHBondContact OD1-CB 3.32Å; N35-S38 PolarHBondContact OD1-N 2.88Å; N35-S38 PolarHBondContact OD1-OG 2.87Å; N35-L39 WeakPolarHBondContact O-CB 3.41Å; N35-L39 PolarHBondContact O-N 3.18Å
36	A	90.9	Very high	91.9	Very high	75 Å²	75	51 Å²	51	62%	0.62	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.7	-178.2	0	0	0	0	0	114.5
37	L	91.5	Very high	91.9	Very high	129 Å²	129	49.2 Å²	49.2	68%	0.675	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-48.5	175.4	-63.7	173.4	0	0	0	110.5	N35 L39 K40 H41	N35-L37 PolarHBondContact O-N 3.42Å; N35-L37 VanDerWaalsContact O-N 3.12Å; N35-L37 WeakPolarHBondContact OD1-CA 3.31Å; N35-L37 WeakPolarHBondContact OD1-CB 3.33Å; N35-L37 PolarHBondContact OD1-N 3.44Å; L37-L39 VanDerWaalsContact C-N 3.25Å; L37-L39 PolarHBondContact O-N 3.14Å; L37-K40 WeakPolarHBondContact O-CB 3.48Å; L37-K40 PolarHBondContact O-N 3.07Å; L37-K40 VanDerWaalsContact O-N 3.1Å; L37-H41 PolarHBondContact O-CD2 3.39Å
38	S	91.7	Very high	91.8	Very high	5 Å²	5	51 Å²	51	4%	0.035	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-64.5	-33.6	176.6	61.8	0	0	0	0	110.7	V31 H32 N35 K40 H41	V31-S38 WeakPolarHBondContact O-CB 3.16Å; V31-S38 PolarHBondContact O-OG 3.26Å; H32-S38 PolarHBondContact CD2-O 2.69Å; H32-S38 VanDerWaalsContact CD2-O 3.27Å; N35-S38 VanDerWaalsContact CG-OG 3.23Å; N35-S38 PolarHBondContact ND2-OG 2.83Å; N35-S38 PolarHBondContact O-N 3Å; N35-S38 PolarHBondContact O-OG 2.87Å; N35-S38 VanDerWaalsContact O-OG 3.08Å; N35-S38 WeakPolarHBondContact OD1-CB 3.32Å; N35-S38 PolarHBondContact OD1-N 2.88Å; N35-S38 PolarHBondContact OD1-OG 2.87Å; S38-K40 PolarHBondContact O-N 3.18Å; S38-H41 VanDerWaalsContact O-CB 3.28Å; S38-H41 WeakPolarHBondContact O-CB 3.27Å; S38-H41 PolarHBondContact O-N 2.98Å
39	L	91.1	Very high	91.6	Very high	68 Å²	68	54.4 Å²	54.4	36%	0.356	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-56.1	-25.2	174.4	-161.1	138.3	0	0	0	113.5	H32 N35 L37 G97	H32-L39 VanDerWaalsContact O-CA 3.27Å; H32-L39 WeakPolarHBondContact O-CA 3.17Å; H32-L39 WeakPolarHBondContact O-CB 3.35Å; H32-L39 PolarHBondContact O-N 3.38Å; N35-L39 WeakPolarHBondContact O-CB 3.41Å; N35-L39 PolarHBondContact O-N 3.18Å; L37-L39 VanDerWaalsContact C-N 3.25Å; L37-L39 PolarHBondContact O-N 3.14Å; L39-G97 WeakPolarHBondContact O-CA 3.5Å; L39-G97 PolarHBondContact O-N 3.2Å
40	K	92.6	Very high	91.6	Very high	148 Å²	148	52.3 Å²	52.3	64%	0.643	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-87	-7.3	177.1	-59.1	176.7	-176.9	-177.4	0	113.8	L37 S38 V42	L37-K40 WeakPolarHBondContact O-CB 3.48Å; L37-K40 PolarHBondContact O-N 3.07Å; L37-K40 VanDerWaalsContact O-N 3.1Å; S38-K40 PolarHBondContact O-N 3.18Å; K40-V42 PolarHBondContact O-N 3.14Å
41	H	94.2	Very high	91.5	Very high	42 Å²	42	52.2 Å²	52.2	19%	0.194	30%	0.301	C	S	.	.			trans	-69.1	129.5	178.9	-61.9	179.8	0	0	0	109.5	A18 D19 L37 S38 R43	A18-H41 HydrophobicContact CB-CB 4.04Å; A18-H41 VanDerWaalsContact CB-CG 3.48Å; D19-H41 IonicContact OD1-CE1 3.47Å; D19-H41 PolarHBondContact OD1-CE1 2.71Å; D19-H41 IonicContact OD1-ND1 3.43Å; D19-H41 IonicContact OD2-CE1 3.75Å; D19-H41 PolarHBondContact OD2-CE1 3.3Å; D19-H41 VanDerWaalsContact OD2-CE1 3.28Å; D19-H41 IonicContact OD2-ND1 2.93Å; D19-H41 PolarHBondContact OD2-ND1 2.79Å; L37-H41 PolarHBondContact O-CD2 3.39Å; S38-H41 VanDerWaalsContact O-CB 3.28Å; S38-H41 WeakPolarHBondContact O-CB 3.27Å; S38-H41 PolarHBondContact O-N 2.98Å; H41-R43 PolarHBondContact O-NH1 3.15Å
42	V	93	Very high	91.3	Very high	67 Å²	67	53.8 Å²	53.8	41%	0.406	31%	0.313	S	S	.	.			trans	-89.2	132.2	174.6	-170.3	0	0	0	0	109.2	K40 F44 L95	K40-V42 PolarHBondContact O-N 3.14Å; V42-F44 HydrophobicContact CB-CE2 4.25Å; V42-F44 HydrophobicContact CG1-CD2 4.29Å; V42-F44 HydrophobicContact CG1-CE2 3.45Å; V42-F44 VanDerWaalsContact CG1-CE2 3.45Å; V42-F44 HydrophobicContact CG1-CZ 3.7Å; V42-L95 CarbonylContact C-O 3.54Å; V42-L95 WeakPolarHBondContact CA-O 3.38Å
43	R	92.9	Very high	91	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.008	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.9	-170.6	-49.9	175.9	-68.4	-88.5	9.9	109.7	F15 C16 D28 H32 H41 G94 L95 G97	F15-R43 WeakPolarHBondContact O-CA 3.3Å; C16-R43 HydrophobicContact CB-CG 4.16Å; D28-R43 WeakPolarHBondContact OD1-CD 3.29Å; D28-R43 IonicContact OD1-CZ 2.88Å; D28-R43 IonicContact OD1-NE 3.8Å; D28-R43 PolarHBondContact OD1-NE 3.36Å; D28-R43 IonicContact OD2-CZ 3.28Å; D28-R43 IonicContact OD2-NE 3.97Å; D28-R43 PolarHBondContact OD2-NE 3.14Å; D28-R43 IonicContact OD2-NH2 3.14Å; H32-R43 PolarHBondContact CD2-NH1 3.07Å; H32-R43 WeakPolarHBondContact CE1-CD 3.29Å; H32-R43 WeakPolarHBondContact ND1-CD 3.14Å; H32-R43 WeakPolarHBondContact NE2-CD 3.47Å; H41-R43 PolarHBondContact O-NH1 3.15Å; R43-G94 CarbonylContact O-C 3.51Å; R43-G94 WeakPolarHBondContact O-CA 3.47Å; R43-L95 HydrophobicContact CB-CB 4.48Å; R43-L95 PolarHBondContact N-O 3.45Å; R43-L95 PolarHBondContact O-N 2.99Å; R43-G97 PolarHBondContact NH2-O 2.99Å
44	F	92.9	Very high	91.1	Very high	43 Å²	43	54.1 Å²	54.1	19%	0.189	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	167.5	-176.6	-66.6	-95.1	0	0	0	110.6	L14 F15 V42 T54 G94	L14-F44 CarbonylContact C-O 3.57Å; L14-F44 VanDerWaalsContact CA-O 3.31Å; L14-F44 WeakPolarHBondContact CA-O 3.27Å; F15-F44 PolarHBondContact N-O 3.36Å; F15-F44 PolarHBondContact O-N 3.47Å; V42-F44 HydrophobicContact CB-CE2 4.25Å; V42-F44 HydrophobicContact CG1-CD2 4.29Å; V42-F44 HydrophobicContact CG1-CE2 3.45Å; V42-F44 VanDerWaalsContact CG1-CE2 3.45Å; V42-F44 HydrophobicContact CG1-CZ 3.7Å; F44-T54 HydrophobicContact CB-CG2 3.95Å; F44-T54 HydrophobicContact CD2-CG2 3.63Å; F44-T54 HydrophobicContact CG-CG2 4.12Å; F44-G94 VanDerWaalsContact CE1-N 3.33Å
45	Q	92.3	Very high	91.2	Very high	14 Å²	14	51.5 Å²	51.5	7%	0.065	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	151.2	165.6	-74.6	-176.8	75.6	0	0	110.6	A55 V65 A107 L108	Q45-A55 HydrophobicContact CB-CB 4.16Å; Q45-A55 VanDerWaalsContact O-CB 3.27Å; Q45-A55 WeakPolarHBondContact O-CB 3.48Å; Q45-A55 PolarHBondContact O-N 2.89Å; Q45-V65 HydrophobicContact CB-CG1 3.67Å; Q45-V65 HydrophobicContact CG-CG1 4.42Å; Q45-A107 PolarHBondContact NE2-O 3.47Å; Q45-L108 HydrophobicContact CG-CD2 3.18Å; Q45-L108 PolarHBondContact NE2-O 3.31Å; Q45-L108 VanDerWaalsContact NE2-O 3.14Å
46	I	93.1	Very high	91.2	Very high	20 Å²	20	49.8 Å²	49.8	10%	0.103	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-74.8	137	172.6	-63.1	162.3	0	0	0	108.7	A12 L13 F15 K22 D48 K51	A12-I46 HydrophobicContact CB-CD1 3.67Å; A12-I46 WeakPolarHBondContact O-CD1 3.42Å; L13-I46 PolarHBondContact O-N 2.82Å; F15-I46 HydrophobicContact CB-CG1 3.94Å; K22-I46 HydrophobicContact CB-CD1 4.23Å; K22-I46 HydrophobicContact CG-CD1 4.36Å; I46-D48 PolarHBondContact O-N 3.28Å; I46-K51 HydrophobicContact CG2-CB 4.24Å
47	C	92.6	Very high	91.1	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-60.3	128.1	173.8	178.7	0	0	0	0	111.4	S49 C50 K51 D53 A55 V65 C67	C47-S49 VanDerWaalsContact C-N 3.32Å; C47-S49 PolarHBondContact O-N 2.92Å; C47-C50 VanDerWaalsContact CB-SG 3.54Å; C47-C50 PolarHBondContact SG-SG 3.09Å; C47-K51 WeakPolarHBondContact O-CA 3.3Å; C47-K51 PolarHBondContact O-N 3.47Å; C47-D53 WeakPolarHBondContact CB-O 3.48Å; C47-D53 PolarHBondContact N-O 2.81Å; C47-D53 VanDerWaalsContact N-O 3.14Å; C47-A55 HydrophobicContact CB-CB 4.49Å; C47-V65 WeakPolarHBondContact CA-O 3.17Å; C47-C67 HydrophobicContact CB-CB 4.03Å; C47-C67 PolarHBondContact SG-N 3.34Å
48	D	90	Very high	91	Very high	44 Å²	44	43.5 Å²	43.5	24%	0.235	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-35.4	-178.5	-71	-33.4	0	0	0	112.1	I46 L64 V65	I46-D48 PolarHBondContact O-N 3.28Å; D48-L64 HydrophobicContact CB-CD2 4.22Å; D48-V65 PolarHBondContact N-O 3.49Å; D48-V65 PolarHBondContact OD2-N 2.86Å
49	S	89.6	Confident	90.8	Very high	71 Å²	71	43.3 Å²	43.3	50%	0.497	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-62.5	-177.1	-56.1	0	0	0	0	113.2	C47 L66	C47-S49 VanDerWaalsContact C-N 3.32Å; C47-S49 PolarHBondContact O-N 2.92Å; S49-L66 WeakPolarHBondContact OG-CD2 3.27Å
50	C	91.7	Very high	90.4	Very high	46 Å²	46	42.6 Å²	42.6	31%	0.311	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.2	-174.3	66.9	0	0	0	0	113.7	C47 S52 C70	C47-C50 VanDerWaalsContact CB-SG 3.54Å; C47-C50 PolarHBondContact SG-SG 3.09Å; C50-S52 PolarHBondContact O-N 3.3Å; C50-S52 PolarHBondContact SG-OG 3.5Å; C50-C70 VanDerWaalsContact CB-SG 3.6Å
51	K	89.6	Confident	90	Very high	91 Å²	91	38.9 Å²	38.9	40%	0.396	22%	0.22	S	C	.	.	S	Bend	trans	55	6.9	-176.4	-52.4	172.8	-179.6	164.8	0	115.2	L2 K22 I46 C47	L2-K51 HydrophobicContact CD1-CB 3.7Å; L2-K51 HydrophobicContact CD1-CD 4.46Å; L2-K51 HydrophobicContact CG-CB 4.43Å; L2-K51 HydrophobicContact CG-CD 4.31Å; K22-K51 WeakPolarHBondContact CE-O 3.3Å; K22-K51 PolarHBondContact NZ-O 3.49Å; I46-K51 HydrophobicContact CG2-CB 4.24Å; C47-K51 WeakPolarHBondContact O-CA 3.3Å; C47-K51 PolarHBondContact O-N 3.47Å
52	S	87.6	Confident	89.4	Confident	73 Å²	73	41.2 Å²	41.2	51%	0.51	23%	0.232	S	C	.	.	S	Bend	trans	-101.2	-30.2	-175	57.5	0	0	0	0	112.5	K22 C50	K22-S52 PolarHBondContact NZ-O 2.95Å; C50-S52 PolarHBondContact O-N 3.3Å; C50-S52 PolarHBondContact SG-OG 3.5Å
53	D	87.3	Confident	89	Confident	54 Å²	54	42 Å²	42	29%	0.289	23%	0.233	S	C	.	.	S	Bend	trans	-119.2	164.5	-171.1	-157.6	-3.7	0	0	0	113.3	C47 C67	C47-D53 WeakPolarHBondContact CB-O 3.48Å; C47-D53 PolarHBondContact N-O 2.81Å; C47-D53 VanDerWaalsContact N-O 3.14Å; D53-C67 HydrophobicContact CB-CB 3.9Å
54	T	91.5	Very high	88.8	Confident	9 Å²	9	43.8 Å²	43.8	6%	0.055	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-60.8	127.8	171.4	50.6	0	0	0	0	110.8	F15 R17 F44 V56 C67	F15-T54 HydrophobicContact CD1-CG2 3.46Å; F15-T54 VanDerWaalsContact CD1-CG2 3.46Å; F15-T54 HydrophobicContact CE1-CG2 4.08Å; F15-T54 HydrophobicContact CG-CG2 4.5Å; R17-T54 HydrophobicContact CB-CG2 4.11Å; F44-T54 HydrophobicContact CB-CG2 3.95Å; F44-T54 HydrophobicContact CD2-CG2 3.63Å; F44-T54 HydrophobicContact CG-CG2 4.12Å; T54-V56 PolarHBondContact O-N 2.83Å; T54-C67 WeakPolarHBondContact O-CA 3.46Å; T54-C67 WeakPolarHBondContact O-CB 3.17Å
55	A	91.2	Very high	88.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.			trans	-81.4	121.3	171.2	0	0	0	0	0	110.4	Q45 C47 V65 L66	Q45-A55 HydrophobicContact CB-CB 4.16Å; Q45-A55 VanDerWaalsContact O-CB 3.27Å; Q45-A55 WeakPolarHBondContact O-CB 3.48Å; Q45-A55 PolarHBondContact O-N 2.89Å; C47-A55 HydrophobicContact CB-CB 4.49Å; A55-V65 HydrophobicContact CB-CB 4.33Å; A55-V65 HydrophobicContact CB-CG1 3.11Å; A55-L66 CarbonylContact C-O 3.52Å; A55-L66 WeakPolarHBondContact CA-O 3.41Å
56	V	88.4	Confident	88.6	Confident	44 Å²	44	41.1 Å²	41.1	27%	0.267	23%	0.231	S	C	.	.			trans	-107.4	-15.3	-175.7	-71.8	0	0	0	0	111.9	T54 L66 H68 R91 L92	T54-V56 PolarHBondContact O-N 2.83Å; V56-L66 PolarHBondContact N-O 3.36Å; V56-H68 HydrophobicContact CG2-CB 4.12Å; V56-R91 WeakPolarHBondContact O-CA 3.38Å; V56-L92 PolarHBondContact O-N 2.78Å
57	L	88.4	Confident	88.5	Confident	19 Å²	19	40.3 Å²	40.3	10%	0.099	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142	-173.6	-66.2	163.3	0	0	0	109.7	V65 L66 D71 H89 R90 R91	L57-V65 CarbonylContact O-C 3.51Å; L57-V65 WeakPolarHBondContact O-CA 3.3Å; L57-L66 PolarHBondContact N-O 3.37Å; L57-L66 VanDerWaalsContact N-O 3.09Å; L57-L66 PolarHBondContact O-N 3.26Å; L57-D71 HydrophobicContact CD1-CB 3.76Å; L57-D71 WeakPolarHBondContact CD1-OD2 3.05Å; L57-H89 HydrophobicContact CD2-CB 4.22Å; L57-R90 CarbonylContact C-O 3.6Å; L57-R90 WeakPolarHBondContact CA-O 3.39Å; L57-R91 HydrophobicContact CD2-CG 3.71Å
58	R	89.4	Confident	88.4	Confident	53 Å²	53	45.8 Å²	45.8	20%	0.2	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123	165.3	179.5	175.1	176.3	-179.8	-2.6	108.7	L64 V65 H89 R90 L92 G109	R58-L64 WeakPolarHBondContact CA-O 3.45Å; R58-V65 HydrophobicContact CB-CG2 4.2Å; R58-V65 HydrophobicContact CG-CG2 4.05Å; R58-H89 WeakPolarHBondContact O-CA 3.34Å; R58-R90 PolarHBondContact N-O 2.77Å; R58-R90 PolarHBondContact O-N 2.77Å; R58-L92 HydrophobicContact CB-CD1 4.35Å; R58-L92 HydrophobicContact CB-CD2 3.93Å; R58-L92 HydrophobicContact CB-CG 4.2Å; R58-G109 PolarHBondContact NH1-O 3.14Å
59	C	87.5	Confident	88.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	117.9	172.3	-177	0	0	0	0	109.2	T61 N63 L64 H75	C59-T61 VanDerWaalsContact C-N 3.32Å; C59-T61 PolarHBondContact SG-OG1 3.03Å; C59-N63 VanDerWaalsContact O-CA 3.28Å; C59-N63 WeakPolarHBondContact O-CA 3.48Å; C59-N63 PolarHBondContact O-N 2.99Å; C59-L64 PolarHBondContact N-O 3.29Å; C59-L64 PolarHBondContact O-N 2.9Å; C59-H75 PolarHBondContact SG-CE1 2.89Å; C59-H75 PolarHBondContact SG-NE2 2.99Å
60	S	83.5	Confident	88.6	Confident	53 Å²	53	45.9 Å²	45.9	37%	0.371	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-27.2	179.6	65.3	0	0	0	0	113.3	H88	S60-H88 PolarHBondContact N-O 2.8Å; S60-H88 WeakPolarHBondContact OG-CB 3.33Å; S60-H88 PolarHBondContact OG-O 3.14Å
61	T	82.8	Confident	88.4	Confident	70 Å²	70	44.5 Å²	44.5	43%	0.429	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-39.8	-176.8	61.8	0	0	0	0	111.6	C59 H87	C59-T61 VanDerWaalsContact C-N 3.32Å; C59-T61 PolarHBondContact SG-OG1 3.03Å; T61-H87 WeakPolarHBondContact CG2-ND1 3.44Å; T61-H87 PolarHBondContact OG1-CE1 3.46Å; T61-H87 PolarHBondContact OG1-ND1 3.05Å
62	H	82.2	Confident	88.3	Confident	92 Å²	92	43.6 Å²	43.6	43%	0.426	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-8.6	180	-56.1	137	0	0	0	112.6	L64 H75 H87	H62-L64 HydrophobicContact CB-CB 4.29Å; H62-L64 HydrophobicContact CB-CD1 3.97Å; H62-L64 HydrophobicContact CB-CG 3.88Å; H62-L64 WeakPolarHBondContact O-CG 3.24Å; H62-L64 PolarHBondContact O-N 3.22Å; H62-L64 VanDerWaalsContact O-N 3.14Å; H62-H75 AromaticContact CE1-CE1 3.2Å; H62-H75 PolarHBondContact CE1-CE1 2.99Å; H62-H75 AromaticContact CE1-NE2 3.92Å; H62-H75 AromaticContact ND1-CE1 3.19Å; H62-H75 PolarHBondContact ND1-CE1 3.45Å; H62-H75 AromaticContact ND1-NE2 3.47Å; H62-H75 PolarHBondContact ND1-NE2 3.33Å; H62-H87 AromaticContact CE1-CE1 3.68Å; H62-H87 AromaticContact NE2-CE1 3.91Å
63	N	84.6	Confident	88.3	Confident	82 Å²	82	46.1 Å²	46.1	44%	0.439	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	26	-170.4	-73.5	-50.8	0	0	0	113.8	C59 R139	C59-N63 VanDerWaalsContact O-CA 3.28Å; C59-N63 WeakPolarHBondContact O-CA 3.48Å; C59-N63 PolarHBondContact O-N 2.99Å; N63-R139 VanDerWaalsContact O-CD 3.23Å; N63-R139 WeakPolarHBondContact O-CD 3.3Å; N63-R139 VanDerWaalsContact O-CG 3.32Å; N63-R139 WeakPolarHBondContact O-CG 3.49Å; N63-R139 PolarHBondContact O-NE 3.48Å
64	L	87.6	Confident	88.1	Confident	41 Å²	41	46 Å²	46	22%	0.215	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	150.9	180	-62.6	178.4	0	0	0	111.7	D48 R58 C59 H62 L66	D48-L64 HydrophobicContact CB-CD2 4.22Å; R58-L64 WeakPolarHBondContact CA-O 3.45Å; C59-L64 PolarHBondContact N-O 3.29Å; C59-L64 PolarHBondContact O-N 2.9Å; H62-L64 HydrophobicContact CB-CB 4.29Å; H62-L64 HydrophobicContact CB-CD1 3.97Å; H62-L64 HydrophobicContact CB-CG 3.88Å; H62-L64 WeakPolarHBondContact O-CG 3.24Å; H62-L64 PolarHBondContact O-N 3.22Å; H62-L64 VanDerWaalsContact O-N 3.14Å; L64-L66 HydrophobicContact CB-CD2 4.11Å; L64-L66 HydrophobicContact CB-CG 4.19Å
65	V	89.8	Confident	87.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	112.7	176.7	172.1	0	0	0	0	108.1	Q45 C47 D48 A55 L57 R58 L92	Q45-V65 HydrophobicContact CB-CG1 3.67Å; Q45-V65 HydrophobicContact CG-CG1 4.42Å; C47-V65 WeakPolarHBondContact CA-O 3.17Å; D48-V65 PolarHBondContact N-O 3.49Å; D48-V65 PolarHBondContact OD2-N 2.86Å; A55-V65 HydrophobicContact CB-CB 4.33Å; A55-V65 HydrophobicContact CB-CG1 3.11Å; L57-V65 CarbonylContact O-C 3.51Å; L57-V65 WeakPolarHBondContact O-CA 3.3Å; R58-V65 HydrophobicContact CB-CG2 4.2Å; R58-V65 HydrophobicContact CG-CG2 4.05Å; V65-L92 HydrophobicContact CB-CD1 4.39Å; V65-L92 HydrophobicContact CG1-CD1 3.37Å; V65-L92 HydrophobicContact CG2-CD1 4.24Å
66	L	91.2	Very high	86.6	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.5	-165.1	-58.9	178.9	0	0	0	112.2	S49 A55 V56 L57 L64 C70 D71 A74	S49-L66 WeakPolarHBondContact OG-CD2 3.27Å; A55-L66 CarbonylContact C-O 3.52Å; A55-L66 WeakPolarHBondContact CA-O 3.41Å; V56-L66 PolarHBondContact N-O 3.36Å; L57-L66 PolarHBondContact N-O 3.37Å; L57-L66 VanDerWaalsContact N-O 3.09Å; L57-L66 PolarHBondContact O-N 3.26Å; L64-L66 HydrophobicContact CB-CD2 4.11Å; L64-L66 HydrophobicContact CB-CG 4.19Å; L66-C70 HydrophobicContact CB-CB 4.45Å; L66-C70 HydrophobicContact CD2-CB 4.33Å; L66-D71 HydrophobicContact CB-CB 4.17Å; L66-D71 HydrophobicContact CD1-CB 4.45Å; L66-A74 HydrophobicContact CD1-CB 4.26Å
67	C	92.7	Very high	85.4	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.02	29%	0.289	C	S	.	.			trans	-75.7	167.7	164.5	74.6	0	0	0	0	110.3	C47 D53 T54 N69 C70 D71	C47-C67 HydrophobicContact CB-CB 4.03Å; C47-C67 PolarHBondContact SG-N 3.34Å; D53-C67 HydrophobicContact CB-CB 3.9Å; T54-C67 WeakPolarHBondContact O-CA 3.46Å; T54-C67 WeakPolarHBondContact O-CB 3.17Å; C67-N69 VanDerWaalsContact C-N 3.29Å; C67-N69 PolarHBondContact O-N 3.44Å; C67-C70 PolarHBondContact O-N 2.94Å; C67-C70 PolarHBondContact SG-N 3.37Å; C67-D71 VanDerWaalsContact O-CB 3.32Å; C67-D71 WeakPolarHBondContact O-CB 3.34Å; C67-D71 PolarHBondContact O-N 3.33Å
68	H	90.1	Very high	83.9	Confident	115 Å²	115	51.7 Å²	51.7	53%	0.532	30%	0.301	S	S	.	.	H	α-helix	trans	-57.3	-42.1	-176.9	-176.7	52.5	0	0	0	112.9	V56 D71 V72	V56-H68 HydrophobicContact CG2-CB 4.12Å; H68-D71 PolarHBondContact O-N 2.83Å; H68-V72 WeakPolarHBondContact O-CG2 3.23Å; H68-V72 PolarHBondContact O-N 2.82Å
69	N	91.6	Very high	82.4	Confident	100 Å²	100	52.5 Å²	52.5	54%	0.535	32%	0.319	S	S	.	.	H	α-helix	trans	-69.4	-48	-178.2	-62.2	-5.7	0	0	0	111.2	C67 D71 V72 D73	C67-N69 VanDerWaalsContact C-N 3.29Å; C67-N69 PolarHBondContact O-N 3.44Å; N69-D71 PolarHBondContact O-N 3.25Å; N69-V72 PolarHBondContact O-N 3.08Å; N69-V72 VanDerWaalsContact O-N 3.14Å; N69-D73 PolarHBondContact O-N 3.43Å
70	C	91.4	Very high	80.9	Confident	17 Å²	17	57.9 Å²	57.9	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-30	178.3	-65.7	0	0	0	0	112.7	C50 L66 C67 A74	C50-C70 VanDerWaalsContact CB-SG 3.6Å; L66-C70 HydrophobicContact CB-CB 4.45Å; L66-C70 HydrophobicContact CD2-CB 4.33Å; C67-C70 PolarHBondContact O-N 2.94Å; C67-C70 PolarHBondContact SG-N 3.37Å; C70-A74 WeakPolarHBondContact O-CB 3.44Å; C70-A74 PolarHBondContact O-N 3.46Å
71	D	88.7	Confident	79.6	Confident	18 Å²	18	58.4 Å²	58.4	10%	0.096	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-46.3	172.4	-175.8	78.6	0	0	0	111.2	L57 L66 C67 H68 N69 D73 A74 H75 H89	L57-D71 HydrophobicContact CD1-CB 3.76Å; L57-D71 WeakPolarHBondContact CD1-OD2 3.05Å; L66-D71 HydrophobicContact CB-CB 4.17Å; L66-D71 HydrophobicContact CD1-CB 4.45Å; C67-D71 VanDerWaalsContact O-CB 3.32Å; C67-D71 WeakPolarHBondContact O-CB 3.34Å; C67-D71 PolarHBondContact O-N 3.33Å; H68-D71 PolarHBondContact O-N 2.83Å; N69-D71 PolarHBondContact O-N 3.25Å; D71-D73 VanDerWaalsContact C-N 3.33Å; D71-D73 PolarHBondContact O-N 2.89Å; D71-A74 PolarHBondContact O-N 3.47Å; D71-H75 VanDerWaalsContact O-CB 3.29Å; D71-H75 WeakPolarHBondContact O-CB 3.31Å; D71-H75 PolarHBondContact O-N 3.15Å; D71-H75 IonicContact OD1-CD2 2.8Å; D71-H89 IonicContact OD1-CE1 3.89Å; D71-H89 PolarHBondContact OD1-CE1 3.01Å; D71-H89 IonicContact OD1-ND1 3.76Å; D71-H89 PolarHBondContact OD1-ND1 3.41Å; D71-H89 IonicContact OD2-CE1 2.72Å; D71-H89 IonicContact OD2-ND1 3.15Å
72	V	87.1	Confident	78.4	Confident	72 Å²	72	63.9 Å²	63.9	44%	0.436	39%	0.386	S	S	.	.	H	α-helix	trans	-64.4	-37.4	174.7	175.1	0	0	0	0	111.6	H68 N69 G76	H68-V72 WeakPolarHBondContact O-CG2 3.23Å; H68-V72 PolarHBondContact O-N 2.82Å; N69-V72 PolarHBondContact O-N 3.08Å; N69-V72 VanDerWaalsContact O-N 3.14Å; V72-G76 WeakPolarHBondContact O-CA 3.42Å; V72-G76 PolarHBondContact O-N 3Å
73	D	87.4	Confident	77.2	Confident	126 Å²	126	67.6 Å²	67.6	67%	0.674	40%	0.403	S	S	*	.	H	α-helix	trans	-68.9	-37.8	177.4	-63.6	-30.7	0	0	0	111.5	N69 D71	N69-D73 PolarHBondContact O-N 3.43Å; D71-D73 VanDerWaalsContact C-N 3.33Å; D71-D73 PolarHBondContact O-N 2.89Å
74	A	83.7	Confident	75.8	Confident	50 Å²	50	69 Å²	69	41%	0.413	41%	0.407	S	S	.	.	H	α-helix	trans	-80.2	-31.2	-179.2	0	0	0	0	0	113.6	L66 C70 D71	L66-A74 HydrophobicContact CD1-CB 4.26Å; C70-A74 WeakPolarHBondContact O-CB 3.44Å; C70-A74 PolarHBondContact O-N 3.46Å; D71-A74 PolarHBondContact O-N 3.47Å
75	H	80.3	Confident	74.5	Confident	18 Å²	18	74.2 Å²	74.2	8%	0.083	43%	0.429	C	S	.	.	H	α-helix	trans	-124.1	-10	-170.5	-64.4	-73.1	0	0	0	114.5	C59 H62 D71 D78 H87 H89	C59-H75 PolarHBondContact SG-CE1 2.89Å; C59-H75 PolarHBondContact SG-NE2 2.99Å; H62-H75 AromaticContact CE1-CE1 3.2Å; H62-H75 PolarHBondContact CE1-CE1 2.99Å; H62-H75 AromaticContact CE1-NE2 3.92Å; H62-H75 AromaticContact ND1-CE1 3.19Å; H62-H75 PolarHBondContact ND1-CE1 3.45Å; H62-H75 AromaticContact ND1-NE2 3.47Å; H62-H75 PolarHBondContact ND1-NE2 3.33Å; D71-H75 VanDerWaalsContact O-CB 3.29Å; D71-H75 WeakPolarHBondContact O-CB 3.31Å; D71-H75 PolarHBondContact O-N 3.15Å; D71-H75 IonicContact OD1-CD2 2.8Å; H75-D78 PolarHBondContact O-N 3.48Å; H75-H87 AromaticContact CE1-CD2 3.76Å; H75-H87 AromaticContact CE1-CE1 3.75Å; H75-H87 AromaticContact CE1-CG 3.47Å; H75-H87 VanDerWaalsContact CE1-CG 3.47Å; H75-H87 AromaticContact CE1-ND1 3.47Å; H75-H87 PolarHBondContact CE1-ND1 2.89Å; H75-H87 AromaticContact CE1-NE2 3.9Å; H75-H87 AromaticContact ND1-CD2 3.22Å; H75-H87 PolarHBondContact ND1-CD2 3.05Å; H75-H87 AromaticContact ND1-CE1 3.8Å; H75-H87 AromaticContact ND1-CG 3.39Å; H75-H87 AromaticContact ND1-ND1 3.75Å; H75-H87 AromaticContact ND1-NE2 3.49Å; H75-H87 PolarHBondContact ND1-NE2 3.3Å; H75-H89 AromaticContact CD2-CE1 3.38Å; H75-H89 PolarHBondContact CD2-CE1 2.83Å; H75-H89 AromaticContact CG-CE1 3.56Å; H75-H89 AromaticContact NE2-CE1 3.79Å
76	G	70.9	Confident	73.2	Confident	36 Å²	36	82.4 Å²	82.4	37%	0.371	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-75.5	-21.3	-179.5	0	0	0	0	0	114	V72 D78 A79	V72-G76 WeakPolarHBondContact O-CA 3.42Å; V72-G76 PolarHBondContact O-N 3Å; G76-D78 PolarHBondContact O-N 2.92Å; G76-A79 PolarHBondContact O-N 2.97Å
77	A	63.2	Low	72.2	Confident	74 Å²	74	84 Å²	84	61%	0.612	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-65.8	-27.4	174.6	0	0	0	0	0	112.4	A79	A77-A79 VanDerWaalsContact C-N 3.34Å; A77-A79 PolarHBondContact O-N 3.43Å
78	D	57	Low	71.3	Confident	65 Å²	65	89.9 Å²	89.9	35%	0.348	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-87	-4.4	-174.7	-59.7	-30	0	0	0	113.5	H75 G76 S80 S81 H84 H87	H75-D78 PolarHBondContact O-N 3.48Å; G76-D78 PolarHBondContact O-N 2.92Å; D78-S80 PolarHBondContact O-N 3.38Å; D78-S81 PolarHBondContact O-N 3.32Å; D78-H84 PolarHBondContact O-ND1 3.21Å; D78-H87 IonicContact OD2-NE2 3.22Å
79	A	56.5	Low	70.8	Confident	69 Å²	69	87.7 Å²	87.7	57%	0.57	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-68	-14.2	175.7	0	0	0	0	0	113.1	G76 A77 H84	G76-A79 PolarHBondContact O-N 2.97Å; A77-A79 VanDerWaalsContact C-N 3.34Å; A77-A79 PolarHBondContact O-N 3.43Å; A79-H84 PolarHBondContact O-CE1 2.89Å
80	S	57.8	Low	70.4	Confident	113 Å²	113	87.8 Å²	87.8	79%	0.79	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-101.8	-6.7	-179.3	-56.9	0	0	0	0	114.2	D78	D78-S80 PolarHBondContact O-N 3.38Å
81	S	55.7	Low	70.2	Confident	64 Å²	64	96.8 Å²	96.8	45%	0.448	52%	0.516	S	S	.	.	S	Bend	trans	-98.3	126.9	-176.7	-64.7	0	0	0	0	110.3	D78 H83	D78-S81 PolarHBondContact O-N 3.32Å; S81-H83 CarbonylContact O-C 3.45Å; S81-H83 PolarHBondContact O-N 3.32Å
82	L	57.7	Low	70.1	Confident	186 Å²	186	96.8 Å²	96.8	97%	0.974	52%	0.516	S	S	*	.	S	Bend	trans	-56.5	-12.1	-179.7	-98.8	93.5	0	0	0	114.9
83	H	56.9	Low	70	Confident	170 Å²	170	100.5 Å²	100.5	79%	0.787	53%	0.528	S	S	*	.	S	Bend	trans	-99.8	82.2	167.2	-83.1	-68.1	0	0	0	109.7	S81 H85	S81-H83 CarbonylContact O-C 3.45Å; S81-H83 PolarHBondContact O-N 3.32Å; H83-H85 PolarHBondContact O-N 3.14Å
84	H	55.2	Low	70.1	Confident	111 Å²	111	95.9 Å²	95.9	51%	0.514	51%	0.51	S	S	.	.			trans	-65.4	100.3	165.5	-72.4	-34.4	0	0	0	108.7	D78 A79 H86	D78-H84 PolarHBondContact O-ND1 3.21Å; A79-H84 PolarHBondContact O-CE1 2.89Å; H84-H86 VanDerWaalsContact C-N 3.29Å; H84-H86 PolarHBondContact O-N 2.95Å
85	H	59.4	Low	70.4	Confident	150 Å²	150	94 Å²	94	69%	0.694	49%	0.494	S	S	*	.			trans	-63.6	103.1	152.5	-93	-68.6	0	0	0	106.2	H83 H87	H83-H85 PolarHBondContact O-N 3.14Å; H85-H87 PolarHBondContact O-CD2 3.47Å; H85-H87 VanDerWaalsContact O-CD2 3.24Å; H85-H87 PolarHBondContact O-N 3.47Å
86	H	63.4	Low	70.8	Confident	172 Å²	172	96.1 Å²	96.1	80%	0.796	51%	0.51	S	S	*	.			trans	-62.7	89.5	171.3	-85	-65.9	0	0	0	108.3	H84 H88	H84-H86 VanDerWaalsContact C-N 3.29Å; H84-H86 PolarHBondContact O-N 2.95Å; H86-H88 PolarHBondContact O-N 3.36Å
87	H	70.2	Confident	71.6	Confident	34 Å²	34	95 Å²	95	16%	0.157	50%	0.499	C	S	.	.			trans	-64.3	122.6	165.4	-67.5	-73.5	0	0	0	107	T61 H62 H75 D78 H85 H89	T61-H87 WeakPolarHBondContact CG2-ND1 3.44Å; T61-H87 PolarHBondContact OG1-CE1 3.46Å; T61-H87 PolarHBondContact OG1-ND1 3.05Å; H62-H87 AromaticContact CE1-CE1 3.68Å; H62-H87 AromaticContact NE2-CE1 3.91Å; H75-H87 AromaticContact CE1-CD2 3.76Å; H75-H87 AromaticContact CE1-CE1 3.75Å; H75-H87 AromaticContact CE1-CG 3.47Å; H75-H87 VanDerWaalsContact CE1-CG 3.47Å; H75-H87 AromaticContact CE1-ND1 3.47Å; H75-H87 PolarHBondContact CE1-ND1 2.89Å; H75-H87 AromaticContact CE1-NE2 3.9Å; H75-H87 AromaticContact ND1-CD2 3.22Å; H75-H87 PolarHBondContact ND1-CD2 3.05Å; H75-H87 AromaticContact ND1-CE1 3.8Å; H75-H87 AromaticContact ND1-CG 3.39Å; H75-H87 AromaticContact ND1-ND1 3.75Å; H75-H87 AromaticContact ND1-NE2 3.49Å; H75-H87 PolarHBondContact ND1-NE2 3.3Å; D78-H87 IonicContact OD2-NE2 3.22Å; H85-H87 PolarHBondContact O-CD2 3.47Å; H85-H87 VanDerWaalsContact O-CD2 3.24Å; H85-H87 PolarHBondContact O-N 3.47Å; H87-H89 WeakPolarHBondContact CB-NE2 3.36Å; H87-H89 PolarHBondContact O-CD2 3.38Å; H87-H89 PolarHBondContact O-N 2.76Å; H87-H89 VanDerWaalsContact O-N 3.17Å
88	H	73.3	Confident	72.5	Confident	127 Å²	127	95.4 Å²	95.4	59%	0.588	50%	0.496	S	S	*	.			trans	-84.9	94.7	178.4	176.2	-66.9	0	0	0	108.4	S60 H86	S60-H88 PolarHBondContact N-O 2.8Å; S60-H88 WeakPolarHBondContact OG-CB 3.33Å; S60-H88 PolarHBondContact OG-O 3.14Å; H86-H88 PolarHBondContact O-N 3.36Å
89	H	79.2	Confident	73.7	Confident	69 Å²	69	92.8 Å²	92.8	32%	0.319	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.1	176.3	-51.2	-107.7	0	0	0	109.8	L57 R58 D71 H75 H87	L57-H89 HydrophobicContact CD2-CB 4.22Å; R58-H89 WeakPolarHBondContact O-CA 3.34Å; D71-H89 IonicContact OD1-CE1 3.89Å; D71-H89 PolarHBondContact OD1-CE1 3.01Å; D71-H89 IonicContact OD1-ND1 3.76Å; D71-H89 PolarHBondContact OD1-ND1 3.41Å; D71-H89 IonicContact OD2-CE1 2.72Å; D71-H89 IonicContact OD2-ND1 3.15Å; H75-H89 AromaticContact CD2-CE1 3.38Å; H75-H89 PolarHBondContact CD2-CE1 2.83Å; H75-H89 AromaticContact CG-CE1 3.56Å; H75-H89 AromaticContact NE2-CE1 3.79Å; H87-H89 WeakPolarHBondContact CB-NE2 3.36Å; H87-H89 PolarHBondContact O-CD2 3.38Å; H87-H89 PolarHBondContact O-N 2.76Å; H87-H89 VanDerWaalsContact O-N 3.17Å
90	R	84.2	Confident	74.9	Confident	103 Å²	103	92 Å²	92	39%	0.389	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.5	170.4	-176.2	176.8	174.6	-162.4	1.3	108.9	L57 R58 L92 D111	L57-R90 CarbonylContact C-O 3.6Å; L57-R90 WeakPolarHBondContact CA-O 3.39Å; R58-R90 PolarHBondContact N-O 2.77Å; R58-R90 PolarHBondContact O-N 2.77Å; R90-L92 PolarHBondContact O-N 2.75Å; R90-D111 IonicContact CZ-OD2 2.81Å; R90-D111 VanDerWaalsContact CZ-OD2 3.28Å; R90-D111 IonicContact NH1-OD2 3.86Å; R90-D111 PolarHBondContact NH1-OD2 3.06Å; R90-D111 IonicContact NH2-OD2 3.5Å; R90-D111 PolarHBondContact NH2-OD2 3.33Å
91	R	86.9	Confident	76.1	Confident	205 Å²	205	88.2 Å²	88.2	77%	0.774	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	129.7	168.9	-76.4	-172.7	175.6	-164.8	-0.6	109.8	V56 L57	V56-R91 WeakPolarHBondContact O-CA 3.38Å; L57-R91 HydrophobicContact CD2-CG 3.71Å
92	L	85.5	Confident	77.3	Confident	18 Å²	18	88.9 Å²	88.9	9%	0.094	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-85.1	140.4	176.7	-65.5	177.1	0	0	0	110.1	V56 R58 V65 R90	V56-L92 PolarHBondContact O-N 2.78Å; R58-L92 HydrophobicContact CB-CD1 4.35Å; R58-L92 HydrophobicContact CB-CD2 3.93Å; R58-L92 HydrophobicContact CB-CG 4.2Å; V65-L92 HydrophobicContact CB-CD1 4.39Å; V65-L92 HydrophobicContact CG1-CD1 3.37Å; V65-L92 HydrophobicContact CG2-CD1 4.24Å; R90-L92 PolarHBondContact O-N 2.75Å
93	H	85.9	Confident	78.7	Confident	151 Å²	151	85.1 Å²	85.1	70%	0.699	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-84.8	136.4	174.6	-76.4	-94.1	0	0	0	110.1
94	G	88.8	Confident	80	Confident	29 Å²	29	77 Å²	77	30%	0.299	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-76.9	141.6	174.3	0	0	0	0	0	111.4	R43 F44	R43-G94 CarbonylContact O-C 3.51Å; R43-G94 WeakPolarHBondContact O-CA 3.47Å; F44-G94 VanDerWaalsContact CE1-N 3.33Å
95	L	89.9	Confident	81.4	Confident	11 Å²	11	72 Å²	72	6%	0.058	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-84.3	126.8	173.1	-66.7	175.1	0	0	0	109.7	L14 V42 R43 P99 I104 A107	L14-L95 HydrophobicContact CD1-CD1 4.02Å; L14-L95 HydrophobicContact CD2-CD1 4Å; V42-L95 CarbonylContact C-O 3.54Å; V42-L95 WeakPolarHBondContact CA-O 3.38Å; R43-L95 HydrophobicContact CB-CB 4.48Å; R43-L95 PolarHBondContact N-O 3.45Å; R43-L95 PolarHBondContact O-N 2.99Å; L95-P99 HydrophobicContact CB-CG 4.36Å; L95-P99 HydrophobicContact CD1-CG 4.42Å; L95-P99 HydrophobicContact CD2-CB 3.9Å; L95-P99 HydrophobicContact CD2-CG 4.03Å; L95-I104 HydrophobicContact CD1-CG1 4.3Å; L95-A107 HydrophobicContact CD1-CB 4.23Å; L95-A107 HydrophobicContact CD2-CB 3.36Å; L95-A107 HydrophobicContact CG-CB 3.71Å
96	S	89.7	Confident	82.6	Confident	62 Å²	62	67.5 Å²	67.5	43%	0.434	35%	0.351	S	S	.	.			trans	-130.5	159.5	173.5	178.9	0	0	0	0	108.5
97	G	87.5	Confident	83.6	Confident	13 Å²	13	60 Å²	60	13%	0.134	32%	0.318	C	S	.	.	S	Bend	trans	72.1	-146.4	-179.9	0	0	0	0	0	113.1	L39 R43 P99	L39-G97 WeakPolarHBondContact O-CA 3.5Å; L39-G97 PolarHBondContact O-N 3.2Å; R43-G97 PolarHBondContact NH2-O 2.99Å; G97-P99 WeakPolarHBondContact O-CD 3.33Å
98	C	81	Confident	84.1	Confident	81 Å²	81	58.5 Å²	58.5	55%	0.547	31%	0.311	S	S	.	.	S	Bend	trans	-112.2	84.1	173.9	-65	0	0	0	0	108.7
99	P	83.5	Confident	84.2	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.071	29%	0.287	C	S	.	.			trans	-68.6	139.3	-175.2	29	-36	0	0	0	110.9	L95 G97 E103 I104	L95-P99 HydrophobicContact CB-CG 4.36Å; L95-P99 HydrophobicContact CD1-CG 4.42Å; L95-P99 HydrophobicContact CD2-CB 3.9Å; L95-P99 HydrophobicContact CD2-CG 4.03Å; G97-P99 WeakPolarHBondContact O-CD 3.33Å; P99-E103 VanDerWaalsContact CA-OE2 3.23Å; P99-E103 WeakPolarHBondContact CA-OE2 3.29Å; P99-E103 HydrophobicContact CB-CB 3.94Å; P99-I104 HydrophobicContact CB-CG1 3.91Å; P99-I104 HydrophobicContact CG-CD1 4.12Å; P99-I104 HydrophobicContact CG-CG1 3.74Å
100	S	82.3	Confident	83.6	Confident	53 Å²	53	50.4 Å²	50.4	37%	0.371	28%	0.277	S	S	.	.			trans	-66.1	161.3	170.5	64.2	0	0	0	0	111.2	P102 E103 I104	S100-P102 WeakPolarHBondContact OG-CG 3.48Å; S100-E103 PolarHBondContact N-OE2 2.85Å; S100-E103 WeakPolarHBondContact O-CB 3.3Å; S100-E103 PolarHBondContact O-N 2.94Å; S100-E103 VanDerWaalsContact O-N 3.08Å; S100-E103 VanDerWaalsContact OG-CG 3.3Å; S100-E103 WeakPolarHBondContact OG-CG 3.34Å; S100-E103 PolarHBondContact OG-OE2 3.31Å; S100-I104 WeakPolarHBondContact O-CG1 3.33Å; S100-I104 PolarHBondContact O-N 2.8Å
101	V	80.9	Confident	82.2	Confident	33 Å²	33	49.1 Å²	49.1	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-49.5	-48.2	176.9	-176.1	0	0	0	0	113	E103 I104 A105 A122 R125 V128	V101-E103 PolarHBondContact O-N 3.06Å; V101-I104 PolarHBondContact O-N 3.42Å; V101-A105 PolarHBondContact O-N 2.9Å; V101-A122 HydrophobicContact CG1-CB 4.11Å; V101-R125 HydrophobicContact CG2-CB 4.47Å; V101-V128 HydrophobicContact CG1-CB 4.31Å; V101-V128 HydrophobicContact CG1-CG2 3.23Å
102	P	82.8	Confident	80.4	Confident	78 Å²	78	44.4 Å²	44.4	51%	0.506	26%	0.263	S	S	.	.	H	α-helix	trans	-68	-31.7	177.8	26.4	-35.8	0	0	0	113.5	S100 A105 S106	S100-P102 WeakPolarHBondContact OG-CG 3.48Å; P102-A105 PolarHBondContact O-N 3.22Å; P102-S106 WeakPolarHBondContact O-CB 3Å; P102-S106 PolarHBondContact O-N 3.33Å; P102-S106 PolarHBondContact O-OG 2.9Å
103	E	85.5	Confident	78.1	Confident	106 Å²	106	54.8 Å²	54.8	50%	0.495	30%	0.301	S	S	.	.	H	α-helix	trans	-67.2	-38.8	175.5	-73	171.3	145.2	0	0	111.5	P99 S100 V101 S106 A107	P99-E103 VanDerWaalsContact CA-OE2 3.23Å; P99-E103 WeakPolarHBondContact CA-OE2 3.29Å; P99-E103 HydrophobicContact CB-CB 3.94Å; S100-E103 PolarHBondContact N-OE2 2.85Å; S100-E103 WeakPolarHBondContact O-CB 3.3Å; S100-E103 PolarHBondContact O-N 2.94Å; S100-E103 VanDerWaalsContact O-N 3.08Å; S100-E103 VanDerWaalsContact OG-CG 3.3Å; S100-E103 WeakPolarHBondContact OG-CG 3.34Å; S100-E103 PolarHBondContact OG-OE2 3.31Å; V101-E103 PolarHBondContact O-N 3.06Å; E103-S106 PolarHBondContact O-N 3.1Å; E103-A107 VanDerWaalsContact O-CB 3.3Å; E103-A107 WeakPolarHBondContact O-CB 2.88Å; E103-A107 PolarHBondContact O-N 3.39Å
104	I	85.4	Confident	75.6	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-49.8	173.9	-63.9	167.6	0	0	0	109.8	L25 L95 P99 S100 V101 S106 A107 L108 V128	L25-I104 HydrophobicContact CD1-CG2 4.25Å; L25-I104 HydrophobicContact CD2-CG2 4.03Å; L95-I104 HydrophobicContact CD1-CG1 4.3Å; P99-I104 HydrophobicContact CB-CG1 3.91Å; P99-I104 HydrophobicContact CG-CD1 4.12Å; P99-I104 HydrophobicContact CG-CG1 3.74Å; S100-I104 WeakPolarHBondContact O-CG1 3.33Å; S100-I104 PolarHBondContact O-N 2.8Å; V101-I104 PolarHBondContact O-N 3.42Å; I104-S106 VanDerWaalsContact C-N 3.29Å; I104-S106 PolarHBondContact O-N 3.03Å; I104-A107 PolarHBondContact O-N 2.77Å; I104-L108 HydrophobicContact CG2-CD1 3.5Å; I104-L108 VanDerWaalsContact CG2-CD1 3.5Å; I104-L108 HydrophobicContact CG2-CG 4.09Å; I104-L108 VanDerWaalsContact O-CB 3.29Å; I104-L108 WeakPolarHBondContact O-CB 3.27Å; I104-L108 WeakPolarHBondContact O-CG 3.19Å; I104-L108 PolarHBondContact O-N 3.43Å; I104-V128 HydrophobicContact CG2-CG1 3.86Å
105	A	84.7	Confident	72.9	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-53.6	-49.2	176.6	0	0	0	0	0	111	V101 P102 A107 L108 G109 L110 F112	V101-A105 PolarHBondContact O-N 2.9Å; P102-A105 PolarHBondContact O-N 3.22Å; A105-A107 PolarHBondContact O-N 3.37Å; A105-L108 CarbonylContact O-C 3.55Å; A105-L108 PolarHBondContact O-N 3.44Å; A105-G109 PolarHBondContact O-N 3.01Å; A105-G109 VanDerWaalsContact O-N 3.15Å; A105-L110 HydrophobicContact CB-CB 4.06Å; A105-L110 WeakPolarHBondContact O-CA 3.42Å; A105-L110 VanDerWaalsContact O-CB 3.29Å; A105-L110 WeakPolarHBondContact O-CB 3.22Å; A105-L110 PolarHBondContact O-N 3.19Å; A105-F112 HydrophobicContact CB-CE2 4.37Å
106	S	83.6	Confident	69.9	Low	57 Å²	57	67.5 Å²	67.5	40%	0.399	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-46.8	179.2	-55.6	0	0	0	0	112.5	P102 E103 I104 L108 G109	P102-S106 WeakPolarHBondContact O-CB 3Å; P102-S106 PolarHBondContact O-N 3.33Å; P102-S106 PolarHBondContact O-OG 2.9Å; E103-S106 PolarHBondContact O-N 3.1Å; I104-S106 VanDerWaalsContact C-N 3.29Å; I104-S106 PolarHBondContact O-N 3.03Å; S106-L108 VanDerWaalsContact C-N 3.27Å; S106-L108 PolarHBondContact O-N 2.87Å; S106-G109 WeakPolarHBondContact O-CA 3.27Å; S106-G109 PolarHBondContact O-N 3.3Å
107	A	84.3	Confident	67.1	Low	13 Å²	13	71 Å²	71	11%	0.107	39%	0.391	C	S	.	.	H	α-helix	trans	-66.6	-30.5	178.5	0	0	0	0	0	112.7	Q45 L95 E103 I104 A105 G109	Q45-A107 PolarHBondContact NE2-O 3.47Å; L95-A107 HydrophobicContact CD1-CB 4.23Å; L95-A107 HydrophobicContact CD2-CB 3.36Å; L95-A107 HydrophobicContact CG-CB 3.71Å; E103-A107 VanDerWaalsContact O-CB 3.3Å; E103-A107 WeakPolarHBondContact O-CB 2.88Å; E103-A107 PolarHBondContact O-N 3.39Å; I104-A107 PolarHBondContact O-N 2.77Å; A105-A107 PolarHBondContact O-N 3.37Å; A107-G109 PolarHBondContact O-N 2.93Å
108	L	81.9	Confident	64.7	Low	3 Å²	3	75.8 Å²	75.8	2%	0.016	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-5.2	174.1	-62.9	-179.5	0	0	0	112.6	L14 Q45 I104 A105 S106 L110 V132	L14-L108 HydrophobicContact CD2-CD2 4.05Å; Q45-L108 HydrophobicContact CG-CD2 3.18Å; Q45-L108 PolarHBondContact NE2-O 3.31Å; Q45-L108 VanDerWaalsContact NE2-O 3.14Å; I104-L108 HydrophobicContact CG2-CD1 3.5Å; I104-L108 VanDerWaalsContact CG2-CD1 3.5Å; I104-L108 HydrophobicContact CG2-CG 4.09Å; I104-L108 VanDerWaalsContact O-CB 3.29Å; I104-L108 WeakPolarHBondContact O-CB 3.27Å; I104-L108 WeakPolarHBondContact O-CG 3.19Å; I104-L108 PolarHBondContact O-N 3.43Å; A105-L108 CarbonylContact O-C 3.55Å; A105-L108 PolarHBondContact O-N 3.44Å; S106-L108 VanDerWaalsContact C-N 3.27Å; S106-L108 PolarHBondContact O-N 2.87Å; L108-L110 VanDerWaalsContact C-N 3.27Å; L108-L110 HydrophobicContact CB-CG 4.1Å; L108-V132 HydrophobicContact CB-CG2 4.39Å; L108-V132 HydrophobicContact CD1-CB 4.28Å; L108-V132 HydrophobicContact CD1-CG1 4.07Å; L108-V132 HydrophobicContact CD1-CG2 3.23Å; L108-V132 HydrophobicContact CG-CG2 4.39Å
109	G	74.5	Confident	62.6	Low	8 Å²	8	77.3 Å²	77.3	8%	0.082	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	21.9	-177.3	0	0	0	0	0	112.7	R58 A105 S106 A107 D111	R58-G109 PolarHBondContact NH1-O 3.14Å; A105-G109 PolarHBondContact O-N 3.01Å; A105-G109 VanDerWaalsContact O-N 3.15Å; S106-G109 WeakPolarHBondContact O-CA 3.27Å; S106-G109 PolarHBondContact O-N 3.3Å; A107-G109 PolarHBondContact O-N 2.93Å; G109-D111 PolarHBondContact O-N 2.86Å; G109-D111 VanDerWaalsContact O-N 3.14Å
110	L	67.3	Low	60.4	Low	18 Å²	18	80.9 Å²	80.9	9%	0.094	45%	0.447	C	S	.	.			trans	-83.7	59.8	168.8	-49	-170.1	0	0	0	108.6	A105 L108 F112 Q131 V132 I135	A105-L110 HydrophobicContact CB-CB 4.06Å; A105-L110 WeakPolarHBondContact O-CA 3.42Å; A105-L110 VanDerWaalsContact O-CB 3.29Å; A105-L110 WeakPolarHBondContact O-CB 3.22Å; A105-L110 PolarHBondContact O-N 3.19Å; L108-L110 VanDerWaalsContact C-N 3.27Å; L108-L110 HydrophobicContact CB-CG 4.1Å; L110-F112 PolarHBondContact O-N 3.09Å; L110-Q131 HydrophobicContact CD1-CB 4.41Å; L110-V132 HydrophobicContact CD1-CG2 3.56Å; L110-V132 HydrophobicContact CG-CG2 4.49Å; L110-I135 HydrophobicContact CD1-CD1 4.47Å; L110-I135 HydrophobicContact CD2-CD1 3.12Å; L110-I135 HydrophobicContact CD2-CG1 4.44Å; L110-I135 HydrophobicContact CG-CD1 4.38Å
111	D	54.1	Low	58.8	Low	77 Å²	77	83.2 Å²	83.2	41%	0.412	46%	0.459	S	S	.	.			trans	-79	107.4	171.3	-80.2	-40.3	0	0	0	107.7	R90 G109 R113	R90-D111 IonicContact CZ-OD2 2.81Å; R90-D111 VanDerWaalsContact CZ-OD2 3.28Å; R90-D111 IonicContact NH1-OD2 3.86Å; R90-D111 PolarHBondContact NH1-OD2 3.06Å; R90-D111 IonicContact NH2-OD2 3.5Å; R90-D111 PolarHBondContact NH2-OD2 3.33Å; G109-D111 PolarHBondContact O-N 2.86Å; G109-D111 VanDerWaalsContact O-N 3.14Å; D111-R113 PolarHBondContact O-N 2.99Å
112	F	48.7	Very low	57.5	Low	105 Å²	105	82.4 Å²	82.4	46%	0.461	46%	0.456	S	S	.	.			trans	-67.7	45.1	175.4	-64.3	-83	0	0	0	113.2	A105 L110 P120	A105-F112 HydrophobicContact CB-CE2 4.37Å; L110-F112 PolarHBondContact O-N 3.09Å; F112-P120 HydrophobicContact CD2-CB 4.45Å; F112-P120 HydrophobicContact CE2-CB 4.5Å
113	R	37	Very low	56.3	Low	237 Å²	237	83.3 Å²	83.3	89%	0.894	47%	0.47	S	S	*	.			trans	-124.5	81.1	-179.5	-80.9	-162.2	158.4	-176.1	-3.6	111.1	D111	D111-R113 PolarHBondContact O-N 2.99Å
114	A	35.3	Very low	55.6	Low	102 Å²	102	80.2 Å²	80.2	84%	0.843	46%	0.46	S	S	*	.	S	Bend	trans	-172.7	10.2	148.8	0	0	0	0	0	114.5
115	Q	30.9	Very low	55	Low	184 Å²	184	82 Å²	82	86%	0.86	47%	0.467	S	S	*	.	S	Bend	trans	-125.8	145.3	162.6	-73.7	177.9	-7	0	0	107.3
116	E	27.3	Very low	54.8	Low	172 Å²	172	86 Å²	86	80%	0.804	49%	0.488	S	S	*	.	S	Bend	trans	-32.5	157.5	-173.6	-67.1	-167.2	148.7	0	0	116.6	V118	E116-V118 VanDerWaalsContact C-N 3.28Å; E116-V118 PolarHBondContact O-N 2.79Å
117	P	31.4	Very low	54.7	Low	135 Å²	135	87.1 Å²	87.1	88%	0.877	49%	0.486	S	S	*	.			trans	-68.4	83.2	-162.9	32.1	-35.2	0	0	0	111.7
118	V	35.8	Very low	54.5	Low	114 Å²	114	86.5 Å²	86.5	69%	0.691	48%	0.482	S	S	*	.			trans	-95	111.4	163.7	-175.3	0	0	0	0	105	E116	E116-V118 VanDerWaalsContact C-N 3.28Å; E116-V118 PolarHBondContact O-N 2.79Å
119	V	37.6	Very low	54.5	Low	113 Å²	113	86.8 Å²	86.8	69%	0.685	48%	0.482	S	S	*	.			trans	-41.2	135.2	169.2	177.6	0	0	0	0	108.8	T121	V119-T121 PolarHBondContact O-N 2.78Å
120	P	37.7	Very low	54.9	Low	85 Å²	85	91.3 Å²	91.3	55%	0.552	50%	0.501	S	S	*	.			trans	-60.1	104.6	178	-14.8	26.9	0	0	0	109	F112 A122	F112-P120 HydrophobicContact CD2-CB 4.45Å; F112-P120 HydrophobicContact CE2-CB 4.5Å; P120-A122 PolarHBondContact O-N 2.9Å
121	T	47.5	Very low	55.7	Low	103 Å²	103	93.4 Å²	93.4	63%	0.632	51%	0.511	S	S	*	.			trans	-87	20.3	177.7	42.6	0	0	0	0	112.3	V119 A123	V119-T121 PolarHBondContact O-N 2.78Å; T121-A123 PolarHBondContact O-N 3.42Å
122	A	53.7	Low	56.9	Low	15 Å²	15	90.1 Å²	90.1	12%	0.124	49%	0.494	C	S	.	.			trans	-79.4	81.7	161.8	0	0	0	0	0	107.9	V101 P120 E127 V128	V101-A122 HydrophobicContact CG1-CB 4.11Å; P120-A122 PolarHBondContact O-N 2.9Å; A122-E127 VanDerWaalsContact C-OE2 3.29Å; A122-E127 VanDerWaalsContact CA-OE2 3.24Å; A122-E127 WeakPolarHBondContact CA-OE2 3.47Å; A122-E127 HydrophobicContact CB-CB 4.19Å; A122-V128 HydrophobicContact CB-CG2 3.71Å
123	A	58.3	Low	58.5	Low	97 Å²	97	85.4 Å²	85.4	80%	0.802	47%	0.473	S	S	*	.			trans	-71.1	-23.3	173.9	0	0	0	0	0	111.2	T121 E127	T121-A123 PolarHBondContact O-N 3.42Å; A123-E127 PolarHBondContact N-OE2 3.48Å
124	S	70.3	Confident	60.7	Low	41 Å²	41	78 Å²	78	29%	0.287	45%	0.449	S	S	.	.	S	Bend	trans	-123.4	152.5	-174.2	71.5	0	0	0	0	113.2	D126 E127 V128	S124-D126 PolarHBondContact O-N 3.36Å; S124-E127 PolarHBondContact N-OE2 2.88Å; S124-E127 PolarHBondContact O-N 3.45Å; S124-E127 VanDerWaalsContact OG-CD 3.29Å; S124-E127 VanDerWaalsContact OG-CG 3.3Å; S124-E127 WeakPolarHBondContact OG-CG 3.38Å; S124-E127 PolarHBondContact OG-N 3.2Å; S124-E127 PolarHBondContact OG-OE2 3.47Å; S124-E127 VanDerWaalsContact OG-OE2 3.05Å; S124-V128 PolarHBondContact O-N 3.37Å
125	R	73.6	Confident	62.8	Low	38 Å²	38	75.6 Å²	75.6	14%	0.143	42%	0.421	C	S	.	.	H	α-helix	trans	-63	-27.8	173.1	-168	178.9	-177.5	94.3	2.9	111.8	L25 D28 V101 Y129	L25-R125 VanDerWaalsContact O-CZ 3.25Å; L25-R125 PolarHBondContact O-NE 3.29Å; L25-R125 PolarHBondContact O-NH2 3.12Å; D28-R125 IonicContact OD2-NH2 3.7Å; D28-R125 PolarHBondContact OD2-NH2 2.78Å; V101-R125 HydrophobicContact CG2-CB 4.47Å; R125-Y129 WeakPolarHBondContact O-CB 3.45Å; R125-Y129 PolarHBondContact O-N 2.69Å
126	D	80.4	Confident	64.8	Low	90 Å²	90	67.4 Å²	67.4	48%	0.481	39%	0.385	S	S	.	.	H	α-helix	trans	-70.3	-37.5	178.1	-67	-39.1	0	0	0	111.7	S124 Y129 E130	S124-D126 PolarHBondContact O-N 3.36Å; D126-Y129 WeakPolarHBondContact O-CB 3.27Å; D126-Y129 PolarHBondContact O-N 3.34Å; D126-E130 PolarHBondContact O-N 3.28Å
127	E	81.1	Confident	67.2	Low	79 Å²	79	64.4 Å²	64.4	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-42.9	173.8	-73.8	158.2	159.8	0	0	112	A122 A123 S124 Y129 E130 Q131	A122-E127 VanDerWaalsContact C-OE2 3.29Å; A122-E127 VanDerWaalsContact CA-OE2 3.24Å; A122-E127 WeakPolarHBondContact CA-OE2 3.47Å; A122-E127 HydrophobicContact CB-CB 4.19Å; A123-E127 PolarHBondContact N-OE2 3.48Å; S124-E127 PolarHBondContact N-OE2 2.88Å; S124-E127 PolarHBondContact O-N 3.45Å; S124-E127 VanDerWaalsContact OG-CD 3.29Å; S124-E127 VanDerWaalsContact OG-CG 3.3Å; S124-E127 WeakPolarHBondContact OG-CG 3.38Å; S124-E127 PolarHBondContact OG-N 3.2Å; S124-E127 PolarHBondContact OG-OE2 3.47Å; S124-E127 VanDerWaalsContact OG-OE2 3.05Å; E127-Y129 VanDerWaalsContact C-N 3.29Å; E127-Y129 PolarHBondContact O-N 3.4Å; E127-E130 PolarHBondContact O-N 3.27Å; E127-Q131 WeakPolarHBondContact O-CB 3.42Å; E127-Q131 VanDerWaalsContact O-CG 3.3Å; E127-Q131 WeakPolarHBondContact O-CG 3.28Å; E127-Q131 PolarHBondContact O-N 3.37Å
128	V	79.9	Confident	69.2	Low	1 Å²	1	63.2 Å²	63.2	1%	0.006	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-41.5	173.4	171.6	0	0	0	0	110.5	L25 V101 I104 A122 S124 E130 Q131 V132	L25-V128 HydrophobicContact CD1-CG1 4.25Å; V101-V128 HydrophobicContact CG1-CB 4.31Å; V101-V128 HydrophobicContact CG1-CG2 3.23Å; I104-V128 HydrophobicContact CG2-CG1 3.86Å; A122-V128 HydrophobicContact CB-CG2 3.71Å; S124-V128 PolarHBondContact O-N 3.37Å; V128-E130 PolarHBondContact O-N 2.87Å; V128-Q131 PolarHBondContact O-N 3.1Å; V128-V132 HydrophobicContact CG1-CG2 4.02Å; V128-V132 WeakPolarHBondContact O-CB 3.46Å; V128-V132 WeakPolarHBondContact O-CG2 3.02Å; V128-V132 PolarHBondContact O-N 3.01Å
129	Y	81.3	Confident	70.9	Confident	8 Å²	8	59.2 Å²	59.2	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-50.4	176.8	179.3	-99.1	0	0	0	111.7	K10 P11 L13 C24 L25 R125 D126 E127 V132 L133	K10-Y129 WeakPolarHBondContact CB-OH 3.49Å; P11-Y129 WeakPolarHBondContact CD-OH 3.46Å; P11-Y129 WeakPolarHBondContact CG-OH 3.29Å; L13-Y129 HydrophobicContact CD1-CD2 3.56Å; L13-Y129 HydrophobicContact CD1-CE2 3.72Å; L13-Y129 HydrophobicContact CG-CE2 4.39Å; C24-Y129 HydrophobicContact CB-CE2 4.13Å; L25-Y129 HydrophobicContact CB-CD2 4.05Å; L25-Y129 HydrophobicContact CD1-CD2 4.03Å; L25-Y129 HydrophobicContact CD1-CG 4.49Å; L25-Y129 HydrophobicContact CG-CD2 4.02Å; R125-Y129 WeakPolarHBondContact O-CB 3.45Å; R125-Y129 PolarHBondContact O-N 2.69Å; D126-Y129 WeakPolarHBondContact O-CB 3.27Å; D126-Y129 PolarHBondContact O-N 3.34Å; E127-Y129 VanDerWaalsContact C-N 3.29Å; E127-Y129 PolarHBondContact O-N 3.4Å; Y129-V132 PolarHBondContact O-N 2.88Å; Y129-L133 HydrophobicContact CD1-CD1 3.9Å; Y129-L133 HydrophobicContact CD1-CG 4.47Å; Y129-L133 HydrophobicContact CE1-CD1 3.32Å; Y129-L133 HydrophobicContact CE1-CG 4.16Å; Y129-L133 HydrophobicContact CE2-CD1 4.45Å; Y129-L133 WeakPolarHBondContact O-CG 3.48Å; Y129-L133 PolarHBondContact O-N 3.28Å
130	E	84.5	Confident	71.9	Confident	103 Å²	103	58.3 Å²	58.3	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-41.3	178.8	-68.5	-54	137.1	0	0	112.6	D126 E127 V128 V132 L133 E134	D126-E130 PolarHBondContact O-N 3.28Å; E127-E130 PolarHBondContact O-N 3.27Å; V128-E130 PolarHBondContact O-N 2.87Å; E130-V132 VanDerWaalsContact C-N 3.34Å; E130-V132 PolarHBondContact O-N 2.74Å; E130-L133 WeakPolarHBondContact O-CB 3.36Å; E130-L133 PolarHBondContact O-N 3.22Å; E130-E134 PolarHBondContact O-N 2.8Å
131	Q	83.6	Confident	72.8	Confident	63 Å²	63	59.9 Å²	59.9	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-41.2	175.8	-73.6	174.8	7.7	0	0	112.5	L110 E127 V128 L133 E134 I135	L110-Q131 HydrophobicContact CD1-CB 4.41Å; E127-Q131 WeakPolarHBondContact O-CB 3.42Å; E127-Q131 VanDerWaalsContact O-CG 3.3Å; E127-Q131 WeakPolarHBondContact O-CG 3.28Å; E127-Q131 PolarHBondContact O-N 3.37Å; V128-Q131 PolarHBondContact O-N 3.1Å; Q131-L133 VanDerWaalsContact C-N 3.31Å; Q131-E134 PolarHBondContact O-N 3.29Å; Q131-I135 WeakPolarHBondContact O-CG1 3.34Å; Q131-I135 PolarHBondContact O-N 3.12Å
132	V	80.1	Confident	72.8	Confident	8 Å²	8	58 Å²	58	5%	0.048	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-39.8	176.8	177.3	0	0	0	0	110.3	L13 L108 L110 V128 Y129 E130 E134 I135 A136	L13-V132 HydrophobicContact CD1-CB 3.99Å; L13-V132 HydrophobicContact CD1-CG1 3.67Å; L13-V132 HydrophobicContact CD2-CG1 3.68Å; L13-V132 HydrophobicContact CG-CG1 4.19Å; L108-V132 HydrophobicContact CB-CG2 4.39Å; L108-V132 HydrophobicContact CD1-CB 4.28Å; L108-V132 HydrophobicContact CD1-CG1 4.07Å; L108-V132 HydrophobicContact CD1-CG2 3.23Å; L108-V132 HydrophobicContact CG-CG2 4.39Å; L110-V132 HydrophobicContact CD1-CG2 3.56Å; L110-V132 HydrophobicContact CG-CG2 4.49Å; V128-V132 HydrophobicContact CG1-CG2 4.02Å; V128-V132 WeakPolarHBondContact O-CB 3.46Å; V128-V132 WeakPolarHBondContact O-CG2 3.02Å; V128-V132 PolarHBondContact O-N 3.01Å; Y129-V132 PolarHBondContact O-N 2.88Å; E130-V132 VanDerWaalsContact C-N 3.34Å; E130-V132 PolarHBondContact O-N 2.74Å; V132-E134 VanDerWaalsContact C-N 3.34Å; V132-I135 PolarHBondContact O-N 3.03Å; V132-A136 VanDerWaalsContact O-CB 3.27Å; V132-A136 WeakPolarHBondContact O-CB 3.1Å; V132-A136 PolarHBondContact O-N 3.08Å
133	L	81.7	Confident	72.2	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-42.5	175.3	-70.1	-177.4	0	0	0	112	M1 P11 L13 Y129 E130 Q131 I135 A136 R137	M1-L133 HydrophobicContact CE-CD2 4.19Å; M1-L133 HydrophobicContact SD-CD2 3.53Å; M1-L133 VanDerWaalsContact SD-CD2 3.53Å; P11-L133 HydrophobicContact CB-CD2 3.86Å; P11-L133 HydrophobicContact CG-CD1 3.83Å; P11-L133 HydrophobicContact CG-CD2 3.28Å; P11-L133 HydrophobicContact CG-CG 4.21Å; L13-L133 HydrophobicContact CD1-CD2 4.43Å; L13-L133 HydrophobicContact CD2-CD2 3.89Å; L13-L133 HydrophobicContact CG-CD2 4.44Å; Y129-L133 HydrophobicContact CD1-CD1 3.9Å; Y129-L133 HydrophobicContact CD1-CG 4.47Å; Y129-L133 HydrophobicContact CE1-CD1 3.32Å; Y129-L133 HydrophobicContact CE1-CG 4.16Å; Y129-L133 HydrophobicContact CE2-CD1 4.45Å; Y129-L133 WeakPolarHBondContact O-CG 3.48Å; Y129-L133 PolarHBondContact O-N 3.28Å; E130-L133 WeakPolarHBondContact O-CB 3.36Å; E130-L133 PolarHBondContact O-N 3.22Å; Q131-L133 VanDerWaalsContact C-N 3.31Å; L133-I135 VanDerWaalsContact C-N 3.35Å; L133-A136 CarbonylContact O-C 3.58Å; L133-A136 PolarHBondContact O-N 2.89Å; L133-R137 VanDerWaalsContact O-CG 3.3Å; L133-R137 WeakPolarHBondContact O-CG 3.45Å; L133-R137 PolarHBondContact O-N 3.45Å
134	E	82.8	Confident	70.8	Confident	81 Å²	81	63.8 Å²	63.8	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-44.1	178.3	-170.7	49.5	-140	0	0	111.2	E130 Q131 V132 A136 R137 Q138	E130-E134 PolarHBondContact O-N 2.8Å; Q131-E134 PolarHBondContact O-N 3.29Å; V132-E134 VanDerWaalsContact C-N 3.34Å; E134-A136 VanDerWaalsContact C-N 3.35Å; E134-A136 PolarHBondContact O-N 2.97Å; E134-R137 WeakPolarHBondContact O-CB 3.42Å; E134-R137 PolarHBondContact O-N 3.33Å; E134-R137 VanDerWaalsContact O-N 3.15Å; E134-R137 IonicContact OE2-NH1 3.6Å; E134-R137 PolarHBondContact OE2-NH1 3.27Å; E134-R137 VanDerWaalsContact OE2-NH1 3.14Å; E134-Q138 VanDerWaalsContact O-CG 3.31Å; E134-Q138 WeakPolarHBondContact O-CG 3.26Å; E134-Q138 PolarHBondContact O-N 3.31Å; E134-Q138 PolarHBondContact OE1-NE2 3.19Å
135	I	78.6	Confident	69	Low	51 Å²	51	66.4 Å²	66.4	26%	0.262	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-39.4	175.2	-70.4	167.2	0	0	0	111.3	L110 Q131 V132 L133 R137 Q138 R139	L110-I135 HydrophobicContact CD1-CD1 4.47Å; L110-I135 HydrophobicContact CD2-CD1 3.12Å; L110-I135 HydrophobicContact CD2-CG1 4.44Å; L110-I135 HydrophobicContact CG-CD1 4.38Å; Q131-I135 WeakPolarHBondContact O-CG1 3.34Å; Q131-I135 PolarHBondContact O-N 3.12Å; V132-I135 PolarHBondContact O-N 3.03Å; L133-I135 VanDerWaalsContact C-N 3.35Å; I135-R137 VanDerWaalsContact C-N 3.32Å; I135-R137 PolarHBondContact O-N 2.89Å; I135-Q138 PolarHBondContact O-N 2.88Å; I135-R139 VanDerWaalsContact O-CG 3.27Å; I135-R139 WeakPolarHBondContact O-CG 3.41Å; I135-R139 PolarHBondContact O-N 3.41Å
136	A	73.3	Confident	67.1	Low	13 Å²	13	73.2 Å²	73.2	11%	0.107	41%	0.405	C	S	.	.	H	α-helix	trans	-64.5	-35.3	174	0	0	0	0	0	112.1	M1 V132 L133 E134 N140	M1-A136 HydrophobicContact CE-CB 4.43Å; M1-A136 HydrophobicContact SD-CB 4.29Å; V132-A136 VanDerWaalsContact O-CB 3.27Å; V132-A136 WeakPolarHBondContact O-CB 3.1Å; V132-A136 PolarHBondContact O-N 3.08Å; L133-A136 CarbonylContact O-C 3.58Å; L133-A136 PolarHBondContact O-N 2.89Å; E134-A136 VanDerWaalsContact C-N 3.35Å; E134-A136 PolarHBondContact O-N 2.97Å; A136-N140 PolarHBondContact O-N 3.4Å; A136-N140 PolarHBondContact O-ND2 3.42Å
137	R	77.7	Confident	64.7	Low	109 Å²	109	76.8 Å²	76.8	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-66.1	-47	172.6	-70.8	173.4	-167.8	155.2	1.3	110.9	M1 L133 E134 I135 R139 N140 N141	M1-R137 HydrophobicContact CE-CG 3.39Å; L133-R137 VanDerWaalsContact O-CG 3.3Å; L133-R137 WeakPolarHBondContact O-CG 3.45Å; L133-R137 PolarHBondContact O-N 3.45Å; E134-R137 WeakPolarHBondContact O-CB 3.42Å; E134-R137 PolarHBondContact O-N 3.33Å; E134-R137 VanDerWaalsContact O-N 3.15Å; E134-R137 IonicContact OE2-NH1 3.6Å; E134-R137 PolarHBondContact OE2-NH1 3.27Å; E134-R137 VanDerWaalsContact OE2-NH1 3.14Å; I135-R137 VanDerWaalsContact C-N 3.32Å; I135-R137 PolarHBondContact O-N 2.89Å; R137-R139 VanDerWaalsContact C-N 3.31Å; R137-R139 PolarHBondContact O-N 3.26Å; R137-N140 PolarHBondContact O-N 3.44Å; R137-N141 PolarHBondContact O-N 3.28Å
138	Q	74.5	Confident	62.6	Low	110 Å²	110	80.8 Å²	80.8	51%	0.514	44%	0.442	S	S	.	.	H	α-helix	trans	-59.7	-40.6	178.3	-70.3	171.9	12.8	0	0	112.2	E134 I135 N140 N141 G142	E134-Q138 VanDerWaalsContact O-CG 3.31Å; E134-Q138 WeakPolarHBondContact O-CG 3.26Å; E134-Q138 PolarHBondContact O-N 3.31Å; E134-Q138 PolarHBondContact OE1-NE2 3.19Å; I135-Q138 PolarHBondContact O-N 2.88Å; Q138-N140 VanDerWaalsContact C-N 3.28Å; Q138-N140 PolarHBondContact O-N 3.44Å; Q138-N141 PolarHBondContact O-N 2.9Å; Q138-G142 PolarHBondContact O-N 3.26Å
139	R	70.6	Confident	60.2	Low	30 Å²	30	89.2 Å²	89.2	11%	0.113	48%	0.479	C	S	.	.	H	α-helix	trans	-59.4	-37.9	173.2	-71.8	175.8	-168.1	164.2	6.4	112.7	N63 I135 R137	N63-R139 VanDerWaalsContact O-CD 3.23Å; N63-R139 WeakPolarHBondContact O-CD 3.3Å; N63-R139 VanDerWaalsContact O-CG 3.32Å; N63-R139 WeakPolarHBondContact O-CG 3.49Å; N63-R139 PolarHBondContact O-NE 3.48Å; I135-R139 VanDerWaalsContact O-CG 3.27Å; I135-R139 WeakPolarHBondContact O-CG 3.41Å; I135-R139 PolarHBondContact O-N 3.41Å; R137-R139 VanDerWaalsContact C-N 3.31Å; R137-R139 PolarHBondContact O-N 3.26Å
140	N	58	Low	58.1	Low	94 Å²	94	98.3 Å²	98.3	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-75.6	-26.7	177.8	-73.2	-59.5	0	0	0	113	A136 R137 Q138	A136-N140 PolarHBondContact O-N 3.4Å; A136-N140 PolarHBondContact O-ND2 3.42Å; R137-N140 PolarHBondContact O-N 3.44Å; Q138-N140 VanDerWaalsContact C-N 3.28Å; Q138-N140 PolarHBondContact O-N 3.44Å
141	N	57.6	Low	55.9	Low	118 Å²	118	100.8 Å²	100.8	63%	0.631	54%	0.535	S	S	*	.	H	α-helix	trans	-88.6	-13.7	-179	-64.4	-11.8	0	0	0	113.3	R137 Q138 L143	R137-N141 PolarHBondContact O-N 3.28Å; Q138-N141 PolarHBondContact O-N 2.9Å; N141-L143 VanDerWaalsContact C-N 3.26Å; N141-L143 PolarHBondContact O-N 3.29Å
142	G	47.2	Very low	53.5	Low	63 Å²	63	105.5 Å²	105.5	65%	0.649	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	5	-174	0	0	0	0	0	117	Q138	Q138-G142 PolarHBondContact O-N 3.26Å
143	L	41	Very low	51.6	Low	168 Å²	168	110.8 Å²	110.8	88%	0.88	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	14.4	177.3	-70	176.4	0	0	0	114.3	N141	N141-L143 VanDerWaalsContact C-N 3.26Å; N141-L143 PolarHBondContact O-N 3.29Å
144	G	29.3	Very low	49.4	Very low	66 Å²	66	116.9 Å²	116.9	68%	0.68	64%	0.64	S	S	*	*	S	Bend	trans	169.6	94.6	167.6	0	0	0	0	0	114.5
145	A	32.8	Very low	47.1	Very low	96 Å²	96	116.1 Å²	116.1	79%	0.793	65%	0.654	S	S	*	*			trans	-168.9	97.1	153.6	0	0	0	0	0	110.8	Q147	A145-Q147 PolarHBondContact O-N 3.28Å
146	E	32.8	Very low	45.2	Very low	181 Å²	181	121.1 Å²	121.1	85%	0.846	68%	0.681	S	S	*	*			trans	-52.4	125.8	148.8	-85.9	172.1	91.5	0	0	109.5	L148	E146-L148 PolarHBondContact O-N 3.16Å
147	Q	30.1	Very low	43.3	Very low	165 Å²	165	128.6 Å²	128.6	77%	0.771	72%	0.719	S	S	*	*			trans	40.4	80.9	134.6	-141.3	160.1	35.6	0	0	117.2	A145	A145-Q147 PolarHBondContact O-N 3.28Å
148	L	37	Very low	41.5	Very low	163 Å²	163	129 Å²	129	85%	0.853	73%	0.734	S	S	*	*			trans	-113.8	98.3	156.2	-75.2	173.2	0	0	0	109.4	E146	E146-L148 PolarHBondContact O-N 3.16Å
149	K	30.8	Very low	39.8	Very low	177 Å²	177	129.7 Å²	129.7	77%	0.77	75%	0.745	S	S	*	*			trans	-65.7	129.6	157.2	-70.2	174.9	173.7	177.4	0	107.5
150	F	37.1	Very low	38.3	Very low	200 Å²	200	133.9 Å²	133.9	88%	0.877	77%	0.773	S	S	*	*			trans	-140.8	128.5	157.8	-117.2	-89.2	0	0	0	108.8
151	D	37.1	Very low	37.3	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	79%	0.785	S	S	*	*			trans	-69.1	154.3	-169.3	-62.4	-73.5	0	0	0	114.2
152	D	33.9	Very low	36.3	Very low	162 Å²	162	135.9 Å²	135.9	87%	0.866	79%	0.793	S	S	*	*			trans	-53.6	135.6	174.3	-79.4	-63.1	0	0	0	114.3
153	S	39.5	Very low	35.7	Very low	118 Å²	118	139.8 Å²	139.8	83%	0.825	80%	0.799	S	S	*	*			trans	-166	132.8	134.1	-85.2	0	0	0	0	111.4
154	P	35.7	Very low	35.4	Very low	135 Å²	135	140.4 Å²	140.4	88%	0.877	80%	0.797	S	S	*	*			trans	-91.9	138	-177.2	35.9	-30.4	0	0	0	110.8
155	G	34.8	Very low	35.8	Very low	65 Å²	65	145.7 Å²	145.7	67%	0.67	81%	0.806	S	S	*	*			trans	161	97.5	170.9	0	0	0	0	0	112.4
156	N	38.6	Very low	36.1	Very low	156 Å²	156	148.4 Å²	148.4	83%	0.834	81%	0.807	S	S	*	*			trans	175.2	112.6	130.2	-84.3	-17.6	0	0	0	109	V158	N156-V158 PolarHBondContact O-N 3.04Å; N156-V158 VanDerWaalsContact O-N 3.1Å
157	D	34	Very low	36.3	Very low	169 Å²	169	146.7 Å²	146.7	90%	0.904	80%	0.802	S	S	*	*			trans	-56.5	106.5	167.7	-70.4	-45.8	0	0	0	109.8
158	V	39.9	Very low	36.5	Very low	119 Å²	119	146 Å²	146	72%	0.721	80%	0.798	S	S	*	*			trans	-104.1	103	163.4	-179.4	0	0	0	0	107	N156 V160	N156-V158 PolarHBondContact O-N 3.04Å; N156-V158 VanDerWaalsContact O-N 3.1Å; V158-V160 PolarHBondContact O-N 3.15Å
159	V	38.6	Very low	36.7	Very low	124 Å²	124	147.5 Å²	147.5	75%	0.752	80%	0.801	S	S	*	*			trans	-60.1	104.3	170.2	-177.2	0	0	0	0	108	V161	V159-V161 PolarHBondContact O-N 3.29Å
160	V	37.7	Very low	37.5	Very low	117 Å²	117	144.6 Å²	144.6	71%	0.709	80%	0.799	S	S	*	*			trans	-81.8	106	168.6	-178.2	0	0	0	0	107.1	V158 V162	V158-V160 PolarHBondContact O-N 3.15Å; V160-V162 PolarHBondContact O-N 3.29Å; V160-V162 VanDerWaalsContact O-N 3.12Å
161	V	38.3	Very low	37.7	Very low	122 Å²	122	138.3 Å²	138.3	74%	0.739	78%	0.778	S	S	*	*			trans	-67.4	106	166.6	-178.7	0	0	0	0	106.8	V159 D163	V159-V161 PolarHBondContact O-N 3.29Å; V161-D163 PolarHBondContact O-N 2.99Å
162	V	36.4	Very low	38	Very low	133 Å²	133	137.1 Å²	137.1	81%	0.806	77%	0.765	S	S	*	*			trans	-72.8	107.9	170.8	-135.1	0	0	0	0	106.2	V160 E164	V160-V162 PolarHBondContact O-N 3.29Å; V160-V162 VanDerWaalsContact O-N 3.12Å; V162-E164 PolarHBondContact O-N 2.85Å; V162-E164 VanDerWaalsContact O-N 3.16Å
163	D	34.7	Very low	38.6	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	75%	0.749	S	S	*	*			trans	-74.2	107.9	177.8	-150.8	9.7	0	0	0	108.7	V161 M165	V161-D163 PolarHBondContact O-N 2.99Å; D163-M165 PolarHBondContact O-N 2.91Å; D163-M165 VanDerWaalsContact O-N 3.1Å
164	E	35.1	Very low	38.8	Very low	181 Å²	181	132 Å²	132	85%	0.846	74%	0.739	S	S	*	*			trans	-80.2	80.4	-175.3	-145	-170.7	146.2	0	0	109	V162	V162-E164 PolarHBondContact O-N 2.85Å; V162-E164 VanDerWaalsContact O-N 3.16Å
165	M	37.2	Very low	39.4	Very low	178 Å²	178	131.1 Å²	131.1	88%	0.877	73%	0.726	S	S	*	*			trans	-121.7	65.3	164.8	-80.5	-174.2	62.2	0	0	110.1	D163	D163-M165 PolarHBondContact O-N 2.91Å; D163-M165 VanDerWaalsContact O-N 3.1Å
166	L	39.1	Very low	40	Very low	152 Å²	152	134.4 Å²	134.4	80%	0.796	73%	0.727	S	S	*	*			trans	-82.2	153	163.6	-164.6	72	0	0	0	108.9
167	I	36.2	Very low	40.1	Very low	146 Å²	146	134.2 Å²	134.2	75%	0.749	72%	0.724	S	S	*	*			trans	95.3	120.8	159.7	-39.9	169	0	0	0	115.1
168	Q	35.5	Very low	40.6	Very low	149 Å²	149	133.2 Å²	133.2	70%	0.696	72%	0.717	S	S	*	*			trans	101.4	48.8	165.8	-50.2	-165.2	-6.9	0	0	119.4
169	Q	40.3	Very low	40.7	Very low	196 Å²	196	136.4 Å²	136.4	92%	0.916	72%	0.724	S	S	*	*			trans	-136.8	78.4	146.9	-72.5	-167.4	-6.1	0	0	110.6
170	T	46.8	Very low	40.7	Very low	116 Å²	116	137.5 Å²	137.5	71%	0.712	73%	0.726	S	S	*	*			trans	-78.1	122.2	165.5	46.4	0	0	0	0	108.9	F172	T170-F172 PolarHBondContact O-N 3.37Å
171	P	42.6	Very low	40.7	Very low	67 Å²	67	137.5 Å²	137.5	44%	0.435	73%	0.731	S	S	.	*			trans	-67.8	130.1	170.3	27.2	-29.4	0	0	0	108.3	T173	P171-T173 PolarHBondContact O-N 3.26Å
172	F	42.8	Very low	40.5	Very low	131 Å²	131	141 Å²	141	58%	0.575	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	10.7	-165.6	-135.2	-93.8	0	0	0	116.5	T170 F220	T170-F172 PolarHBondContact O-N 3.37Å; F172-F220 AromaticContact CE1-CZ 3.85Å; F172-F220 HydrophobicContact CE1-CZ 3.85Å; F172-F220 AromaticContact CE2-CE1 3.65Å; F172-F220 HydrophobicContact CE2-CE1 3.65Å; F172-F220 AromaticContact CE2-CZ 3.69Å; F172-F220 HydrophobicContact CE2-CZ 3.69Å; F172-F220 AromaticContact CZ-CE1 3.53Å; F172-F220 HydrophobicContact CZ-CE1 3.53Å; F172-F220 AromaticContact CZ-CE2 3.95Å; F172-F220 HydrophobicContact CZ-CE2 3.95Å; F172-F220 AromaticContact CZ-CZ 3.08Å; F172-F220 HydrophobicContact CZ-CZ 3.08Å
173	T	46.7	Very low	40.5	Very low	84 Å²	84	140.5 Å²	140.5	52%	0.515	74%	0.742	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	-15.3	-168.4	56	0	0	0	0	114.3	P171	P171-T173 PolarHBondContact O-N 3.26Å
174	S	43.7	Very low	40.5	Very low	88 Å²	88	142.3 Å²	142.3	62%	0.615	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-84.4	-16	-175.9	-57.7	0	0	0	0	114.7
175	L	48.8	Very low	40.5	Very low	116 Å²	116	143.1 Å²	143.1	61%	0.607	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-86	-4.6	-179	-85.7	163.1	0	0	0	114.5
176	L	46.9	Very low	40.2	Very low	134 Å²	134	141.3 Å²	141.3	70%	0.702	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-95.9	4.7	-179.3	-67.7	176	0	0	0	113.8
177	M	41.6	Very low	40.1	Very low	153 Å²	153	138 Å²	138	75%	0.754	74%	0.735	S	S	*	*			trans	-139	68.2	-175.5	-62.8	-69.3	168.5	0	0	110.3	Q179	M177-Q179 PolarHBondContact O-N 3.34Å
178	L	44.3	Very low	40.2	Very low	147 Å²	147	142.6 Å²	142.6	77%	0.77	74%	0.743	S	S	*	*			trans	-72.5	111.6	161.7	-113.8	85.8	0	0	0	108
179	Q	42.4	Very low	40.1	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	76%	0.755	S	S	*	*			trans	-78.6	114.5	171.2	-72.3	173.9	-22.8	0	0	108.3	M177 S181	M177-Q179 PolarHBondContact O-N 3.34Å; Q179-S181 PolarHBondContact O-N 2.89Å
180	N	36.8	Very low	40	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	75%	0.751	S	S	*	*			trans	-68.1	114.3	168	-70.4	-15.7	0	0	0	108.3	E182	N180-E182 PolarHBondContact O-N 2.71Å
181	S	38.1	Very low	39.5	Very low	117 Å²	117	143.4 Å²	143.4	82%	0.818	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-71.9	120.8	168.6	52.6	0	0	0	0	109.5	Q179	Q179-S181 PolarHBondContact O-N 2.89Å
182	E	35.4	Very low	39.5	Very low	197 Å²	197	148.1 Å²	148.1	92%	0.921	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.6	134.8	179.7	-59.7	172.4	131.8	0	0	111.1	N180	N180-E182 PolarHBondContact O-N 2.71Å
183	S	36.4	Very low	39.3	Very low	122 Å²	122	148.5 Å²	148.5	85%	0.853	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-100.9	121.6	160.7	55	0	0	0	0	109.7
184	E	34.6	Very low	38.9	Very low	182 Å²	182	152.6 Å²	152.6	85%	0.85	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.3	127.7	177.5	-159.8	175.3	142.7	0	0	111.2
185	F	34.4	Very low	38.5	Very low	197 Å²	197	152 Å²	152	86%	0.864	81%	0.809	S	S	*	*			trans	-143.5	111.9	161	-169	-97.4	0	0	0	111.1
186	D	30.6	Very low	38	Very low	141 Å²	141	157.5 Å²	157.5	75%	0.754	82%	0.824	S	S	*	*			trans	-63.1	130.4	172.7	-89.2	-45.4	0	0	0	113
187	A	36.5	Very low	37.3	Very low	82 Å²	82	155 Å²	155	68%	0.678	83%	0.83	S	S	*	*			trans	-160.5	93.8	151.4	0	0	0	0	0	113.6
188	R	39.2	Very low	37.3	Very low	242 Å²	242	152.7 Å²	152.7	91%	0.913	83%	0.825	S	S	*	*			trans	49.1	111.3	133	-60.5	-178.6	178.5	-176.3	-0.5	119.6	S190	R188-S190 PolarHBondContact O-N 3.02Å
189	K	33.1	Very low	37.1	Very low	218 Å²	218	151.8 Å²	151.8	95%	0.948	82%	0.817	S	S	*	*			trans	-27.2	124.7	147.7	-105.2	172.4	172.8	172.6	0	113.8
190	S	39.5	Very low	37.1	Very low	120 Å²	120	147.2 Å²	147.2	84%	0.839	81%	0.811	S	S	*	*			trans	-134.1	131.7	137.5	59.9	0	0	0	0	108.7	R188	R188-S190 PolarHBondContact O-N 3.02Å
191	N	34.7	Very low	37.2	Very low	141 Å²	141	151.1 Å²	151.1	75%	0.754	82%	0.815	S	S	*	*			trans	-75.3	129.3	177.5	-136.4	2.7	0	0	0	106.7
192	D	42.1	Very low	37.7	Very low	166 Å²	166	151.8 Å²	151.8	89%	0.888	81%	0.809	S	S	*	*			trans	-158.6	129.6	143.9	-89.7	-32.7	0	0	0	110.2
193	N	39.9	Very low	38.6	Very low	138 Å²	138	149 Å²	149	74%	0.738	80%	0.8	S	S	*	*			trans	-76.1	161.5	-177	-73.8	-51.1	0	0	0	111.9
194	N	39.1	Very low	39.4	Very low	170 Å²	170	150.6 Å²	150.6	91%	0.909	79%	0.794	S	S	*	*			trans	84.1	102.7	166.1	-65.1	-18.4	0	0	0	117.1
195	G	35.1	Very low	40.1	Very low	76 Å²	76	152.8 Å²	152.8	78%	0.784	79%	0.794	S	S	*	*			trans	-176.5	107.7	161.6	0	0	0	0	0	110.8
196	Y	38	Very low	40.8	Very low	232 Å²	232	147.8 Å²	147.8	91%	0.91	78%	0.776	S	S	*	*			trans	-29.1	128.6	174.9	-117.2	-113.2	0	0	0	114.7	T198	Y196-T198 PolarHBondContact O-N 3.01Å
197	G	31.7	Very low	41.8	Very low	81 Å²	81	148.8 Å²	148.8	84%	0.835	77%	0.771	S	S	*	*			trans	-70.1	115.4	177.8	0	0	0	0	0	112.3
198	T	42.5	Very low	42.8	Very low	104 Å²	104	151.5 Å²	151.5	64%	0.638	77%	0.774	S	S	*	*			trans	-126.6	114.7	165.1	-12.1	0	0	0	0	108.6	Y196	Y196-T198 PolarHBondContact O-N 3.01Å
199	E	39.3	Very low	43.7	Very low	129 Å²	129	144 Å²	144	60%	0.603	75%	0.752	S	S	*	*			trans	45.3	81	146.2	67	-146.4	161.1	0	0	121.1	W201	E199-W201 PolarHBondContact O-N 2.87Å
200	A	42.8	Very low	45.1	Very low	91 Å²	91	140.2 Å²	140.2	75%	0.752	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	4	163.2	0	0	0	0	0	114.7
201	W	39.2	Very low	46.1	Very low	228 Å²	228	138.2 Å²	138.2	86%	0.864	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-16.5	-176.3	-66.1	101.4	0	0	0	113.9	E199	E199-W201 PolarHBondContact O-N 2.87Å
202	D	48	Very low	47.2	Very low	130 Å²	130	135.9 Å²	135.9	70%	0.695	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-5.3	-175.4	-90.5	-9.3	0	0	0	114.8
203	L	54	Low	48.1	Very low	140 Å²	140	135.2 Å²	135.2	73%	0.733	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	0.4	-178.3	-71.6	168	0	0	0	114.7
204	H	52.5	Low	49.1	Very low	155 Å²	155	129.6 Å²	129.6	72%	0.718	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-13.3	-172.3	-142.8	157	0	0	0	114.6
205	W	50.1	Low	49.9	Very low	228 Å²	228	125.4 Å²	125.4	86%	0.864	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	27.5	-173.2	-63.4	106.7	0	0	0	114.4	Y207	W205-Y207 PolarHBondContact O-N 2.75Å
206	N	48.3	Very low	51.3	Low	91 Å²	91	127.2 Å²	127.2	49%	0.487	65%	0.654	S	S	.	*			trans	-78.5	97	179	-153.6	-9.7	0	0	0	110.6	N208 N209	N206-N208 PolarHBondContact O-N 3.45Å; N206-N209 WeakPolarHBondContact O-CB 3.33Å; N206-N209 PolarHBondContact O-N 3.1Å; N206-N209 VanDerWaalsContact O-N 3.1Å
207	Y	51.9	Low	52.9	Low	162 Å²	162	120.2 Å²	120.2	64%	0.635	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-10.5	176.9	-136.6	-96.3	0	0	0	113.3	W205 Y212	W205-Y207 PolarHBondContact O-N 2.75Å; Y207-Y212 HydrophobicContact CD2-CE1 4.21Å; Y207-Y212 HydrophobicContact CE1-CE1 4.25Å; Y207-Y212 AromaticContact CE2-CE1 3.92Å; Y207-Y212 HydrophobicContact CE2-CE1 3.92Å; Y207-Y212 AromaticContact CE2-CZ 3.98Å; Y207-Y212 AromaticContact CZ-CE1 3.94Å
208	N	57.5	Low	54.9	Low	139 Å²	139	121.3 Å²	121.3	74%	0.743	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	11.9	177.5	-65.2	-25	0	0	0	113.4	N206 P210	N206-N208 PolarHBondContact O-N 3.45Å; N208-P210 WeakPolarHBondContact O-CD 3.22Å
209	N	58.7	Low	56.6	Low	86 Å²	86	118.2 Å²	118.2	46%	0.46	59%	0.594	S	S	.	*			trans	-71.9	119.4	174	-176.3	-5.8	0	0	0	109.7	N206 A211 Y212	N206-N209 WeakPolarHBondContact O-CB 3.33Å; N206-N209 PolarHBondContact O-N 3.1Å; N206-N209 VanDerWaalsContact O-N 3.1Å; N209-A211 PolarHBondContact O-N 3.07Å; N209-A211 WeakPolarHBondContact OD1-CB 3.47Å; N209-A211 PolarHBondContact OD1-N 3.1Å; N209-Y212 VanDerWaalsContact O-CB 3.22Å; N209-Y212 WeakPolarHBondContact O-CB 3.33Å; N209-Y212 PolarHBondContact O-N 3.38Å
210	P	61.4	Low	57.9	Low	138 Å²	138	118.9 Å²	118.9	90%	0.896	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-8.8	178.4	23.9	-32.2	0	0	0	114.2	N208	N208-P210 WeakPolarHBondContact O-CD 3.22Å
211	A	61.7	Low	59.5	Low	78 Å²	78	123.2 Å²	123.2	65%	0.645	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	2.2	170.6	0	0	0	0	0	114.3	N209 Q213	N209-A211 PolarHBondContact O-N 3.07Å; N209-A211 WeakPolarHBondContact OD1-CB 3.47Å; N209-A211 PolarHBondContact OD1-N 3.1Å; A211-Q213 PolarHBondContact O-N 3.04Å
212	Y	58.5	Low	61.1	Low	92 Å²	92	117 Å²	117	36%	0.361	58%	0.583	S	S	.	*			trans	-80.8	115	-179.6	-178	-101.6	0	0	0	111.3	Y207 N209 P214	Y207-Y212 HydrophobicContact CD2-CE1 4.21Å; Y207-Y212 HydrophobicContact CE1-CE1 4.25Å; Y207-Y212 AromaticContact CE2-CE1 3.92Å; Y207-Y212 HydrophobicContact CE2-CE1 3.92Å; Y207-Y212 AromaticContact CE2-CZ 3.98Å; Y207-Y212 AromaticContact CZ-CE1 3.94Å; N209-Y212 VanDerWaalsContact O-CB 3.22Å; N209-Y212 WeakPolarHBondContact O-CB 3.33Å; N209-Y212 PolarHBondContact O-N 3.38Å; Y212-P214 HydrophobicContact CE1-CB 4.31Å
213	Q	59.6	Low	62.3	Low	152 Å²	152	117.5 Å²	117.5	71%	0.71	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-92.8	119.6	169.4	-71.5	-69.8	-18.6	0	0	109	A211	A211-Q213 PolarHBondContact O-N 3.04Å
214	P	60.5	Low	63.4	Low	20 Å²	20	114.9 Å²	114.9	13%	0.13	56%	0.564	C	S	.	*	P	Polyproline II helix	trans	-65.7	149.1	178.6	27.3	-32.4	0	0	0	110.8	Y212 Q216 C228	Y212-P214 HydrophobicContact CE1-CB 4.31Å; P214-Q216 PolarHBondContact O-N 3.38Å; P214-C228 HydrophobicContact CB-CB 3.78Å; P214-C228 HydrophobicContact CG-CB 4Å
215	P	55.7	Low	64.2	Low	82 Å²	82	110.3 Å²	110.3	53%	0.532	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-61.1	132.6	-179.6	-20.1	31.2	0	0	0	111.5	C228	P215-C228 PolarHBondContact O-SG 3.5Å
216	Q	66	Low	64.5	Low	113 Å²	113	100.9 Å²	100.9	53%	0.528	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-68.7	133.5	171.9	-69.1	176.3	-5.2	0	0	110.3	P214	P214-Q216 PolarHBondContact O-N 3.38Å
217	V	71.7	Confident	64.9	Low	86 Å²	86	99.7 Å²	99.7	52%	0.521	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.4	175.5	-179.6	0	0	0	0	108.4	T226	V217-T226 PolarHBondContact N-O 3.25Å; V217-T226 PolarHBondContact O-N 3.17Å; V217-T226 PolarHBondContact O-OG1 2.98Å; V217-T226 VanDerWaalsContact O-OG1 3.13Å
218	W	72.7	Confident	65	Low	103 Å²	103	95.2 Å²	95.2	39%	0.39	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.6	176.1	-171.7	-98.6	0	0	0	110.7
219	D	77.6	Confident	64.5	Low	40 Å²	40	94.4 Å²	94.4	21%	0.214	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	109.6	172.4	-169.8	-41.8	0	0	0	109.9	Q221 L222 Q223 K224	D219-Q221 VanDerWaalsContact C-N 3.32Å; D219-Q221 PolarHBondContact O-N 2.72Å; D219-Q221 WeakPolarHBondContact OD1-CA 3.35Å; D219-Q221 VanDerWaalsContact OD1-CB 3.31Å; D219-Q221 WeakPolarHBondContact OD1-CB 3.15Å; D219-Q221 PolarHBondContact OD1-N 3.29Å; D219-L222 HydrophobicContact CB-CB 4.12Å; D219-L222 HydrophobicContact CB-CD1 4.37Å; D219-L222 PolarHBondContact O-N 3.46Å; D219-L222 PolarHBondContact OD1-N 2.8Å; D219-L222 VanDerWaalsContact OD2-CD1 3.3Å; D219-L222 WeakPolarHBondContact OD2-CD1 3.47Å; D219-Q223 PolarHBondContact O-N 3.36Å; D219-K224 PolarHBondContact N-O 3.5Å
220	F	68.6	Low	63.7	Low	142 Å²	142	96.2 Å²	96.2	62%	0.623	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.5	-179.9	-75.4	-89	0	0	0	113.8	F172	F172-F220 AromaticContact CE1-CZ 3.85Å; F172-F220 HydrophobicContact CE1-CZ 3.85Å; F172-F220 AromaticContact CE2-CE1 3.65Å; F172-F220 HydrophobicContact CE2-CE1 3.65Å; F172-F220 AromaticContact CE2-CZ 3.69Å; F172-F220 HydrophobicContact CE2-CZ 3.69Å; F172-F220 AromaticContact CZ-CE1 3.53Å; F172-F220 HydrophobicContact CZ-CE1 3.53Å; F172-F220 AromaticContact CZ-CE2 3.95Å; F172-F220 HydrophobicContact CZ-CE2 3.95Å; F172-F220 AromaticContact CZ-CZ 3.08Å; F172-F220 HydrophobicContact CZ-CZ 3.08Å
221	Q	74.4	Confident	62.6	Low	183 Å²	183	94.7 Å²	94.7	86%	0.855	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-33.7	177.5	-120	95.7	5	0	0	110.8	D219	D219-Q221 VanDerWaalsContact C-N 3.32Å; D219-Q221 PolarHBondContact O-N 2.72Å; D219-Q221 WeakPolarHBondContact OD1-CA 3.35Å; D219-Q221 VanDerWaalsContact OD1-CB 3.31Å; D219-Q221 WeakPolarHBondContact OD1-CB 3.15Å; D219-Q221 PolarHBondContact OD1-N 3.29Å
222	L	74.5	Confident	61.7	Low	96 Å²	96	101.5 Å²	101.5	50%	0.503	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-4.1	-175	-62.1	170.9	0	0	0	113.9	D219 K224	D219-L222 HydrophobicContact CB-CB 4.12Å; D219-L222 HydrophobicContact CB-CD1 4.37Å; D219-L222 PolarHBondContact O-N 3.46Å; D219-L222 PolarHBondContact OD1-N 2.8Å; D219-L222 VanDerWaalsContact OD2-CD1 3.3Å; D219-L222 WeakPolarHBondContact OD2-CD1 3.47Å; L222-K224 HydrophobicContact CB-CD 4.31Å; L222-K224 HydrophobicContact CB-CG 3.75Å; L222-K224 PolarHBondContact O-N 3.01Å; L222-K224 VanDerWaalsContact O-N 3.1Å
223	Q	72.8	Confident	60.7	Low	142 Å²	142	102.9 Å²	102.9	66%	0.664	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	34.8	-175.5	-72.6	-172.6	-35.9	0	0	113.7	D219	D219-Q223 PolarHBondContact O-N 3.36Å
224	K	75.9	Confident	59.8	Low	85 Å²	85	101.5 Å²	101.5	37%	0.37	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.7	179.1	63.4	173.4	-179.7	158.4	0	111.3	D219 L222 T226 E230	D219-K224 PolarHBondContact N-O 3.5Å; L222-K224 HydrophobicContact CB-CD 4.31Å; L222-K224 HydrophobicContact CB-CG 3.75Å; L222-K224 PolarHBondContact O-N 3.01Å; L222-K224 VanDerWaalsContact O-N 3.1Å; K224-T226 HydrophobicContact CG-CG2 4.45Å; K224-E230 IonicContact NZ-OE2 3.76Å; K224-E230 PolarHBondContact NZ-OE2 3.02Å
225	S	70.6	Confident	58.6	Low	58 Å²	58	106.5 Å²	106.5	41%	0.406	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.7	121	165.1	58.4	0	0	0	0	108.5
226	T	56.1	Low	57.6	Low	30 Å²	30	110.9 Å²	110.9	18%	0.184	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.2	132.1	168.9	41.4	0	0	0	0	108.7	V217 K224	V217-T226 PolarHBondContact N-O 3.25Å; V217-T226 PolarHBondContact O-N 3.17Å; V217-T226 PolarHBondContact O-OG1 2.98Å; V217-T226 VanDerWaalsContact O-OG1 3.13Å; K224-T226 HydrophobicContact CG-CG2 4.45Å
227	D	56.9	Low	56.4	Low	67 Å²	67	112 Å²	112	36%	0.358	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-71.8	151.3	167.7	-155.3	-10.2	0	0	0	108.6	N229 E230	D227-N229 PolarHBondContact O-N 3.49Å; D227-E230 PolarHBondContact O-N 3.02Å
228	C	52.8	Low	54.9	Low	67 Å²	67	111.5 Å²	111.5	45%	0.453	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	6.7	-179	-71.3	0	0	0	0	114	P214 P215	P214-C228 HydrophobicContact CB-CB 3.78Å; P214-C228 HydrophobicContact CG-CB 4Å; P215-C228 PolarHBondContact O-SG 3.5Å
229	N	48.7	Very low	53.3	Low	122 Å²	122	114.2 Å²	114.2	65%	0.652	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	14	-174.2	-67.4	-47.1	0	0	0	114.3	D227 P231	D227-N229 PolarHBondContact O-N 3.49Å; N229-P231 WeakPolarHBondContact O-CD 3.49Å
230	E	40.8	Very low	51.2	Low	125 Å²	125	121.6 Å²	121.6	58%	0.584	64%	0.64	S	S	*	*			trans	-70.9	112.2	167.8	-90.8	-142.6	117.1	0	0	109.7	K224 D227 R232	K224-E230 IonicContact NZ-OE2 3.76Å; K224-E230 PolarHBondContact NZ-OE2 3.02Å; D227-E230 PolarHBondContact O-N 3.02Å; E230-R232 PolarHBondContact O-N 3.42Å; E230-R232 VanDerWaalsContact O-N 3.08Å
231	P	38.9	Very low	49.8	Very low	105 Å²	105	120.7 Å²	120.7	68%	0.682	65%	0.646	S	S	*	*			trans	-71.9	110.7	175.1	27.6	-21.6	0	0	0	106.9	N229 V233	N229-P231 WeakPolarHBondContact O-CD 3.49Å; P231-V233 PolarHBondContact O-N 3.36Å
232	R	41.7	Very low	47.9	Very low	222 Å²	222	117.6 Å²	117.6	84%	0.838	64%	0.642	S	S	*	*			trans	-61.3	95.2	161.8	-99	-176.3	176	177.7	0.6	107.6	E230 V234	E230-R232 PolarHBondContact O-N 3.42Å; E230-R232 VanDerWaalsContact O-N 3.08Å; R232-V234 PolarHBondContact O-N 2.97Å; R232-V234 VanDerWaalsContact O-N 3.08Å
233	V	37.6	Very low	46.2	Very low	121 Å²	121	121.5 Å²	121.5	73%	0.733	66%	0.655	S	S	*	*			trans	-65.7	103	164.5	178.9	0	0	0	0	106.2	P231 T235	P231-V233 PolarHBondContact O-N 3.36Å; V233-T235 HydrophobicContact CG1-CG2 4.35Å
234	V	41.3	Very low	44.4	Very low	122 Å²	122	121.7 Å²	121.7	74%	0.739	66%	0.659	S	S	*	*			trans	-96.9	107.3	167.8	-178.3	0	0	0	0	106.1	R232 F236	R232-V234 PolarHBondContact O-N 2.97Å; R232-V234 VanDerWaalsContact O-N 3.08Å; V234-F236 PolarHBondContact O-N 3.45Å
235	T	35.8	Very low	42.3	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	68%	0.678	S	S	*	*			trans	-68	115.8	175.5	50.5	0	0	0	0	109.8	V233	V233-T235 HydrophobicContact CG1-CG2 4.35Å
236	F	35.3	Very low	40.6	Very low	175 Å²	175	129.2 Å²	129.2	77%	0.768	69%	0.687	S	S	*	*	S	Bend	trans	-131.6	115	160.2	-169.1	-96.6	0	0	0	106.2	V234 G238	V234-F236 PolarHBondContact O-N 3.45Å; F236-G238 PolarHBondContact O-N 3.46Å
237	D	40.3	Very low	39.5	Very low	135 Å²	135	136 Å²	136	72%	0.722	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.5	45.6	173.1	-60.8	-14.7	0	0	0	118.5	L239	D237-L239 PolarHBondContact O-N 3Å
238	G	38.9	Very low	38.4	Very low	77 Å²	77	138 Å²	138	79%	0.794	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.7	22	148.6	0	0	0	0	0	118.9	F236	F236-G238 PolarHBondContact O-N 3.46Å
239	L	39.6	Very low	37.4	Very low	159 Å²	159	141.4 Å²	141.4	83%	0.832	75%	0.746	S	S	*	*			trans	-130.9	123.4	174.4	-69.7	172.6	0	0	0	112.2	D237	D237-L239 PolarHBondContact O-N 3Å
240	E	34.3	Very low	36.8	Very low	195 Å²	195	143 Å²	143	91%	0.911	75%	0.754	S	S	*	*			trans	-84.5	114.1	-179.3	-63.6	-177.5	171.2	0	0	111.2
241	V	38.3	Very low	36.5	Very low	124 Å²	124	146 Å²	146	75%	0.752	77%	0.77	S	S	*	*			trans	-137.3	122.8	168.6	-175.3	0	0	0	0	110.1	K243	V241-K243 PolarHBondContact O-N 3.5Å
242	P	35.5	Very low	36.1	Very low	118 Å²	118	146.6 Å²	146.6	77%	0.766	77%	0.768	S	S	*	*			trans	-63.1	125	174.4	-19.1	30.9	0	0	0	111	L244	P242-L244 PolarHBondContact O-N 3.28Å
243	K	38.7	Very low	35.5	Very low	178 Å²	178	146.7 Å²	146.7	77%	0.774	77%	0.77	S	S	*	*			trans	-72.8	78.4	172.3	-77.4	-174.6	175.9	174.9	0	110.6	V241	V241-K243 PolarHBondContact O-N 3.5Å
244	L	35	Very low	35.3	Very low	146 Å²	146	145.7 Å²	145.7	76%	0.764	77%	0.768	S	S	*	*			trans	-85.4	124.9	156.4	-153.5	80.5	0	0	0	106.5	P242	P242-L244 PolarHBondContact O-N 3.28Å
245	F	32.1	Very low	34.8	Very low	171 Å²	171	145.4 Å²	145.4	75%	0.75	77%	0.767	S	S	*	*			trans	73.5	87.5	-176	-70	-97.6	0	0	0	117.1
246	Q	34.8	Very low	34.5	Very low	130 Å²	130	147 Å²	147	61%	0.607	77%	0.769	S	S	*	*			trans	-141.2	13.6	159.7	-131.8	102.2	48.7	0	0	116.4
247	D	32.3	Very low	34.3	Very low	171 Å²	171	142.2 Å²	142.2	91%	0.914	77%	0.769	S	S	*	*	S	Bend	trans	-102.7	16.3	178.7	-76.8	-15.8	0	0	0	114.5
248	V	34.5	Very low	33.9	Very low	110 Å²	110	142.3 Å²	142.3	67%	0.667	77%	0.769	S	S	*	*	S	Bend	trans	-113.2	8.5	177.2	-161.8	0	0	0	0	112.9
249	H	30.4	Very low	33.7	Very low	139 Å²	139	145.5 Å²	145.5	64%	0.644	77%	0.768	S	S	*	*	S	Bend	trans	-137.2	20.3	-174.6	-94.1	-76.9	0	0	0	118.1
250	N	36.7	Very low	33.7	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	76%	0.764	S	S	*	*	S	Bend	trans	-114.6	18.3	175.6	-95.6	8.2	0	0	0	116.6
251	M	34.6	Very low	33.6	Very low	188 Å²	188	142.5 Å²	142.5	93%	0.926	76%	0.758	S	S	*	*	S	Bend	trans	-147.2	48.3	157.7	-82	-63.1	178	0	0	110.7
252	N	31.1	Very low	33.4	Very low	119 Å²	119	143.6 Å²	143.6	64%	0.636	76%	0.758	S	S	*	*			trans	-110.3	108.9	145.3	-91	-17.5	0	0	0	104.6	S254	N252-S254 VanDerWaalsContact C-N 3.29Å; N252-S254 PolarHBondContact O-N 2.97Å
253	Y	29.4	Very low	33.3	Very low	224 Å²	224	145.4 Å²	145.4	88%	0.878	76%	0.761	S	S	*	*			trans	-59	103.1	160	179.4	-98.8	0	0	0	105.6	T255	Y253-T255 VanDerWaalsContact C-N 3.33Å; Y253-T255 PolarHBondContact O-N 3.01Å
254	S	33.4	Very low	33.3	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	77%	0.765	S	S	*	*			trans	-53.8	98.1	178.7	-72.4	0	0	0	0	109.5	N252	N252-S254 VanDerWaalsContact C-N 3.29Å; N252-S254 PolarHBondContact O-N 2.97Å
255	T	29.7	Very low	33.3	Very low	117 Å²	117	146.6 Å²	146.6	72%	0.718	77%	0.769	S	S	*	*			trans	-60.7	145.3	140.1	-54	0	0	0	0	106.7	Y253	Y253-T255 VanDerWaalsContact C-N 3.33Å; Y253-T255 PolarHBondContact O-N 3.01Å
256	I	29.2	Very low	33.6	Very low	158 Å²	158	145.5 Å²	145.5	81%	0.81	77%	0.771	S	S	*	*			trans	103.4	107.2	178	-52.8	155	0	0	0	112.5
257	G	32.3	Very low	33.5	Very low	74 Å²	74	146.2 Å²	146.2	76%	0.763	78%	0.779	S	S	*	*			trans	170.8	66	179.9	0	0	0	0	0	107.7
258	D	31	Very low	33.9	Very low	137 Å²	137	146.6 Å²	146.6	73%	0.733	78%	0.775	S	S	*	*			trans	-53.3	159	171.9	-61.8	-55	0	0	0	111.6
259	D	35.3	Very low	34.1	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	77%	0.772	S	S	*	*			trans	93.7	102.4	160.4	-57.6	-27.9	0	0	0	119.9
260	I	39.1	Very low	34.5	Very low	146 Å²	146	144.8 Å²	144.8	75%	0.749	77%	0.773	S	S	*	*			trans	109.7	107.3	130.7	-63	158.1	0	0	0	118.9
261	D	31.9	Very low	34.7	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	77%	0.772	S	S	*	*			trans	56.3	131	145.7	-61.2	-23.6	0	0	0	119.4
262	I	34.4	Very low	34.8	Very low	146 Å²	146	141 Å²	141	75%	0.749	76%	0.758	S	S	*	*				-165.4	121.3	59.8	-74.8	174.9	0	0	0	109.2
263	L	33.8	Very low	34.9	Very low	157 Å²	157	140.6 Å²	140.6	82%	0.822	77%	0.765	S	S	*	*			trans	50.4	108.6	145.3	-53.2	170.6	0	0	0	120.8
264	S	39.4	Very low	35.3	Very low	124 Å²	124	135.7 Å²	135.7	87%	0.867	76%	0.764	S	S	*	*				-178	98.7	112.2	-79.7	0	0	0	0	112
265	R	34.6	Very low	35.5	Very low	224 Å²	224	135.7 Å²	135.7	85%	0.845	76%	0.764	S	S	*	*			trans	-64.9	138.8	167.9	-89.4	160.9	53.5	165.8	-3.4	110.9
266	N	37.6	Very low	35.9	Very low	149 Å²	149	139.1 Å²	139.1	80%	0.797	77%	0.771	S	S	*	*				-168.6	128	103.5	-95.2	-17.5	0	0	0	112.7
267	N	33.7	Very low	36.3	Very low	144 Å²	144	136 Å²	136	77%	0.77	77%	0.768	S	S	*	*			trans	-81.9	173.3	-177.7	-88.4	-33	0	0	0	113
268	Q	39.6	Very low	36.7	Very low	179 Å²	179	142 Å²	142	84%	0.836	77%	0.774	S	S	*	*			trans	95.7	135.9	149.9	-50.5	-177.8	17.1	0	0	114.5
269	S	39	Very low	37.1	Very low	87 Å²	87	147.1 Å²	147.1	61%	0.608	78%	0.783	S	S	*	*			cis	-178.1	158.3	-20.6	49.8	0	0	0	0	104.7
270	D	39.8	Very low	37.1	Very low	125 Å²	125	149 Å²	149	67%	0.668	78%	0.784	S	S	*	*			trans	74	108.8	149.4	-56.4	-39.3	0	0	0	122.5
271	Q	39.6	Very low	37.3	Very low	169 Å²	169	151.5 Å²	151.5	79%	0.79	79%	0.793	S	S	*	*				82.1	130.5	118	-66.3	-158.6	40.5	0	0	122.3
272	S	37.1	Very low	37.4	Very low	92 Å²	92	151.4 Å²	151.4	64%	0.643	79%	0.788	S	S	*	*			trans	93.5	101.4	141.3	-63	0	0	0	0	120.1
273	S	32.3	Very low	38.1	Very low	112 Å²	112	150.2 Å²	150.2	78%	0.783	79%	0.792	S	S	*	*				58.1	112	117.8	-44.5	0	0	0	0	119
274	S	37.9	Very low	38.3	Very low	121 Å²	121	149.9 Å²	149.9	85%	0.846	79%	0.791	S	S	*	*				179.7	146.7	113	56.8	0	0	0	0	113.1
275	S	38.9	Very low	38.6	Very low	98 Å²	98	154.2 Å²	154.2	69%	0.685	79%	0.794	S	S	*	*			trans	-56.1	145.2	174.9	49.8	0	0	0	0	115.2
276	H	38.3	Very low	38.6	Very low	190 Å²	190	153.7 Å²	153.7	88%	0.88	80%	0.798	S	S	*	*				-164.5	127.1	128.3	-107.9	-72.3	0	0	0	112.4
277	A	35.9	Very low	38.6	Very low	91 Å²	91	151 Å²	151	75%	0.752	80%	0.797	S	S	*	*			trans	-80.3	147.5	174.3	0	0	0	0	0	112.6
278	K	41.4	Very low	38.7	Very low	202 Å²	202	156.2 Å²	156.2	88%	0.878	81%	0.805	S	S	*	*			trans	-167.7	103.2	148.6	-108.2	170.7	-178.7	179.4	0	108.7
279	R	40.1	Very low	38.3	Very low	244 Å²	244	151.5 Å²	151.5	92%	0.921	81%	0.805	S	S	*	*				64.8	99.2	100.1	-77.8	-165.5	-179.7	-154.8	2.1	115.7
280	K	35.4	Very low	38	Very low	183 Å²	183	150.7 Å²	150.7	80%	0.796	81%	0.81	S	S	*	*			trans	1.8	130	134.8	-138.2	-178.8	-173.3	-164.1	0	117.9	E282	K280-E282 IonicContact NZ-OE2 3.28Å
281	E	41.7	Very low	37.8	Very low	199 Å²	199	153 Å²	153	93%	0.93	82%	0.822	S	S	*	*			trans	-145.9	130.7	145	-151.6	161.8	-158.7	0	0	110.7
282	E	34.1	Very low	37.5	Very low	144 Å²	144	150.1 Å²	150.1	67%	0.673	82%	0.82	S	S	*	*			trans	-105.4	131.5	-175.7	-128.4	171.1	143.4	0	0	107	K280	K280-E282 IonicContact NZ-OE2 3.28Å
283	S	50.3	Low	37.7	Very low	121 Å²	121	150 Å²	150	85%	0.846	82%	0.819	S	S	*	*			trans	-142.2	105.5	161	71.6	0	0	0	0	111.4
284	N	37	Very low	38	Very low	149 Å²	149	152.4 Å²	152.4	80%	0.797	82%	0.818	S	S	*	*			trans	-65.9	132.8	165.1	-76.8	-54.5	0	0	0	110.5
285	K	46.7	Very low	37.9	Very low	216 Å²	216	151.7 Å²	151.7	94%	0.939	81%	0.813	S	S	*	*			trans	-140.3	132.2	149.3	-81.6	-170.3	180	172.1	0	111.2
286	K	33.3	Very low	37.9	Very low	213 Å²	213	152.8 Å²	152.8	93%	0.926	82%	0.816	S	S	*	*			trans	-115.9	124.1	-176.4	-176	170.3	-174.9	174.6	0	107.4
287	A	38.6	Very low	37.7	Very low	92 Å²	92	151.7 Å²	151.7	76%	0.76	82%	0.816	S	S	*	*			trans	-165.6	111.6	163.1	0	0	0	0	0	105.4
288	R	35.1	Very low	37.4	Very low	253 Å²	253	156.4 Å²	156.4	96%	0.955	82%	0.82	S	S	*	*				62.4	106.9	70.6	-151.8	-177.7	-164.9	-151	3.8	112.6
289	G	32.8	Very low	37	Very low	80 Å²	80	155.7 Å²	155.7	83%	0.825	82%	0.819	S	S	*	*			trans	116.6	129.5	149.2	0	0	0	0	0	116.4
290	G	31.8	Very low	36.7	Very low	70 Å²	70	148.3 Å²	148.3	72%	0.722	81%	0.805	S	S	*	*			trans	112.2	87	139.6	0	0	0	0	0	118
291	L	35.1	Very low	37	Very low	175 Å²	175	147 Å²	147	92%	0.916	81%	0.805	S	S	*	*				45.1	125.2	124.5	-62.6	166	0	0	0	121.1
292	S	33	Very low	36.6	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	79%	0.794	S	S	*	*				120.1	140.6	118.3	-157	0	0	0	0	117.2
293	S	42	Very low	36.7	Very low	90 Å²	90	146.4 Å²	146.4	63%	0.629	80%	0.804	S	S	*	*			trans	80.3	132.6	155.4	-63.8	0	0	0	0	117.2
294	E	38.5	Very low	36	Very low	163 Å²	163	145.6 Å²	145.6	76%	0.762	80%	0.798	S	S	*	*			cis	-175.8	148.1	1.2	-118.8	162.3	115.6	0	0	107.3
295	S	37.1	Very low	36.3	Very low	106 Å²	106	141.7 Å²	141.7	74%	0.741	79%	0.793	S	S	*	*			trans	63.2	135.7	148.1	81	0	0	0	0	118.2
296	T	37.6	Very low	35.9	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	78%	0.781	S	S	*	*			cis	-170.1	144.3	46.6	34.9	0	0	0	0	110.6
297	L	35	Very low	36.5	Very low	167 Å²	167	134.4 Å²	134.4	87%	0.874	78%	0.779	S	S	*	*			trans	76.5	105	149.3	-70.6	169.3	0	0	0	120.8
298	F	29	Very low	36.3	Very low	191 Å²	191	137.3 Å²	137.3	84%	0.838	78%	0.781	S	S	*	*			trans	-54	133.7	151.7	-97.5	-105.3	0	0	0	111.7
299	E	32.3	Very low	36.6	Very low	187 Å²	187	131.2 Å²	131.2	87%	0.874	77%	0.772	S	S	*	*			trans	-133.3	107.1	146.9	-164.6	160.1	174.7	0	0	108.7
300	S	35.2	Very low	36.7	Very low	88 Å²	88	133.5 Å²	133.5	62%	0.615	77%	0.77	S	S	*	*			trans	-84.8	122.2	176.8	-50.2	0	0	0	0	108.4	P302	S300-P302 WeakPolarHBondContact O-CD 3.3Å
301	I	40.5	Very low	37.2	Very low	155 Å²	155	135.9 Å²	135.9	80%	0.795	77%	0.77	S	S	*	*			trans	-95.8	111.7	166.8	-57.9	174.3	0	0	0	107.8
302	P	33.6	Very low	37.2	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	76%	0.761	S	S	*	*			trans	-88.7	125.8	165.1	33.6	-25	0	0	0	108.4	S300	S300-P302 WeakPolarHBondContact O-CD 3.3Å
303	Y	37	Very low	37.5	Very low	223 Å²	223	137.8 Å²	137.8	88%	0.875	76%	0.764	S	S	*	*			trans	-108.8	90.4	162.9	-161.7	-98.2	0	0	0	108.7	G305	Y303-G305 PolarHBondContact O-N 3.13Å
304	S	35.5	Very low	37.4	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	77%	0.77	S	S	*	*			trans	-65.9	116.2	163	-72	0	0	0	0	109
305	G	43.7	Very low	37.4	Very low	67 Å²	67	141.1 Å²	141.1	69%	0.691	77%	0.774	S	S	*	*			trans	-121.6	86.6	163.5	0	0	0	0	0	108.2	Y303	Y303-G305 PolarHBondContact O-N 3.13Å
306	T	36.6	Very low	37.5	Very low	112 Å²	112	143.1 Å²	143.1	69%	0.687	78%	0.781	S	S	*	*			trans	-68	124.7	173.6	49.1	0	0	0	0	109.6
307	N	45.7	Very low	37.2	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	79%	0.785	S	S	*	*			trans	-143.3	107.4	147.4	-85.5	-30	0	0	0	106.9	V309	N307-V309 PolarHBondContact O-N 3.04Å
308	N	35.1	Very low	37.1	Very low	153 Å²	153	136.3 Å²	136.3	82%	0.818	78%	0.775	S	S	*	*			trans	-59.5	116	-175	-69.6	-33.9	0	0	0	111.2
309	V	41.2	Very low	37.6	Very low	126 Å²	126	134.8 Å²	134.8	76%	0.764	78%	0.775	S	S	*	*			trans	-108.4	104.6	152.8	178.2	0	0	0	0	106.2	N307 V311	N307-V309 PolarHBondContact O-N 3.04Å; V309-V311 HydrophobicContact CG1-CG2 4.37Å; V309-V311 PolarHBondContact O-N 2.89Å
310	V	35.2	Very low	38.2	Very low	128 Å²	128	133.1 Å²	133.1	78%	0.776	77%	0.768	S	S	*	*			trans	-61.7	100.2	169.7	176.1	0	0	0	0	106.9	M312	V310-M312 PolarHBondContact O-N 3.4Å
311	V	41.5	Very low	39.3	Very low	119 Å²	119	133.9 Å²	133.9	72%	0.721	77%	0.765	S	S	*	*			trans	-84.2	100.6	165	179.7	0	0	0	0	106	V309 E313	V309-V311 HydrophobicContact CG1-CG2 4.37Å; V309-V311 PolarHBondContact O-N 2.89Å; V311-E313 PolarHBondContact O-N 2.82Å
312	M	36.5	Very low	40	Very low	149 Å²	149	131.9 Å²	131.9	73%	0.734	76%	0.76	S	S	*	*			trans	-68.4	97	172.1	-167.7	164.2	-176.4	0	0	108.1	V310 H314	V310-M312 PolarHBondContact O-N 3.4Å; M312-H314 PolarHBondContact O-N 3.1Å
313	E	37.9	Very low	41.1	Very low	173 Å²	173	131.4 Å²	131.4	81%	0.808	76%	0.759	S	S	*	*			trans	-66.3	111.1	163.2	-87.6	-176.3	128.7	0	0	108.4	V311	V311-E313 PolarHBondContact O-N 2.82Å
314	H	39.7	Very low	42	Very low	165 Å²	165	123.5 Å²	123.5	76%	0.764	73%	0.734	S	S	*	*			trans	-107.7	108.9	154.2	-104.3	160.1	0	0	0	109.2	M312 V316	M312-H314 PolarHBondContact O-N 3.1Å; H314-V316 PolarHBondContact O-N 3.37Å
315	L	38.8	Very low	43.1	Very low	159 Å²	159	123.4 Å²	123.4	83%	0.832	73%	0.725	S	S	*	*			trans	-58	121	167.3	-69.9	139.8	0	0	0	110.5
316	V	40.4	Very low	44.1	Very low	148 Å²	148	128.2 Å²	128.2	90%	0.897	73%	0.727	S	S	*	*			trans	-142.3	134.2	149	-177	0	0	0	0	107.6	H314	H314-V316 PolarHBondContact O-N 3.37Å
317	G	31.4	Very low	45.4	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	71%	0.712	S	S	*	*			trans	-73.7	166.2	-158.8	0	0	0	0	0	116.3
318	G	33	Very low	46.4	Very low	63 Å²	63	125.4 Å²	125.4	65%	0.649	70%	0.701	S	S	*	*			trans	155.7	88.4	173.1	0	0	0	0	0	113.4	E320	G318-E320 PolarHBondContact O-N 3.42Å
319	N	38.6	Very low	48	Very low	159 Å²	159	122.2 Å²	122.2	85%	0.85	69%	0.687	S	S	*	*			trans	6.5	48.5	154.3	-139.7	13.7	0	0	0	122.9
320	E	46.1	Very low	49.7	Very low	152 Å²	152	119.3 Å²	119.3	71%	0.71	67%	0.673	S	S	*	*			trans	-129.7	51.4	-177.9	-59.8	-172.4	-154.7	0	0	114.6	G318 T324	G318-E320 PolarHBondContact O-N 3.42Å; E320-T324 PolarHBondContact O-OG1 2.83Å
321	N	56.8	Low	51.9	Low	104 Å²	104	118.7 Å²	118.7	56%	0.556	66%	0.664	S	S	*	*	H	α-helix	trans	-89.5	-29.4	-171.5	34.8	11.4	0	0	0	114.3	L325	N321-L325 WeakPolarHBondContact O-CB 3.46Å; N321-L325 WeakPolarHBondContact O-CD1 3.13Å; N321-L325 WeakPolarHBondContact O-CG 3.16Å; N321-L325 PolarHBondContact O-N 2.9Å
322	V	55.2	Low	53.8	Low	113 Å²	113	118.6 Å²	118.6	69%	0.685	66%	0.656	S	S	*	*	H	α-helix	trans	-80.2	-42.5	-173.9	-176.5	0	0	0	0	113	L325 K326	V322-L325 PolarHBondContact O-N 3.13Å; V322-K326 PolarHBondContact O-N 3.35Å; V322-K326 VanDerWaalsContact O-N 3.17Å
323	S	56.3	Low	56	Low	98 Å²	98	117 Å²	117	69%	0.685	65%	0.647	S	S	*	*	H	α-helix	trans	-68.6	-39.8	-179.5	-59.2	0	0	0	0	112.3	K326 A327	S323-K326 PolarHBondContact O-N 3.46Å; S323-A327 PolarHBondContact O-N 3.3Å
324	T	57.2	Low	58.1	Low	58 Å²	58	114.3 Å²	114.3	36%	0.356	64%	0.637	S	S	.	*	H	α-helix	trans	-65.2	-38.6	176.7	-53.4	0	0	0	0	112	E320 A327 R328	E320-T324 PolarHBondContact O-OG1 2.83Å; T324-A327 PolarHBondContact O-N 3.08Å; T324-R328 VanDerWaalsContact O-CG 3.3Å; T324-R328 WeakPolarHBondContact O-CG 3.45Å; T324-R328 PolarHBondContact O-N 2.97Å
325	L	59.2	Low	60.4	Low	103 Å²	103	109.5 Å²	109.5	54%	0.539	63%	0.626	S	S	.	*	H	α-helix	trans	-66.9	-41.6	175.6	-73.8	173.3	0	0	0	112	N321 V322 A327 R328 V329	N321-L325 WeakPolarHBondContact O-CB 3.46Å; N321-L325 WeakPolarHBondContact O-CD1 3.13Å; N321-L325 WeakPolarHBondContact O-CG 3.16Å; N321-L325 PolarHBondContact O-N 2.9Å; V322-L325 PolarHBondContact O-N 3.13Å; L325-A327 PolarHBondContact O-N 3.33Å; L325-R328 PolarHBondContact O-N 2.99Å; L325-V329 WeakPolarHBondContact O-CG2 3.29Å; L325-V329 PolarHBondContact O-N 3.43Å
326	K	63.4	Low	62.7	Low	168 Å²	168	108.1 Å²	108.1	73%	0.73	61%	0.613	S	S	*	*	H	α-helix	trans	-64.3	-40.3	176.4	-166.7	173.5	-176.2	177	0	112.1	V322 S323 V329 S330	V322-K326 PolarHBondContact O-N 3.35Å; V322-K326 VanDerWaalsContact O-N 3.17Å; S323-K326 PolarHBondContact O-N 3.46Å; K326-V329 PolarHBondContact O-N 2.99Å; K326-S330 PolarHBondContact O-N 3.19Å
327	A	64.6	Low	65.1	Low	47 Å²	47	105.2 Å²	105.2	39%	0.388	59%	0.593	S	S	.	*	H	α-helix	trans	-62.2	-43.8	174.3	0	0	0	0	0	111.8	S323 T324 L325 V329 S330 L331	S323-A327 PolarHBondContact O-N 3.3Å; T324-A327 PolarHBondContact O-N 3.08Å; L325-A327 PolarHBondContact O-N 3.33Å; A327-V329 PolarHBondContact O-N 2.97Å; A327-S330 PolarHBondContact O-N 3.35Å; A327-S330 PolarHBondContact O-OG 3.42Å; A327-L331 WeakPolarHBondContact O-CG 3.33Å; A327-L331 PolarHBondContact O-N 3.5Å
328	R	65.8	Low	67.9	Low	168 Å²	168	110.4 Å²	110.4	63%	0.634	59%	0.588	S	S	*	*	H	α-helix	trans	-62.8	-42	176.4	-74.4	176.8	177.7	176.1	0.4	112.9	T324 L325 S330 L331 Q332	T324-R328 VanDerWaalsContact O-CG 3.3Å; T324-R328 WeakPolarHBondContact O-CG 3.45Å; T324-R328 PolarHBondContact O-N 2.97Å; L325-R328 PolarHBondContact O-N 2.99Å; R328-S330 VanDerWaalsContact C-N 3.34Å; R328-L331 PolarHBondContact O-N 3.41Å; R328-Q332 WeakPolarHBondContact O-CB 3.46Å; R328-Q332 PolarHBondContact O-N 2.97Å
329	V	70.2	Confident	70.7	Confident	87 Å²	87	109.1 Å²	109.1	53%	0.527	57%	0.574	S	S	.	*	H	α-helix	trans	-62	-43.6	175.1	173.8	0	0	0	0	110.6	L325 K326 A327 L331 Q332 E333	L325-V329 WeakPolarHBondContact O-CG2 3.29Å; L325-V329 PolarHBondContact O-N 3.43Å; K326-V329 PolarHBondContact O-N 2.99Å; A327-V329 PolarHBondContact O-N 2.97Å; V329-L331 PolarHBondContact O-N 2.92Å; V329-Q332 PolarHBondContact O-N 3.26Å; V329-E333 WeakPolarHBondContact O-CB 3.39Å; V329-E333 PolarHBondContact O-N 3.07Å
330	S	77	Confident	73.2	Confident	65 Å²	65	105.5 Å²	105.5	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-64.9	-40	179.1	73.8	0	0	0	0	113.4	K326 A327 R328 E333 L334	K326-S330 PolarHBondContact O-N 3.19Å; A327-S330 PolarHBondContact O-N 3.35Å; A327-S330 PolarHBondContact O-OG 3.42Å; R328-S330 VanDerWaalsContact C-N 3.34Å; S330-E333 PolarHBondContact O-N 2.98Å; S330-L334 WeakPolarHBondContact O-CB 3.49Å; S330-L334 PolarHBondContact O-N 3.39Å
331	L	79.7	Confident	75.3	Confident	114 Å²	114	100.7 Å²	100.7	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-68.4	-39.1	176.4	-74.2	173.2	0	0	0	111.9	A327 R328 V329 L334 A335	A327-L331 WeakPolarHBondContact O-CG 3.33Å; A327-L331 PolarHBondContact O-N 3.5Å; R328-L331 PolarHBondContact O-N 3.41Å; V329-L331 PolarHBondContact O-N 2.92Å; L331-L334 PolarHBondContact O-N 2.97Å; L331-A335 WeakPolarHBondContact O-CB 3.46Å; L331-A335 PolarHBondContact O-N 2.99Å
332	Q	81.8	Confident	76.9	Confident	117 Å²	117	100.1 Å²	100.1	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-66.4	-39.3	176.9	-169.6	178.5	20.1	0	0	111.8	R328 V329 A335 K336	R328-Q332 WeakPolarHBondContact O-CB 3.46Å; R328-Q332 PolarHBondContact O-N 2.97Å; V329-Q332 PolarHBondContact O-N 3.26Å; Q332-A335 PolarHBondContact O-N 3.43Å; Q332-K336 WeakPolarHBondContact O-CG 3.42Å; Q332-K336 PolarHBondContact O-N 3.43Å
333	E	83.6	Confident	78.6	Confident	116 Å²	116	99.5 Å²	99.5	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-42.7	174.8	-171.6	171.7	-175.7	0	0	111.5	V329 S330 A335 K336 N337	V329-E333 WeakPolarHBondContact O-CB 3.39Å; V329-E333 PolarHBondContact O-N 3.07Å; S330-E333 PolarHBondContact O-N 2.98Å; E333-A335 VanDerWaalsContact C-N 3.33Å; E333-A335 PolarHBondContact O-N 3.01Å; E333-K336 PolarHBondContact O-N 3.45Å; E333-N337 WeakPolarHBondContact O-CB 3.28Å; E333-N337 VanDerWaalsContact O-CG 3.3Å; E333-N337 PolarHBondContact O-N 2.98Å; E333-N337 PolarHBondContact O-ND2 3Å
334	L	82	Confident	80.4	Confident	116 Å²	116	103.3 Å²	103.3	61%	0.607	53%	0.528	S	S	*	.	H	α-helix	trans	-60.9	-41.3	174.9	-172.2	65.4	0	0	0	112	S330 L331 N337 R338	S330-L334 WeakPolarHBondContact O-CB 3.49Å; S330-L334 PolarHBondContact O-N 3.39Å; L331-L334 PolarHBondContact O-N 2.97Å; L334-N337 PolarHBondContact O-N 2.83Å; L334-R338 WeakPolarHBondContact O-CB 3.48Å; L334-R338 PolarHBondContact O-N 3.47Å
335	A	87.2	Confident	82.1	Confident	65 Å²	65	106 Å²	106	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-41.5	176.6	0	0	0	0	0	112.4	L331 Q332 E333 R338 G339	L331-A335 WeakPolarHBondContact O-CB 3.46Å; L331-A335 PolarHBondContact O-N 2.99Å; Q332-A335 PolarHBondContact O-N 3.43Å; E333-A335 VanDerWaalsContact C-N 3.33Å; E333-A335 PolarHBondContact O-N 3.01Å; A335-R338 PolarHBondContact O-N 2.97Å; A335-G339 PolarHBondContact O-N 3.21Å
336	K	87.9	Confident	83.7	Confident	129 Å²	129	107.2 Å²	107.2	56%	0.561	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-47.7	174.7	-72.8	176.6	-178.9	178.2	0	111.7	Q332 E333 R338 G339 D340	Q332-K336 WeakPolarHBondContact O-CG 3.42Å; Q332-K336 PolarHBondContact O-N 3.43Å; E333-K336 PolarHBondContact O-N 3.45Å; K336-R338 VanDerWaalsContact C-N 3.26Å; K336-R338 PolarHBondContact O-N 3.05Å; K336-G339 WeakPolarHBondContact O-CA 3.49Å; K336-G339 PolarHBondContact O-N 3.04Å; K336-D340 PolarHBondContact O-N 3.35Å
337	N	90.2	Very high	85.1	Confident	88 Å²	88	105.1 Å²	105.1	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-58.9	-38.3	178.1	-73.1	-25.3	0	0	0	111.9	E333 L334 A341	E333-N337 WeakPolarHBondContact O-CB 3.28Å; E333-N337 VanDerWaalsContact O-CG 3.3Å; E333-N337 PolarHBondContact O-N 2.98Å; E333-N337 PolarHBondContact O-ND2 3Å; L334-N337 PolarHBondContact O-N 2.83Å; N337-A341 VanDerWaalsContact O-CB 3.29Å; N337-A341 WeakPolarHBondContact O-CB 3.3Å; N337-A341 PolarHBondContact O-N 3.48Å
338	R	90.9	Very high	86.5	Confident	189 Å²	189	109.6 Å²	109.6	71%	0.713	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-45.2	173	-176	-178.3	173.4	109.6	-2.5	111.8	L334 A335 K336 A341 M342	L334-R338 WeakPolarHBondContact O-CB 3.48Å; L334-R338 PolarHBondContact O-N 3.47Å; A335-R338 PolarHBondContact O-N 2.97Å; K336-R338 VanDerWaalsContact C-N 3.26Å; K336-R338 PolarHBondContact O-N 3.05Å; R338-A341 PolarHBondContact O-N 3.41Å; R338-M342 WeakPolarHBondContact O-CB 3.31Å; R338-M342 VanDerWaalsContact O-CG 3.28Å; R338-M342 WeakPolarHBondContact O-CG 3.4Å; R338-M342 PolarHBondContact O-N 2.81Å
339	G	90.4	Very high	87.7	Confident	35 Å²	35	107.3 Å²	107.3	36%	0.361	53%	0.531	S	S	.	.	H	α-helix	trans	-58.2	-48.6	176.6	0	0	0	0	0	112.6	A335 K336 M342 L343	A335-G339 PolarHBondContact O-N 3.21Å; K336-G339 WeakPolarHBondContact O-CA 3.49Å; K336-G339 PolarHBondContact O-N 3.04Å; G339-M342 WeakPolarHBondContact O-CB 3.41Å; G339-M342 PolarHBondContact O-N 3.21Å; G339-L343 PolarHBondContact O-N 3Å
340	D	92.2	Very high	88.6	Confident	84 Å²	84	111.3 Å²	111.3	45%	0.449	54%	0.542	S	S	.	.	H	α-helix	trans	-64.3	-42.1	178.7	-73.9	-6.7	0	0	0	112.2	K336 M342 L343 R344	K336-D340 PolarHBondContact O-N 3.35Å; D340-M342 VanDerWaalsContact C-N 3.3Å; D340-M342 PolarHBondContact O-N 3.39Å; D340-L343 PolarHBondContact O-N 3.03Å; D340-R344 WeakPolarHBondContact O-CG 3.45Å; D340-R344 PolarHBondContact O-N 3.06Å
341	A	89.1	Confident	88.8	Confident	50 Å²	50	113.2 Å²	113.2	41%	0.413	55%	0.55	S	S	.	*	H	α-helix	trans	-61.2	-40	175.2	0	0	0	0	0	111.7	N337 R338 R344 Y345	N337-A341 VanDerWaalsContact O-CB 3.29Å; N337-A341 WeakPolarHBondContact O-CB 3.3Å; N337-A341 PolarHBondContact O-N 3.48Å; R338-A341 PolarHBondContact O-N 3.41Å; A341-R344 PolarHBondContact O-N 3.08Å; A341-Y345 WeakPolarHBondContact O-CB 3.28Å; A341-Y345 PolarHBondContact O-N 2.86Å
342	M	90.3	Very high	89	Confident	93 Å²	93	112.5 Å²	112.5	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-65.9	-38.9	175.6	-73.5	-63.5	99.5	0	0	112.8	R338 G339 D340 Y345 K346	R338-M342 WeakPolarHBondContact O-CB 3.31Å; R338-M342 VanDerWaalsContact O-CG 3.28Å; R338-M342 WeakPolarHBondContact O-CG 3.4Å; R338-M342 PolarHBondContact O-N 2.81Å; G339-M342 WeakPolarHBondContact O-CB 3.41Å; G339-M342 PolarHBondContact O-N 3.21Å; D340-M342 VanDerWaalsContact C-N 3.3Å; D340-M342 PolarHBondContact O-N 3.39Å; M342-Y345 PolarHBondContact O-N 2.85Å; M342-K346 WeakPolarHBondContact O-CG 3.08Å; M342-K346 PolarHBondContact O-N 2.78Å
343	L	92	Very high	88.5	Confident	100 Å²	100	116.2 Å²	116.2	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-47.8	174.3	-73.6	171.7	0	0	0	111.6	G339 D340 Y345 K346 E347	G339-L343 PolarHBondContact O-N 3Å; D340-L343 PolarHBondContact O-N 3.03Å; L343-Y345 VanDerWaalsContact C-N 3.26Å; L343-Y345 PolarHBondContact O-N 3.11Å; L343-K346 WeakPolarHBondContact O-CB 3.47Å; L343-K346 PolarHBondContact O-N 3.3Å; L343-E347 WeakPolarHBondContact O-CG 3.28Å; L343-E347 PolarHBondContact O-N 3.44Å
344	R	93.9	Very high	87.8	Confident	178 Å²	178	119.2 Å²	119.2	67%	0.672	56%	0.556	S	S	*	*	H	α-helix	trans	-58.3	-39.3	175.6	-67.8	176.9	-162.6	-134.1	5.6	111.9	D340 A341 K348	D340-R344 WeakPolarHBondContact O-CG 3.45Å; D340-R344 PolarHBondContact O-N 3.06Å; A341-R344 PolarHBondContact O-N 3.08Å; R344-K348 WeakPolarHBondContact O-CB 3.47Å; R344-K348 PolarHBondContact O-N 3.4Å
345	Y	92.5	Very high	87.4	Confident	113 Å²	113	119.9 Å²	119.9	44%	0.443	56%	0.56	S	S	.	*	H	α-helix	trans	-62.7	-45.7	174.9	175.6	-102.6	0	0	0	111.7	A341 M342 L343 K348 K349	A341-Y345 WeakPolarHBondContact O-CB 3.28Å; A341-Y345 PolarHBondContact O-N 2.86Å; M342-Y345 PolarHBondContact O-N 2.85Å; L343-Y345 VanDerWaalsContact C-N 3.26Å; L343-Y345 PolarHBondContact O-N 3.11Å; Y345-K348 PolarHBondContact O-N 3.49Å; Y345-K349 HydrophobicContact CE1-CD 4.45Å; Y345-K349 WeakPolarHBondContact O-CB 3.37Å; Y345-K349 PolarHBondContact O-N 3.45Å
346	K	93.3	Very high	86.3	Confident	129 Å²	129	126.9 Å²	126.9	56%	0.561	58%	0.579	S	S	*	*	H	α-helix	trans	-62.5	-45	177.4	-72.5	175.9	-178.2	-178.2	0	111.7	M342 L343 K349 K350	M342-K346 WeakPolarHBondContact O-CG 3.08Å; M342-K346 PolarHBondContact O-N 2.78Å; L343-K346 WeakPolarHBondContact O-CB 3.47Å; L343-K346 PolarHBondContact O-N 3.3Å; K346-K349 PolarHBondContact O-N 3.35Å; K346-K350 WeakPolarHBondContact O-CG 3.48Å; K346-K350 PolarHBondContact O-N 3.03Å
347	E	92.9	Very high	85.4	Confident	124 Å²	124	129 Å²	129	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-62.9	-46.4	175.6	-71.1	177.6	170.4	0	0	112.3	L343 K349 K350 T351	L343-E347 WeakPolarHBondContact O-CG 3.28Å; L343-E347 PolarHBondContact O-N 3.44Å; E347-K349 PolarHBondContact O-N 2.84Å; E347-K350 PolarHBondContact O-N 3.29Å; E347-T351 PolarHBondContact O-N 2.94Å; E347-T351 VanDerWaalsContact O-N 3.09Å; E347-T351 PolarHBondContact O-OG1 3.41Å; E347-T351 VanDerWaalsContact O-OG1 3.04Å
348	K	93	Very high	84.1	Confident	141 Å²	141	131.2 Å²	131.2	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-61.6	-34.4	175.5	-173.4	175	-179.2	-178.7	0	111.4	R344 Y345 T351 R352	R344-K348 WeakPolarHBondContact O-CB 3.47Å; R344-K348 PolarHBondContact O-N 3.4Å; Y345-K348 PolarHBondContact O-N 3.49Å; K348-T351 WeakPolarHBondContact CA-OG1 3.37Å; K348-T351 PolarHBondContact O-OG1 2.72Å; K348-R352 WeakPolarHBondContact O-CG 3.47Å; K348-R352 PolarHBondContact O-N 3.24Å
349	K	90.8	Very high	83.3	Confident	120 Å²	120	130 Å²	130	52%	0.522	60%	0.596	S	S	.	*	H	α-helix	trans	-68.7	-42.9	175.6	-169.7	176.1	177.9	-178.7	0	111.6	Y345 K346 E347 T351 R352	Y345-K349 HydrophobicContact CE1-CD 4.45Å; Y345-K349 WeakPolarHBondContact O-CB 3.37Å; Y345-K349 PolarHBondContact O-N 3.45Å; K346-K349 PolarHBondContact O-N 3.35Å; E347-K349 PolarHBondContact O-N 2.84Å; K349-T351 VanDerWaalsContact C-N 3.27Å; K349-T351 PolarHBondContact O-N 3.03Å; K349-R352 WeakPolarHBondContact O-CG 3.46Å; K349-R352 PolarHBondContact O-N 3.15Å
350	K	89	Confident	82.7	Confident	172 Å²	172	135.9 Å²	135.9	75%	0.748	61%	0.608	S	S	*	*	H	α-helix	trans	-62.2	-32.3	176.2	-71.2	175.6	-178.9	-175.5	0	113.1	K346 E347	K346-K350 WeakPolarHBondContact O-CG 3.48Å; K346-K350 PolarHBondContact O-N 3.03Å; E347-K350 PolarHBondContact O-N 3.29Å
351	T	82.9	Confident	82	Confident	104 Å²	104	139.8 Å²	139.8	64%	0.638	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	1	-179.3	52.8	0	0	0	0	114.1	E347 K348 K349 R353	E347-T351 PolarHBondContact O-N 2.94Å; E347-T351 VanDerWaalsContact O-N 3.09Å; E347-T351 PolarHBondContact O-OG1 3.41Å; E347-T351 VanDerWaalsContact O-OG1 3.04Å; K348-T351 WeakPolarHBondContact CA-OG1 3.37Å; K348-T351 PolarHBondContact O-OG1 2.72Å; K349-T351 VanDerWaalsContact C-N 3.27Å; K349-T351 PolarHBondContact O-N 3.03Å; T351-R353 PolarHBondContact O-N 3.04Å
352	R	82.2	Confident	81.7	Confident	99 Å²	99	141.2 Å²	141.2	37%	0.374	63%	0.631	S	S	.	*			trans	-69	124.5	174.9	-57.7	-174.4	-174	-170.3	2.3	109	K348 K349 Y354	K348-R352 WeakPolarHBondContact O-CG 3.47Å; K348-R352 PolarHBondContact O-N 3.24Å; K349-R352 WeakPolarHBondContact O-CG 3.46Å; K349-R352 PolarHBondContact O-N 3.15Å; R352-Y354 HydrophobicContact CB-CE2 4.27Å
353	R	72.3	Confident	81.4	Confident	196 Å²	196	144.7 Å²	144.7	74%	0.74	64%	0.639	S	S	*	*			trans	-101.8	126	163.8	-60.5	-65.2	-175.1	-146.1	2.2	107.1	T351	T351-R353 PolarHBondContact O-N 3.04Å
354	Y	69.5	Low	81.2	Confident	179 Å²	179	145.2 Å²	145.2	70%	0.702	64%	0.637	S	S	*	*			trans	-92.8	-2.2	178.8	-71	-77.3	0	0	0	112.8	R352 K356	R352-Y354 HydrophobicContact CB-CE2 4.27Å; Y354-K356 PolarHBondContact O-N 2.88Å
355	D	72.3	Confident	80.9	Confident	129 Å²	129	139.5 Å²	139.5	69%	0.69	63%	0.628	S	S	*	*			trans	-60.5	134.7	178	-65.6	-52.8	0	0	0	111.6	H357	D355-H357 PolarHBondContact O-N 3.43Å
356	K	65.3	Low	80.5	Confident	213 Å²	213	143.3 Å²	143.3	93%	0.926	64%	0.642	S	S	*	*			trans	-73.7	0.8	177.2	-61.8	179.2	-178.6	177.7	0	112.5	Y354 I358	Y354-K356 PolarHBondContact O-N 2.88Å; K356-I358 PolarHBondContact O-N 3.3Å
357	H	67.5	Low	80.3	Confident	173 Å²	173	138.4 Å²	138.4	80%	0.801	63%	0.625	S	S	*	*	S	Bend	trans	-72	126	-179.4	-142	74.1	0	0	0	110.8	D355 R359	D355-H357 PolarHBondContact O-N 3.43Å; H357-R359 PolarHBondContact O-N 3.39Å
358	I	63.9	Low	80.1	Confident	134 Å²	134	136.9 Å²	136.9	69%	0.687	62%	0.621	S	S	*	*			trans	-56.9	127.1	-167.4	-58	-172.2	0	0	0	110.4	K356 Y360	K356-I358 PolarHBondContact O-N 3.3Å; I358-Y360 PolarHBondContact O-N 3.07Å
359	R	73.8	Confident	79.9	Confident	163 Å²	163	135.7 Å²	135.7	62%	0.615	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	19.5	173.2	-65	-173.2	-176.6	101.8	5.5	114.4	H357 E361 S362 R363	H357-R359 PolarHBondContact O-N 3.39Å; R359-E361 VanDerWaalsContact C-N 3.32Å; R359-E361 PolarHBondContact O-N 2.99Å; R359-S362 PolarHBondContact O-N 3Å; R359-R363 HydrophobicContact CB-CG 4.37Å; R359-R363 WeakPolarHBondContact O-CB 3.48Å; R359-R363 WeakPolarHBondContact O-CG 3.49Å; R359-R363 PolarHBondContact O-N 3.46Å
360	Y	77.9	Confident	79.8	Confident	159 Å²	159	136.2 Å²	136.2	62%	0.624	62%	0.624	S	S	*	*	H	α-helix	trans	-62.1	-42.1	-172.4	-166.7	-104.9	0	0	0	110.7	I358 S362 R363 K364	I358-Y360 PolarHBondContact O-N 3.07Å; Y360-S362 PolarHBondContact O-N 2.89Å; Y360-R363 PolarHBondContact O-N 3.27Å; Y360-K364 HydrophobicContact CE1-CD 4.04Å; Y360-K364 WeakPolarHBondContact O-CB 3.47Å; Y360-K364 PolarHBondContact O-N 3.27Å
361	E	78.3	Confident	79.8	Confident	166 Å²	166	136.3 Å²	136.3	78%	0.776	63%	0.625	S	S	*	*	H	α-helix	trans	-58.8	-48	175.4	-62.1	-174.9	160.3	0	0	112	R359 K364 A365	R359-E361 VanDerWaalsContact C-N 3.32Å; R359-E361 PolarHBondContact O-N 2.99Å; E361-K364 PolarHBondContact O-N 3.44Å; E361-A365 WeakPolarHBondContact O-CB 3.19Å; E361-A365 PolarHBondContact O-N 2.98Å
362	S	82.7	Confident	80.1	Confident	81 Å²	81	136.4 Å²	136.4	57%	0.566	61%	0.613	S	S	*	*	H	α-helix	trans	-64.6	-44.8	177.8	178.8	0	0	0	0	112.6	R359 Y360 K364 R366	R359-S362 PolarHBondContact O-N 3Å; Y360-S362 PolarHBondContact O-N 2.89Å; S362-K364 VanDerWaalsContact C-N 3.34Å; S362-R366 WeakPolarHBondContact O-CB 3.1Å; S362-R366 PolarHBondContact O-N 3.28Å
363	R	83.9	Confident	80.2	Confident	166 Å²	166	136 Å²	136	63%	0.626	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-38.9	177.8	-69.8	-177.8	-154.6	-117.2	9.4	111.2	R359 Y360 R366 A367	R359-R363 HydrophobicContact CB-CG 4.37Å; R359-R363 WeakPolarHBondContact O-CB 3.48Å; R359-R363 WeakPolarHBondContact O-CG 3.49Å; R359-R363 PolarHBondContact O-N 3.46Å; Y360-R363 PolarHBondContact O-N 3.27Å; R363-R366 PolarHBondContact O-N 3.32Å; R363-A367 VanDerWaalsContact O-CB 3.28Å; R363-A367 WeakPolarHBondContact O-CB 3.33Å; R363-A367 PolarHBondContact O-N 3.26Å
364	K	87.4	Confident	80.7	Confident	110 Å²	110	138.4 Å²	138.4	48%	0.478	63%	0.631	S	S	.	*	H	α-helix	trans	-67.1	-48.7	177.6	-174	175.9	-178.6	-169.5	0	111.1	Y360 E361 S362 R366 A367 D368	Y360-K364 HydrophobicContact CE1-CD 4.04Å; Y360-K364 WeakPolarHBondContact O-CB 3.47Å; Y360-K364 PolarHBondContact O-N 3.27Å; E361-K364 PolarHBondContact O-N 3.44Å; S362-K364 VanDerWaalsContact C-N 3.34Å; K364-R366 VanDerWaalsContact C-N 3.3Å; K364-R366 PolarHBondContact O-N 3.38Å; K364-A367 CarbonylContact O-C 3.59Å; K364-A367 WeakPolarHBondContact O-CB 3.37Å; K364-A367 PolarHBondContact O-N 2.86Å; K364-D368 WeakPolarHBondContact CG-OD2 3.38Å; K364-D368 WeakPolarHBondContact O-CB 3.36Å; K364-D368 PolarHBondContact O-N 3Å
365	A	86.5	Confident	81.5	Confident	58 Å²	58	133.2 Å²	133.2	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-57.7	-41.9	174.5	0	0	0	0	0	112.4	E361 D368 T369	E361-A365 WeakPolarHBondContact O-CB 3.19Å; E361-A365 PolarHBondContact O-N 2.98Å; A365-D368 PolarHBondContact O-N 3.2Å; A365-T369 VanDerWaalsContact O-CG2 3.32Å; A365-T369 WeakPolarHBondContact O-CG2 3.36Å; A365-T369 PolarHBondContact O-N 3.43Å; A365-T369 VanDerWaalsContact O-N 3.09Å; A365-T369 PolarHBondContact O-OG1 3.3Å
366	R	85.5	Confident	82.1	Confident	193 Å²	193	136.9 Å²	136.9	73%	0.728	64%	0.636	S	S	*	*	H	α-helix	trans	-68.9	-35.7	175.2	-166.4	176.8	-160.9	166.5	6.4	112.8	S362 R363 K364 T369 R370	S362-R366 WeakPolarHBondContact O-CB 3.1Å; S362-R366 PolarHBondContact O-N 3.28Å; R363-R366 PolarHBondContact O-N 3.32Å; K364-R366 VanDerWaalsContact C-N 3.3Å; K364-R366 PolarHBondContact O-N 3.38Å; R366-T369 WeakPolarHBondContact CA-OG1 3.46Å; R366-T369 PolarHBondContact O-OG1 3.21Å; R366-T369 VanDerWaalsContact O-OG1 3.11Å; R366-R370 VanDerWaalsContact O-CG 3.28Å; R366-R370 WeakPolarHBondContact O-CG 3.32Å
367	A	88.1	Confident	83.2	Confident	26 Å²	26	130.2 Å²	130.2	22%	0.215	61%	0.608	C	S	.	*	H	α-helix	trans	-66.6	-44.6	174.6	0	0	0	0	0	110.3	R363 K364 T369 R370 R372 F377	R363-A367 VanDerWaalsContact O-CB 3.28Å; R363-A367 WeakPolarHBondContact O-CB 3.33Å; R363-A367 PolarHBondContact O-N 3.26Å; K364-A367 CarbonylContact O-C 3.59Å; K364-A367 WeakPolarHBondContact O-CB 3.37Å; K364-A367 PolarHBondContact O-N 2.86Å; A367-T369 PolarHBondContact O-N 3.33Å; A367-R370 PolarHBondContact O-N 3.36Å; A367-R372 PolarHBondContact O-NH1 3.21Å; A367-R372 PolarHBondContact O-NH2 2.79Å; A367-F377 HydrophobicContact CB-CZ 4.03Å; A367-F377 WeakPolarHBondContact O-CE1 3.4Å
368	D	89.4	Confident	84.1	Confident	93 Å²	93	123.8 Å²	123.8	50%	0.497	58%	0.581	S	S	.	*	H	α-helix	trans	-69.2	-31.2	-174.8	-67	-15	0	0	0	113.3	K364 A365 R372	K364-D368 WeakPolarHBondContact CG-OD2 3.38Å; K364-D368 WeakPolarHBondContact O-CB 3.36Å; K364-D368 PolarHBondContact O-N 3Å; A365-D368 PolarHBondContact O-N 3.2Å; D368-R372 IonicContact OD1-NH1 3.01Å; D368-R372 IonicContact OD1-NH2 3.92Å; D368-R372 PolarHBondContact OD1-NH2 3.43Å
369	T	89.4	Confident	85	Confident	116 Å²	116	124.5 Å²	124.5	71%	0.712	58%	0.578	S	S	*	*	H	α-helix	trans	-75.4	-17.8	174.3	48	0	0	0	0	114.3	A365 R366 A367	A365-T369 VanDerWaalsContact O-CG2 3.32Å; A365-T369 WeakPolarHBondContact O-CG2 3.36Å; A365-T369 PolarHBondContact O-N 3.43Å; A365-T369 VanDerWaalsContact O-N 3.09Å; A365-T369 PolarHBondContact O-OG1 3.3Å; R366-T369 WeakPolarHBondContact CA-OG1 3.46Å; R366-T369 PolarHBondContact O-OG1 3.21Å; R366-T369 VanDerWaalsContact O-OG1 3.11Å; A367-T369 PolarHBondContact O-N 3.33Å
370	R	88.9	Confident	85.3	Confident	130 Å²	130	121.3 Å²	121.3	49%	0.491	59%	0.587	S	S	.	*	S	Bend	trans	-79.2	135.4	-179.4	-73.8	172.3	73.5	179.4	4.5	111.1	R366 A367 R372 F377	R366-R370 VanDerWaalsContact O-CG 3.28Å; R366-R370 WeakPolarHBondContact O-CG 3.32Å; A367-R370 PolarHBondContact O-N 3.36Å; R370-R372 PolarHBondContact O-N 3.08Å; R370-F377 HydrophobicContact CB-CD1 3.55Å; R370-F377 HydrophobicContact CB-CE1 3.6Å; R370-F377 HydrophobicContact CG-CD1 4.47Å; R370-F377 HydrophobicContact CG-CE1 4.43Å
371	K	88.6	Confident	85.2	Confident	174 Å²	174	118 Å²	118	76%	0.757	59%	0.587	S	S	*	*			trans	-57	132.6	172.3	-68.5	-172.3	177.2	-176.1	0	110.5	V378	K371-V378 HydrophobicContact CB-CB 4.32Å; K371-V378 HydrophobicContact CB-CG2 3.85Å; K371-V378 PolarHBondContact O-N 3.32Å; K371-V378 VanDerWaalsContact O-N 3.08Å
372	R	89	Confident	84.8	Confident	106 Å²	106	114.5 Å²	114.5	40%	0.4	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.3	142	175.9	-63.9	-176.9	-177.4	97.3	-19.8	110.1	A367 D368 R370 R376 F377	A367-R372 PolarHBondContact O-NH1 3.21Å; A367-R372 PolarHBondContact O-NH2 2.79Å; D368-R372 IonicContact OD1-NH1 3.01Å; D368-R372 IonicContact OD1-NH2 3.92Å; D368-R372 PolarHBondContact OD1-NH2 3.43Å; R370-R372 PolarHBondContact O-N 3.08Å; R372-R376 CarbonylContact C-O 3.59Å; R372-R376 WeakPolarHBondContact CA-O 3.36Å; R372-F377 HydrophobicContact CG-CD1 3.68Å; R372-F377 HydrophobicContact CG-CE1 3.89Å; R372-F377 VanDerWaalsContact NE-CE1 3.25Å
373	V	83.8	Confident	84	Confident	91 Å²	91	115.4 Å²	115.4	55%	0.552	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-125.2	122.8	170.4	171.8	0	0	0	0	107	G375 R376 V378	V373-G375 VanDerWaalsContact C-N 3.25Å; V373-G375 PolarHBondContact O-N 3.31Å; V373-R376 PolarHBondContact N-O 2.87Å; V373-R376 PolarHBondContact O-N 3.09Å; V373-V378 HydrophobicContact CB-CG2 4.26Å; V373-V378 HydrophobicContact CG2-CG2 3.59Å
374	R	83.8	Confident	83	Confident	246 Å²	246	116.6 Å²	116.6	93%	0.928	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.5	42.4	-178.2	-55.6	178.4	85.5	168.6	5.6	113.6	R376	R374-R376 VanDerWaalsContact C-N 3.28Å; R374-R376 PolarHBondContact O-N 2.9Å
375	G	85	Confident	81	Confident	71 Å²	71	119 Å²	119	73%	0.732	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.8	-2	179.1	0	0	0	0	0	115.6	V373	V373-G375 VanDerWaalsContact C-N 3.25Å; V373-G375 PolarHBondContact O-N 3.31Å
376	R	84.5	Confident	80.8	Confident	205 Å²	205	122 Å²	122	77%	0.774	64%	0.636	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.2	143.5	177.3	-62.5	-179.1	-178	-87.9	0	110.6	R372 V373 R374 V378	R372-R376 CarbonylContact C-O 3.59Å; R372-R376 WeakPolarHBondContact CA-O 3.36Å; V373-R376 PolarHBondContact N-O 2.87Å; V373-R376 PolarHBondContact O-N 3.09Å; R374-R376 VanDerWaalsContact C-N 3.28Å; R374-R376 PolarHBondContact O-N 2.9Å; R376-V378 PolarHBondContact O-N 3.09Å
377	F	89.6	Confident	80.5	Confident	74 Å²	74	118.3 Å²	118.3	33%	0.325	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.9	134.1	170.9	-65.8	-57.2	0	0	0	110	A367 R370 R372 K379	A367-F377 HydrophobicContact CB-CZ 4.03Å; A367-F377 WeakPolarHBondContact O-CE1 3.4Å; R370-F377 HydrophobicContact CB-CD1 3.55Å; R370-F377 HydrophobicContact CB-CE1 3.6Å; R370-F377 HydrophobicContact CG-CD1 4.47Å; R370-F377 HydrophobicContact CG-CE1 4.43Å; R372-F377 HydrophobicContact CG-CD1 3.68Å; R372-F377 HydrophobicContact CG-CE1 3.89Å; R372-F377 VanDerWaalsContact NE-CE1 3.25Å; F377-K379 PolarHBondContact O-N 3.3Å
378	V	85.9	Confident	80.1	Confident	38 Å²	38	123.4 Å²	123.4	23%	0.23	65%	0.654	C	S	.	*	P	Polyproline II helix	trans	-61.3	124.1	177.7	179.8	0	0	0	0	109.3	K371 V373 R376 D382 V383	K371-V378 HydrophobicContact CB-CB 4.32Å; K371-V378 HydrophobicContact CB-CG2 3.85Å; K371-V378 PolarHBondContact O-N 3.32Å; K371-V378 VanDerWaalsContact O-N 3.08Å; V373-V378 HydrophobicContact CB-CG2 4.26Å; V373-V378 HydrophobicContact CG2-CG2 3.59Å; R376-V378 PolarHBondContact O-N 3.09Å; V378-D382 HydrophobicContact CG1-CB 4.18Å; V378-V383 HydrophobicContact CG1-CG2 3.5Å
379	K	82.8	Confident	79.5	Confident	148 Å²	148	125.2 Å²	125.2	64%	0.643	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-86.7	159.5	170.2	-71.5	-178.8	176.4	177.7	0	109.6	F377 S381 D382	F377-K379 PolarHBondContact O-N 3.3Å; K379-S381 PolarHBondContact O-N 3.39Å; K379-S381 VanDerWaalsContact O-N 3.13Å; K379-D382 PolarHBondContact N-OD2 2.81Å; K379-D382 PolarHBondContact O-N 3.42Å
380	A	79.6	Confident	78.9	Confident	97 Å²	97	125.8 Å²	125.8	80%	0.802	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-57.1	-28.3	179.5	0	0	0	0	0	113.5	D382	A380-D382 VanDerWaalsContact C-N 3.27Å; A380-D382 PolarHBondContact O-N 2.93Å
381	S	77.5	Confident	78.3	Confident	89 Å²	89	125.5 Å²	125.5	62%	0.622	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-65.3	-26.5	173.5	51.2	0	0	0	0	113.9	K379	K379-S381 PolarHBondContact O-N 3.39Å; K379-S381 VanDerWaalsContact O-N 3.13Å
382	D	69.8	Low	77.5	Confident	92 Å²	92	122 Å²	122	49%	0.492	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-98.1	4.8	-168.4	-46.9	-22.4	0	0	0	111.9	V378 K379 A380 Q384	V378-D382 HydrophobicContact CG1-CB 4.18Å; K379-D382 PolarHBondContact N-OD2 2.81Å; K379-D382 PolarHBondContact O-N 3.42Å; A380-D382 VanDerWaalsContact C-N 3.27Å; A380-D382 PolarHBondContact O-N 2.93Å; D382-Q384 VanDerWaalsContact C-N 3.29Å
383	V	65.2	Low	76.6	Confident	101 Å²	101	123.2 Å²	123.2	61%	0.612	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	5.9	-177.4	-174.4	0	0	0	0	111.8	V378	V378-V383 HydrophobicContact CG1-CG2 3.5Å
384	Q	62.6	Low	76	Confident	190 Å²	190	125.9 Å²	125.9	89%	0.888	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	21.1	-175	-80.3	-176.2	-22.6	0	0	115.5	D382	D382-Q384 VanDerWaalsContact C-N 3.29Å
385	A	46.2	Very low	75.3	Confident	160 Å²	160	115 Å²	115	100%	1.322	68%	0.677	S	S	*	*			trans	-122.1	0	164.9	0	0	0	0	0	109

Retrieved 385 of 385 residues in 78.3 ms (Link to these results)

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