A0A077Z0F9_TRITR Loading...

FHA and dsrm domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0F9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 620 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	44.1	Very low	56	Low	254 Å²	254	157.5 Å²	157.5	100%	1.251	87%	0.874	S	S	*	*				0	88.7	0	-74.2	-174.5	172.3	0	0	107.1
2	A	45.3	Very low	55.7	Low	105 Å²	105	155.3 Å²	155.3	87%	0.868	87%	0.872	S	S	*	*			trans	-144.7	120	176.9	0	0	0	0	0	106.1
3	S	51.3	Low	56.1	Low	117 Å²	117	153.9 Å²	153.9	82%	0.818	87%	0.869	S	S	*	*			trans	-105.1	113.8	-179.5	50.1	0	0	0	0	108.8
4	E	52.8	Low	55.7	Low	199 Å²	199	154.6 Å²	154.6	93%	0.93	87%	0.868	S	S	*	*			trans	-88.6	132.4	169.2	-116.1	167	166	0	0	108.9
5	V	58.5	Low	55.9	Low	136 Å²	136	152.7 Å²	152.7	82%	0.824	87%	0.865	S	S	*	*			trans	-113.9	115.1	175.8	-179.7	0	0	0	0	107.5
6	E	59.8	Low	54.9	Low	193 Å²	193	151.9 Å²	151.9	90%	0.902	86%	0.864	S	S	*	*			trans	-104.9	126.2	179.7	-162.1	178.2	-167	0	0	109.4
7	F	53.7	Low	54.6	Low	203 Å²	203	152.4 Å²	152.4	89%	0.89	86%	0.864	S	S	*	*			trans	-100	124.6	-175.6	-152.5	-92.5	0	0	0	110.4
8	K	64.8	Low	54	Low	202 Å²	202	154.3 Å²	154.3	88%	0.878	87%	0.865	S	S	*	*			trans	-118.7	124.7	-177	-162.8	170.8	-173.8	173.4	0	110.4
9	A	61.2	Low	53.4	Low	87 Å²	87	149.7 Å²	149.7	72%	0.719	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-79.3	148.8	-178.9	0	0	0	0	0	113.1
10	P	62.6	Low	52.9	Low	121 Å²	121	151 Å²	151	79%	0.786	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-88.8	157.5	-176.3	34.5	-33.8	0	0	0	114.3
11	P	61.5	Low	52.3	Low	115 Å²	115	148 Å²	148	75%	0.747	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-88.8	162.4	-176.7	36	-34.9	0	0	0	114
12	P	53.1	Low	52.2	Low	131 Å²	131	140.9 Å²	140.9	85%	0.851	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-86.8	146.6	-174.2	34.7	-33	0	0	0	113.5
13	V	60.4	Low	52.1	Low	138 Å²	138	142.2 Å²	142.2	84%	0.836	83%	0.825	S	S	*	*			trans	-104.2	133.9	-179	179.3	0	0	0	0	110.1
14	L	51.4	Low	51.7	Low	164 Å²	164	142.2 Å²	142.2	86%	0.859	83%	0.825	S	S	*	*			trans	-101.8	143.2	168.1	-72.4	168.1	0	0	0	109.8
15	P	58.4	Low	51	Low	125 Å²	125	141.7 Å²	141.7	81%	0.812	82%	0.822	S	S	*	*			trans	-98.6	142	172.2	35	-27.3	0	0	0	112.6
16	T	39.9	Very low	50.3	Low	140 Å²	140	139.5 Å²	139.5	86%	0.859	82%	0.818	S	S	*	*			trans	-119.6	131.6	167.6	43	0	0	0	0	108.7
17	D	50.2	Low	49.7	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	81%	0.811	S	S	*	*			trans	-163.3	151.3	137.8	-138.3	-14.6	0	0	0	113.6
18	E	43.6	Very low	48.8	Very low	187 Å²	187	134.7 Å²	134.7	87%	0.874	81%	0.811	S	S	*	*			trans	-80.4	171.2	-173.2	-48.9	-170.2	147.7	0	0	112.2
19	G	41.8	Very low	47.1	Very low	67 Å²	67	131 Å²	131	69%	0.691	81%	0.809	S	S	*	*			cis	174.9	177.3	9.1	0	0	0	0	0	111.1
20	L	42.8	Very low	45.7	Very low	174 Å²	174	137 Å²	137	91%	0.911	82%	0.819	S	S	*	*			trans	75.2	103.1	161.8	-67	151.5	0	0	0	119
21	A	40.7	Very low	44.4	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	82%	0.822	S	S	*	*				79.7	136.3	87.9	0	0	0	0	0	113.4
22	S	42.1	Very low	43.3	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	82%	0.818	S	S	*	*			cis	-173.1	139.6	5.5	45.4	0	0	0	0	109.6
23	V	43.4	Very low	42.6	Very low	133 Å²	133	138.1 Å²	138.1	81%	0.806	82%	0.818	S	S	*	*			trans	58.5	117	138.5	-172.4	0	0	0	0	121
24	S	43.6	Very low	41.6	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	81%	0.814	S	S	*	*				-173.5	141.8	108.2	58.5	0	0	0	0	112.9
25	E	38.1	Very low	41.4	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	81%	0.81	S	S	*	*			trans	-66.6	146.4	-169.4	-62.3	155.2	136.7	0	0	115.3
26	A	44.3	Very low	41.1	Very low	90 Å²	90	136.1 Å²	136.1	74%	0.744	81%	0.812	S	S	*	*				155.8	139.6	108.3	0	0	0	0	0	112.2
27	S	46.3	Very low	42.1	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	79%	0.793	S	S	*	*			trans	89.3	84.9	155.3	-47.4	0	0	0	0	118.7
28	E	33.8	Very low	43.2	Very low	188 Å²	188	134.6 Å²	134.6	88%	0.879	79%	0.792	S	S	*	*				55.5	135.2	126.4	-73.5	170.2	156.4	0	0	122
29	C	29.8	Very low	45	Very low	124 Å²	124	127.9 Å²	127.9	84%	0.838	76%	0.764	S	S	*	*			trans	84.5	66.6	172.8	-58.6	0	0	0	0	117.5	I31	C29-I31 PolarHBondContact O-N 3.36Å
30	K	30.9	Very low	46.9	Very low	214 Å²	214	128.7 Å²	128.7	93%	0.93	76%	0.757	S	S	*	*			trans	-83.3	106.9	162.4	-84.6	-178.6	177.7	178.7	0	111.2	S32	K30-S32 PolarHBondContact O-N 3.4Å
31	I	36	Very low	49.1	Very low	166 Å²	166	121.6 Å²	121.6	85%	0.851	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-64.5	117	161.6	-62.1	155.3	0	0	0	107.1	C29	C29-I31 PolarHBondContact O-N 3.36Å
32	S	38.5	Very low	51.3	Low	94 Å²	94	122.8 Å²	122.8	66%	0.657	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-71.1	138.7	174.3	45.5	0	0	0	0	110.7	K30 S34	K30-S32 PolarHBondContact O-N 3.4Å; S32-S34 PolarHBondContact O-N 3.23Å
33	P	38.7	Very low	53.6	Low	130 Å²	130	120.9 Å²	120.9	84%	0.844	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71.7	120.2	175.4	30.5	-31	0	0	0	108.9	A35	P33-A35 PolarHBondContact O-N 3.21Å
34	S	40.2	Very low	55.7	Low	110 Å²	110	115.5 Å²	115.5	77%	0.769	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-62.3	124.9	177.1	-67.3	0	0	0	0	110.5	S32 E36	S32-S34 PolarHBondContact O-N 3.23Å; S34-E36 PolarHBondContact O-N 3.01Å
35	A	45.5	Very low	57.7	Low	94 Å²	94	115.1 Å²	115.1	78%	0.777	68%	0.675	S	S	*	*			trans	-66.5	101.1	169.7	0	0	0	0	0	109.3	P33 I37	P33-A35 PolarHBondContact O-N 3.21Å; A35-I37 PolarHBondContact O-N 3.09Å
36	E	53.7	Low	60.1	Low	180 Å²	180	109.3 Å²	109.3	84%	0.841	65%	0.645	S	S	*	*			trans	-67	110.1	172.2	-69.5	178.2	178.5	0	0	108.6	S34 E38	S34-E36 PolarHBondContact O-N 3.01Å; E36-E38 PolarHBondContact O-N 3.37Å
37	I	60.4	Low	62.1	Low	91 Å²	91	107.1 Å²	107.1	47%	0.467	62%	0.624	S	S	.	*			trans	-73.4	112.4	-179.1	-60.2	169.8	0	0	0	107.8	A35 N84	A35-I37 PolarHBondContact O-N 3.09Å; I37-N84 PolarHBondContact O-ND2 3.23Å
38	E	73.5	Confident	64	Low	178 Å²	178	102.5 Å²	102.5	83%	0.832	59%	0.594	S	S	*	*			trans	-57.3	142.2	177.2	-64	177.5	-178	0	0	112.1	E36	E36-E38 PolarHBondContact O-N 3.37Å
39	V	80.2	Confident	66.6	Low	47 Å²	47	97 Å²	97	29%	0.285	57%	0.573	S	S	.	*			trans	-72.3	124.5	179.9	179.5	0	0	0	0	109.4	Y41 I78 N84	V39-Y41 PolarHBondContact O-N 3.06Å; V39-I78 HydrophobicContact CB-CD1 4.48Å; V39-I78 HydrophobicContact CG1-CD1 3.62Å; V39-I78 HydrophobicContact CG1-CG1 4.36Å; V39-I78 HydrophobicContact CG1-CG2 4.49Å; V39-I78 HydrophobicContact CG2-CD1 4.31Å; V39-N84 WeakPolarHBondContact CG2-ND2 3.38Å
40	P	83.2	Confident	69.1	Low	84 Å²	84	91.1 Å²	91.1	55%	0.545	53%	0.533	S	S	.	.	S	Bend	trans	-80.4	51.2	179.4	34.8	-36.3	0	0	0	112.3	H97 I119	P40-H97 HydrophobicContact CG-CB 4.25Å; P40-I119 HydrophobicContact CG-CG2 4.14Å; P40-I119 WeakPolarHBondContact O-CG2 3.47Å
41	Y	87.8	Confident	71.2	Confident	25 Å²	25	85.8 Å²	85.8	10%	0.098	52%	0.519	C	S	.	.			trans	-140.5	127.4	177.4	177.8	-104.7	0	0	0	110.2	V39 V43 P44 A100 Q102 F117 Y137	V39-Y41 PolarHBondContact O-N 3.06Å; Y41-V43 HydrophobicContact CE1-CG2 4.12Å; Y41-P44 WeakPolarHBondContact OH-CD 3.46Å; Y41-A100 HydrophobicContact CD1-CB 4.07Å; Y41-A100 HydrophobicContact CD2-CB 3.88Å; Y41-A100 HydrophobicContact CE1-CB 3.94Å; Y41-A100 HydrophobicContact CE2-CB 3.75Å; Y41-A100 HydrophobicContact CG-CB 4.05Å; Y41-Q102 WeakPolarHBondContact OH-CB 3.36Å; Y41-Q102 PolarHBondContact OH-OE1 3Å; Y41-F117 HydrophobicContact CD2-CD1 4.01Å; Y41-F117 HydrophobicContact CD2-CE1 4.2Å; Y41-F117 AromaticContact CE2-CD1 3.87Å; Y41-F117 HydrophobicContact CE2-CD1 3.87Å; Y41-F117 HydrophobicContact CE2-CE1 4.32Å; Y41-F117 HydrophobicContact CE2-CG 4.31Å; Y41-Y137 HydrophobicContact CE2-CE1 4.49Å; Y41-Y137 WeakPolarHBondContact CE2-OH 3.45Å; Y41-Y137 PolarHBondContact OH-OH 3.21Å
42	C	88.1	Confident	73.3	Confident	115 Å²	115	81 Å²	81	78%	0.777	50%	0.495	S	S	*	.			trans	-106.2	121.4	175.9	-67.4	0	0	0	0	109	P44	C42-P44 WeakPolarHBondContact O-CD 3.39Å
43	V	89.5	Confident	75.2	Confident	63 Å²	63	82.9 Å²	82.9	38%	0.382	49%	0.493	S	S	.	.			trans	-60.7	125.1	178.2	178.4	0	0	0	0	109.6	Y41 S47	Y41-V43 HydrophobicContact CE1-CG2 4.12Å; V43-S47 VanDerWaalsContact CG1-CB 3.44Å; V43-S47 VanDerWaalsContact CG1-OG 3.32Å; V43-S47 WeakPolarHBondContact CG1-OG 3.46Å
44	P	88.3	Confident	77.3	Confident	20 Å²	20	83 Å²	83	13%	0.13	48%	0.483	C	S	.	.			trans	-66.6	150.7	179.3	-23.9	35.3	0	0	0	113.1	Y41 C42 W46 S47 Q102 Y137	Y41-P44 WeakPolarHBondContact OH-CD 3.46Å; C42-P44 WeakPolarHBondContact O-CD 3.39Å; P44-W46 HydrophobicContact CB-CD2 3.73Å; P44-W46 HydrophobicContact CB-CE3 4.42Å; P44-W46 HydrophobicContact CB-CG 4.06Å; P44-W46 HydrophobicContact CB-CH2 4.32Å; P44-W46 HydrophobicContact CB-CZ2 3.62Å; P44-W46 VanDerWaalsContact CB-NE1 3.31Å; P44-W46 HydrophobicContact CG-CD2 4.45Å; P44-W46 HydrophobicContact CG-CH2 3.99Å; P44-W46 HydrophobicContact CG-CZ2 3.49Å; P44-W46 VanDerWaalsContact CG-CZ2 3.49Å; P44-W46 PolarHBondContact O-N 3.16Å; P44-W46 VanDerWaalsContact O-N 3.1Å; P44-S47 WeakPolarHBondContact O-CB 3.48Å; P44-S47 PolarHBondContact O-N 2.87Å; P44-S47 PolarHBondContact O-OG 3.42Å; P44-Q102 HydrophobicContact CG-CG 4.49Å; P44-Y137 HydrophobicContact CG-CE1 4.23Å; P44-Y137 HydrophobicContact CG-CE2 4.34Å; P44-Y137 WeakPolarHBondContact CG-OH 3.48Å
45	A	85.8	Confident	79.6	Confident	109 Å²	109	78.4 Å²	78.4	90%	0.901	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-21	179.4	0	0	0	0	0	114.7	S47	A45-S47 VanDerWaalsContact C-N 3.29Å
46	W	87.8	Confident	81.8	Confident	66 Å²	66	74.3 Å²	74.3	25%	0.25	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	0.4	176.4	51.3	-104.7	0	0	0	113.6	P44 Q102 R104 Y137	P44-W46 HydrophobicContact CB-CD2 3.73Å; P44-W46 HydrophobicContact CB-CE3 4.42Å; P44-W46 HydrophobicContact CB-CG 4.06Å; P44-W46 HydrophobicContact CB-CH2 4.32Å; P44-W46 HydrophobicContact CB-CZ2 3.62Å; P44-W46 VanDerWaalsContact CB-NE1 3.31Å; P44-W46 HydrophobicContact CG-CD2 4.45Å; P44-W46 HydrophobicContact CG-CH2 3.99Å; P44-W46 HydrophobicContact CG-CZ2 3.49Å; P44-W46 VanDerWaalsContact CG-CZ2 3.49Å; P44-W46 PolarHBondContact O-N 3.16Å; P44-W46 VanDerWaalsContact O-N 3.1Å; W46-Q102 HydrophobicContact CE3-CG 4.42Å; W46-Q102 HydrophobicContact CH2-CB 4.16Å; W46-Q102 HydrophobicContact CH2-CG 3.63Å; W46-Q102 HydrophobicContact CZ3-CB 4.28Å; W46-Q102 HydrophobicContact CZ3-CG 3.47Å; W46-Q102 VanDerWaalsContact CZ3-CG 3.47Å; W46-R104 HydrophobicContact CE3-CB 3.69Å; W46-R104 HydrophobicContact CE3-CG 3.74Å; W46-R104 HydrophobicContact CZ3-CB 3.74Å; W46-R104 HydrophobicContact CZ3-CG 4.25Å; W46-Y137 AromaticContact CH2-CD1 3.74Å; W46-Y137 HydrophobicContact CH2-CD1 3.74Å; W46-Y137 AromaticContact CH2-CE1 3.74Å; W46-Y137 HydrophobicContact CH2-CE1 3.74Å; W46-Y137 HydrophobicContact CH2-CG 4.22Å; W46-Y137 AromaticContact CZ2-CD1 3.96Å; W46-Y137 HydrophobicContact CZ2-CD1 3.96Å; W46-Y137 HydrophobicContact CZ2-CD2 4.05Å; W46-Y137 AromaticContact CZ2-CE1 3.86Å; W46-Y137 HydrophobicContact CZ2-CE1 3.86Å; W46-Y137 AromaticContact CZ2-CE2 3.96Å; W46-Y137 HydrophobicContact CZ2-CE2 3.96Å; W46-Y137 HydrophobicContact CZ2-CG 4.07Å; W46-Y137 AromaticContact CZ2-CZ 3.89Å
47	S	86.9	Confident	83.8	Confident	43 Å²	43	65.8 Å²	65.8	30%	0.301	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-57	139.1	176	63.4	0	0	0	0	110.9	V43 P44 A45 Y103	V43-S47 VanDerWaalsContact CG1-CB 3.44Å; V43-S47 VanDerWaalsContact CG1-OG 3.32Å; V43-S47 WeakPolarHBondContact CG1-OG 3.46Å; P44-S47 WeakPolarHBondContact O-CB 3.48Å; P44-S47 PolarHBondContact O-N 2.87Å; P44-S47 PolarHBondContact O-OG 3.42Å; A45-S47 VanDerWaalsContact C-N 3.29Å; S47-Y103 WeakPolarHBondContact CA-O 3.28Å
48	G	86	Confident	85.4	Confident	12 Å²	12	62.5 Å²	62.5	12%	0.124	36%	0.358	C	S	.	.			trans	-128.1	-175.8	166.9	0	0	0	0	0	111.5	S75 Y103	G48-S75 VanDerWaalsContact O-CA 3.27Å; G48-S75 WeakPolarHBondContact O-CA 3.22Å; G48-S75 WeakPolarHBondContact O-CB 3.4Å; G48-Y103 PolarHBondContact N-O 3.35Å
49	V	87.4	Confident	86.5	Confident	72 Å²	72	54 Å²	54	44%	0.436	32%	0.318	S	S	.	.			trans	-103.8	133	173.5	179.3	0	0	0	0	108.2	T51 N73 Y103	V49-T51 PolarHBondContact O-N 2.88Å; V49-N73 HydrophobicContact CG1-CB 4.33Å; V49-Y103 WeakPolarHBondContact O-CE1 3.36Å
50	S	82	Confident	87.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.315	C	S	.	.			trans	-71.2	114.7	172.4	-178	0	0	0	0	109.6	Y55 N73 A74	S50-Y55 WeakPolarHBondContact OG-CD2 3.48Å; S50-N73 PolarHBondContact O-N 3.34Å; S50-N73 VanDerWaalsContact O-N 3.09Å; S50-A74 PolarHBondContact N-O 3.02Å
51	T	76.8	Confident	87.6	Confident	102 Å²	102	53.1 Å²	53.1	63%	0.626	30%	0.304	S	S	*	.			trans	-86.4	-15.9	177.3	50.1	0	0	0	0	113.4	V49	V49-T51 PolarHBondContact O-N 2.88Å
52	D	78.5	Confident	87.7	Confident	65 Å²	65	58.7 Å²	58.7	35%	0.348	34%	0.335	S	S	.	.			trans	-86.2	128.1	-174.2	-57.1	-23.9	0	0	0	111	H54 Y55	D52-H54 PolarHBondContact O-N 3.03Å; D52-Y55 HydrophobicContact CB-CD2 3.75Å; D52-Y55 HydrophobicContact CB-CE2 3.86Å
53	E	78.1	Confident	87.7	Confident	134 Å²	134	56.1 Å²	56.1	63%	0.626	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-18.7	-178.2	-61.5	-173.9	163.6	0	0	113.4	Y55 M72	E53-Y55 VanDerWaalsContact C-N 3.33Å; E53-Y55 PolarHBondContact O-N 3.35Å; E53-M72 HydrophobicContact CG-CE 3.8Å; E53-M72 HydrophobicContact CG-CG 4.5Å; E53-M72 HydrophobicContact CG-SD 4.06Å; E53-M72 WeakPolarHBondContact OE1-CE 3.39Å
54	H	83.4	Confident	87.8	Confident	134 Å²	134	57.2 Å²	57.2	62%	0.62	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-16.3	-175.4	-61	91.3	0	0	0	113.2	D52 G56 Q158 G159	D52-H54 PolarHBondContact O-N 3.03Å; H54-G56 PolarHBondContact O-N 3.2Å; H54-Q158 CarbonylContact O-C 3.6Å; H54-G159 WeakPolarHBondContact O-CA 3.49Å; H54-G159 PolarHBondContact O-N 2.83Å
55	Y	89.3	Confident	88	Confident	13 Å²	13	60.5 Å²	60.5	5%	0.051	35%	0.353	C	S	.	.			trans	-73.7	127.6	178.7	-74	-69.9	0	0	0	111.4	S50 D52 E53 L71 W114 V142 Q158 P160 D163	S50-Y55 WeakPolarHBondContact OG-CD2 3.48Å; D52-Y55 HydrophobicContact CB-CD2 3.75Å; D52-Y55 HydrophobicContact CB-CE2 3.86Å; E53-Y55 VanDerWaalsContact C-N 3.33Å; E53-Y55 PolarHBondContact O-N 3.35Å; Y55-L71 WeakPolarHBondContact O-CB 3.49Å; Y55-L71 PolarHBondContact O-N 3.15Å; Y55-W114 AromaticContact CD1-CD1 3.69Å; Y55-W114 AromaticContact CD1-NE1 3.83Å; Y55-W114 AromaticContact CG-NE1 3.65Å; Y55-V142 HydrophobicContact CE1-CG2 4.32Å; Y55-Q158 VanDerWaalsContact CA-O 3.32Å; Y55-Q158 WeakPolarHBondContact CA-O 3.3Å; Y55-Q158 WeakPolarHBondContact CD1-O 3.38Å; Y55-P160 HydrophobicContact CE2-CG 4.26Å; Y55-D163 WeakPolarHBondContact OH-CB 3.48Å
56	G	92	Very high	88.3	Confident	7 Å²	7	59.5 Å²	59.5	7%	0.072	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	164.6	-178.1	0	0	0	0	0	112.4	H54 L69 Q158	H54-G56 PolarHBondContact O-N 3.2Å; G56-L69 CarbonylContact C-O 3.6Å; G56-L69 WeakPolarHBondContact CA-O 3.46Å; G56-Q158 PolarHBondContact N-O 3.48Å; G56-Q158 VanDerWaalsContact N-O 3.07Å; G56-Q158 PolarHBondContact O-N 2.94Å
57	F	94.5	Very high	88.4	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.9	164.9	-71.2	-70.3	0	0	0	111	K68 L69 L71 F79 L140 I146 Y155 I156 M157	F57-K68 CarbonylContact O-C 3.48Å; F57-K68 WeakPolarHBondContact O-CA 3.29Å; F57-L69 HydrophobicContact CB-CB 4.21Å; F57-L69 HydrophobicContact CB-CD1 4.36Å; F57-L69 PolarHBondContact N-O 3.05Å; F57-L69 PolarHBondContact O-N 3.37Å; F57-L71 HydrophobicContact CD2-CD1 3.91Å; F57-L71 HydrophobicContact CD2-CD2 3.81Å; F57-L71 HydrophobicContact CD2-CG 4.19Å; F57-L71 HydrophobicContact CE2-CD1 3.7Å; F57-L71 HydrophobicContact CE2-CD2 3.88Å; F57-L71 HydrophobicContact CE2-CG 4.33Å; F57-L71 HydrophobicContact CZ-CD1 4.32Å; F57-F79 HydrophobicContact CD2-CZ 4.22Å; F57-F79 AromaticContact CE2-CZ 3.84Å; F57-F79 HydrophobicContact CE2-CZ 3.84Å; F57-F79 HydrophobicContact CZ-CZ 4.41Å; F57-L140 HydrophobicContact CZ-CD1 4.43Å; F57-I146 HydrophobicContact CD1-CD1 4.49Å; F57-I146 HydrophobicContact CE1-CD1 3.51Å; F57-I146 HydrophobicContact CZ-CD1 4Å; F57-Y155 HydrophobicContact CB-CD1 4.43Å; F57-I156 CarbonylContact C-O 3.54Å; F57-I156 VanDerWaalsContact CA-O 3.31Å; F57-I156 WeakPolarHBondContact CA-O 3.29Å; F57-M157 HydrophobicContact CD1-CB 4.41Å; F57-M157 HydrophobicContact CD1-CE 4.26Å; F57-M157 HydrophobicContact CD1-SD 4.18Å; F57-M157 HydrophobicContact CE1-CB 4.11Å; F57-M157 HydrophobicContact CE1-CE 3.27Å; F57-M157 HydrophobicContact CE1-SD 3.74Å; F57-M157 HydrophobicContact CE2-CE 4.02Å; F57-M157 HydrophobicContact CZ-CE 3.13Å; F57-M157 HydrophobicContact CZ-SD 3.97Å
58	E	95.5	Very high	88.7	Confident	22 Å²	22	63.2 Å²	63.2	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.7	163.8	-87.7	-176.5	-179.1	0	0	110.6	I65 K68 Y155 I156 Q158	E58-I65 HydrophobicContact CB-CG2 4.32Å; E58-I65 HydrophobicContact CG-CG2 4.09Å; E58-I65 WeakPolarHBondContact OE2-CD1 3.45Å; E58-K68 HydrophobicContact CG-CD 4.01Å; E58-K68 HydrophobicContact CG-CG 4Å; E58-K68 WeakPolarHBondContact OE1-CE 3.37Å; E58-K68 IonicContact OE1-NZ 3.73Å; E58-K68 PolarHBondContact OE1-NZ 3.12Å; E58-Y155 CarbonylContact O-C 3.55Å; E58-Y155 WeakPolarHBondContact O-CA 3.37Å; E58-I156 HydrophobicContact CB-CB 4.37Å; E58-I156 PolarHBondContact N-O 3.39Å; E58-I156 PolarHBondContact O-N 2.99Å; E58-Q158 VanDerWaalsContact CG-CD 3.47Å; E58-Q158 HydrophobicContact CG-CG 4.23Å; E58-Q158 PolarHBondContact OE1-NE2 3.47Å; E58-Q158 PolarHBondContact OE1-OE1 2.97Å; E58-Q158 PolarHBondContact OE2-NE2 3.27Å
59	V	95.3	Very high	88.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	106.8	179.9	-172.2	0	0	0	0	108.8	I65 I66 S67 L69 R153 L154 Y155	V59-I65 CarbonylContact O-C 3.54Å; V59-I66 PolarHBondContact O-N 2.97Å; V59-S67 WeakPolarHBondContact CB-O 3.47Å; V59-S67 WeakPolarHBondContact CB-OG 3.41Å; V59-S67 VanDerWaalsContact CG2-OG 3.24Å; V59-S67 WeakPolarHBondContact CG2-OG 3.44Å; V59-S67 PolarHBondContact N-O 3.13Å; V59-L69 HydrophobicContact CG2-CD1 4.04Å; V59-L69 HydrophobicContact CG2-CG 4.4Å; V59-R153 HydrophobicContact CG1-CB 4.19Å; V59-R153 HydrophobicContact CG1-CG 4.46Å; V59-L154 CarbonylContact C-O 3.55Å; V59-L154 WeakPolarHBondContact CA-O 3.37Å; V59-Y155 HydrophobicContact CB-CE1 4.33Å; V59-Y155 HydrophobicContact CG1-CE1 4Å; V59-Y155 HydrophobicContact CG2-CD1 3.7Å; V59-Y155 HydrophobicContact CG2-CE1 3.46Å; V59-Y155 VanDerWaalsContact CG2-CE1 3.46Å
60	L	94.5	Very high	89	Confident	40 Å²	40	65.8 Å²	65.8	21%	0.209	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.6	178.1	-166.1	105.9	0	0	0	110.7	C64 I65 R153 L154 I156	L60-C64 CarbonylContact C-O 3.6Å; L60-C64 WeakPolarHBondContact CA-O 3.33Å; L60-I65 HydrophobicContact CD1-CG1 4Å; L60-R153 CarbonylContact O-C 3.58Å; L60-R153 VanDerWaalsContact O-CA 3.3Å; L60-R153 WeakPolarHBondContact O-CA 3.46Å; L60-L154 HydrophobicContact CB-CB 4.33Å; L60-L154 HydrophobicContact CD2-CD1 4.18Å; L60-L154 PolarHBondContact N-O 3.02Å; L60-L154 PolarHBondContact O-N 3.41Å; L60-I156 HydrophobicContact CB-CD1 4.46Å
61	K	93	Very high	89.2	Confident	72 Å²	72	65.8 Å²	65.8	31%	0.313	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130	171	-171.2	-170.4	-178.1	-173.6	0	109	G63 C64 I66 R153	K61-G63 PolarHBondContact O-N 3.49Å; K61-G63 VanDerWaalsContact O-N 3.14Å; K61-C64 PolarHBondContact N-O 3.48Å; K61-C64 PolarHBondContact O-N 2.81Å; K61-I66 HydrophobicContact CB-CD1 3.32Å; K61-I66 HydrophobicContact CB-CG1 3.98Å; K61-I66 HydrophobicContact CD-CD1 3.43Å; K61-I66 VanDerWaalsContact CD-CD1 3.43Å; K61-I66 HydrophobicContact CG-CD1 3.99Å; K61-R153 HydrophobicContact CB-CG 4.37Å; K61-R153 HydrophobicContact CD-CG 4.33Å; K61-R153 HydrophobicContact CG-CG 4.29Å
62	N	90.1	Very high	89.5	Confident	141 Å²	141	64.7 Å²	64.7	75%	0.754	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	32.2	179.4	-55.8	-11.1	0	0	0	113.7
63	G	87.3	Confident	89.7	Confident	62 Å²	62	66.8 Å²	66.8	64%	0.639	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-4.8	-178.9	0	0	0	0	0	115.7	K61	K61-G63 PolarHBondContact O-N 3.49Å; K61-G63 VanDerWaalsContact O-N 3.14Å
64	C	91.1	Very high	90.1	Very high	85 Å²	85	61.3 Å²	61.3	57%	0.574	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.3	177.1	-60.1	0	0	0	0	111.5	L60 K61 I66	L60-C64 CarbonylContact C-O 3.6Å; L60-C64 WeakPolarHBondContact CA-O 3.33Å; K61-C64 PolarHBondContact N-O 3.48Å; K61-C64 PolarHBondContact O-N 2.81Å; C64-I66 PolarHBondContact O-N 3.31Å
65	I	92.6	Very high	90.4	Very high	89 Å²	89	56.7 Å²	56.7	46%	0.456	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	115.4	171	-58	162.8	0	0	0	108	E58 V59 L60	E58-I65 HydrophobicContact CB-CG2 4.32Å; E58-I65 HydrophobicContact CG-CG2 4.09Å; E58-I65 WeakPolarHBondContact OE2-CD1 3.45Å; V59-I65 CarbonylContact O-C 3.54Å; L60-I65 HydrophobicContact CD1-CG1 4Å
66	I	91.6	Very high	90.5	Very high	88 Å²	88	58.7 Å²	58.7	45%	0.451	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-44.1	-177.9	-67	-169.8	0	0	0	111.7	V59 K61 C64	V59-I66 PolarHBondContact O-N 2.97Å; K61-I66 HydrophobicContact CB-CD1 3.32Å; K61-I66 HydrophobicContact CB-CG1 3.98Å; K61-I66 HydrophobicContact CD-CD1 3.43Å; K61-I66 VanDerWaalsContact CD-CD1 3.43Å; K61-I66 HydrophobicContact CG-CD1 3.99Å; C64-I66 PolarHBondContact O-N 3.31Å
67	S	90.6	Very high	90.6	Very high	43 Å²	43	59.4 Å²	59.4	30%	0.301	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	152.1	-173	59.1	0	0	0	0	111.1	V59	V59-S67 WeakPolarHBondContact CB-O 3.47Å; V59-S67 WeakPolarHBondContact CB-OG 3.41Å; V59-S67 VanDerWaalsContact CG2-OG 3.24Å; V59-S67 WeakPolarHBondContact CG2-OG 3.44Å; V59-S67 PolarHBondContact N-O 3.13Å
68	K	92.5	Very high	90.6	Very high	144 Å²	144	59.8 Å²	59.8	63%	0.626	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.6	171	-50.7	-158.7	-174.6	-159.8	0	109.1	F57 E58	F57-K68 CarbonylContact O-C 3.48Å; F57-K68 WeakPolarHBondContact O-CA 3.29Å; E58-K68 HydrophobicContact CG-CD 4.01Å; E58-K68 HydrophobicContact CG-CG 4Å; E58-K68 WeakPolarHBondContact OE1-CE 3.37Å; E58-K68 IonicContact OE1-NZ 3.73Å; E58-K68 PolarHBondContact OE1-NZ 3.12Å
69	L	91.4	Very high	90.6	Very high	52 Å²	52	58.8 Å²	58.8	27%	0.272	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.7	176.3	-63.2	165.1	0	0	0	107.5	G56 F57 V59 V87 Y155	G56-L69 CarbonylContact C-O 3.6Å; G56-L69 WeakPolarHBondContact CA-O 3.46Å; F57-L69 HydrophobicContact CB-CB 4.21Å; F57-L69 HydrophobicContact CB-CD1 4.36Å; F57-L69 PolarHBondContact N-O 3.05Å; F57-L69 PolarHBondContact O-N 3.37Å; V59-L69 HydrophobicContact CG2-CD1 4.04Å; V59-L69 HydrophobicContact CG2-CG 4.4Å; L69-V87 HydrophobicContact CD1-CG1 4.04Å; L69-V87 HydrophobicContact CD1-CG2 4.18Å; L69-Y155 HydrophobicContact CD1-CD1 4.39Å; L69-Y155 HydrophobicContact CD1-CE1 4.14Å
70	S	89	Confident	90.6	Very high	86 Å²	86	58.8 Å²	58.8	60%	0.601	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	136.7	175.2	-179.2	0	0	0	0	110.2	M72	S70-M72 PolarHBondContact OG-N 3.15Å
71	L	86.1	Confident	90.6	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.345	C	S	.	.			trans	-98.9	11.9	178.4	-59.3	-178.7	0	0	0	112.8	Y55 F57 N73 A74 L77 W114 M157	Y55-L71 WeakPolarHBondContact O-CB 3.49Å; Y55-L71 PolarHBondContact O-N 3.15Å; F57-L71 HydrophobicContact CD2-CD1 3.91Å; F57-L71 HydrophobicContact CD2-CD2 3.81Å; F57-L71 HydrophobicContact CD2-CG 4.19Å; F57-L71 HydrophobicContact CE2-CD1 3.7Å; F57-L71 HydrophobicContact CE2-CD2 3.88Å; F57-L71 HydrophobicContact CE2-CG 4.33Å; F57-L71 HydrophobicContact CZ-CD1 4.32Å; L71-N73 PolarHBondContact O-N 2.84Å; L71-A74 PolarHBondContact O-N 3.16Å; L71-L77 HydrophobicContact CD2-CD1 3.09Å; L71-L77 HydrophobicContact CD2-CG 4.19Å; L71-W114 HydrophobicContact CB-CH2 4.27Å; L71-W114 HydrophobicContact CB-CZ2 3.61Å; L71-W114 HydrophobicContact CD1-CD2 4.07Å; L71-W114 HydrophobicContact CD1-CH2 4.4Å; L71-W114 HydrophobicContact CD1-CZ2 3.86Å; L71-W114 HydrophobicContact CD2-CH2 4.37Å; L71-W114 HydrophobicContact CD2-CZ2 4.41Å; L71-W114 HydrophobicContact CG-CZ2 4.16Å; L71-M157 HydrophobicContact CD1-CE 4.14Å; L71-M157 HydrophobicContact CD1-SD 3.79Å
72	M	82.4	Confident	90.6	Very high	80 Å²	80	59.8 Å²	59.8	39%	0.394	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	129.4	-179.6	-170.9	-172.7	-176.2	0	0	110.8	E53 S70 A74	E53-M72 HydrophobicContact CG-CE 3.8Å; E53-M72 HydrophobicContact CG-CG 4.5Å; E53-M72 HydrophobicContact CG-SD 4.06Å; E53-M72 WeakPolarHBondContact OE1-CE 3.39Å; S70-M72 PolarHBondContact OG-N 3.15Å; M72-A74 PolarHBondContact O-N 2.91Å; M72-A74 VanDerWaalsContact O-N 3.07Å
73	N	83.3	Confident	90.6	Very high	109 Å²	109	60.3 Å²	60.3	58%	0.583	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	9.1	179.5	-57.3	-39.4	0	0	0	115.8	V49 S50 L71	V49-N73 HydrophobicContact CG1-CB 4.33Å; S50-N73 PolarHBondContact O-N 3.34Å; S50-N73 VanDerWaalsContact O-N 3.09Å; L71-N73 PolarHBondContact O-N 2.84Å
74	A	86.8	Confident	90.6	Very high	19 Å²	19	60.6 Å²	60.6	16%	0.157	33%	0.326	C	S	.	.			trans	-83.4	133.6	172.6	0	0	0	0	0	110	S50 L71 M72 L77 W114	S50-A74 PolarHBondContact N-O 3.02Å; L71-A74 PolarHBondContact O-N 3.16Å; M72-A74 PolarHBondContact O-N 2.91Å; M72-A74 VanDerWaalsContact O-N 3.07Å; A74-L77 HydrophobicContact CB-CD2 4.41Å; A74-L77 HydrophobicContact CB-CG 4.49Å; A74-W114 HydrophobicContact CB-CH2 4.17Å
75	S	89.7	Confident	90.6	Very high	37 Å²	37	57.2 Å²	57.2	26%	0.259	30%	0.303	S	S	.	.	S	Bend	trans	-87.5	-41.2	169.6	60.7	0	0	0	0	111.3	G48 Q102 Y103	G48-S75 VanDerWaalsContact O-CA 3.27Å; G48-S75 WeakPolarHBondContact O-CA 3.22Å; G48-S75 WeakPolarHBondContact O-CB 3.4Å; S75-Q102 PolarHBondContact O-NE2 2.92Å; S75-Y103 PolarHBondContact O-N 2.87Å
76	H	91.9	Very high	90.6	Very high	54 Å²	54	57.5 Å²	57.5	25%	0.25	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.3	178	65.3	-69	0	0	0	110.1	C101	H76-C101 CarbonylContact C-O 3.4Å; H76-C101 WeakPolarHBondContact CA-O 3.44Å; H76-C101 WeakPolarHBondContact CB-O 3.28Å
77	L	93.6	Very high	90.7	Very high	23 Å²	23	54 Å²	54	12%	0.12	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.8	170.4	-70.9	-178.4	0	0	0	109.2	L71 A74 F79 D86 V87 A100 C101	L71-L77 HydrophobicContact CD2-CD1 3.09Å; L71-L77 HydrophobicContact CD2-CG 4.19Å; A74-L77 HydrophobicContact CB-CD2 4.41Å; A74-L77 HydrophobicContact CB-CG 4.49Å; L77-F79 HydrophobicContact CB-CE2 4.07Å; L77-F79 HydrophobicContact CB-CZ 4.43Å; L77-F79 HydrophobicContact CD1-CZ 4.48Å; L77-D86 WeakPolarHBondContact CA-OD2 3.32Å; L77-D86 HydrophobicContact CD2-CB 3.67Å; L77-V87 HydrophobicContact CD1-CG2 4.42Å; L77-A100 CarbonylContact O-C 3.41Å; L77-A100 VanDerWaalsContact O-CA 3.3Å; L77-A100 WeakPolarHBondContact O-CA 3.34Å; L77-C101 PolarHBondContact N-O 3.02Å; L77-C101 PolarHBondContact O-N 2.97Å
78	I	94.9	Very high	90.9	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.046	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.7	173.3	-57.6	146.3	0	0	0	108	V39 V85 D86 V87 A100 I119	V39-I78 HydrophobicContact CB-CD1 4.48Å; V39-I78 HydrophobicContact CG1-CD1 3.62Å; V39-I78 HydrophobicContact CG1-CG1 4.36Å; V39-I78 HydrophobicContact CG1-CG2 4.49Å; V39-I78 HydrophobicContact CG2-CD1 4.31Å; I78-V85 HydrophobicContact CB-CG1 3.93Å; I78-V85 HydrophobicContact CG2-CB 4.48Å; I78-V85 HydrophobicContact CG2-CG1 3.75Å; I78-V85 HydrophobicContact CG2-CG2 4.14Å; I78-V85 WeakPolarHBondContact O-CG1 3.5Å; I78-D86 PolarHBondContact N-OD2 3Å; I78-D86 PolarHBondContact O-N 3.03Å; I78-V87 PolarHBondContact O-N 2.7Å; I78-A100 HydrophobicContact CG1-CB 4.45Å; I78-I119 HydrophobicContact CG2-CD1 4.39Å
79	F	95.7	Very high	90.9	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.1	176.8	-66	-91.6	0	0	0	109.2	F57 L77 V87 L89 H98 A99 C101 F148 Y155	F57-F79 HydrophobicContact CD2-CZ 4.22Å; F57-F79 AromaticContact CE2-CZ 3.84Å; F57-F79 HydrophobicContact CE2-CZ 3.84Å; F57-F79 HydrophobicContact CZ-CZ 4.41Å; L77-F79 HydrophobicContact CB-CE2 4.07Å; L77-F79 HydrophobicContact CB-CZ 4.43Å; L77-F79 HydrophobicContact CD1-CZ 4.48Å; F79-V87 HydrophobicContact CD1-CB 3.59Å; F79-V87 HydrophobicContact CD1-CG1 3.72Å; F79-V87 HydrophobicContact CD1-CG2 4.06Å; F79-V87 HydrophobicContact CE1-CB 3.77Å; F79-V87 HydrophobicContact CE1-CG1 3.82Å; F79-V87 HydrophobicContact CE1-CG2 3.73Å; F79-V87 HydrophobicContact CG-CB 4.36Å; F79-V87 HydrophobicContact CZ-CG2 4.23Å; F79-L89 HydrophobicContact CB-CD1 4Å; F79-L89 HydrophobicContact CD1-CD1 4.33Å; F79-H98 WeakPolarHBondContact O-CA 3.4Å; F79-H98 WeakPolarHBondContact O-CB 3.4Å; F79-H98 PolarHBondContact O-N 2.91Å; F79-A99 PolarHBondContact N-O 3.45Å; F79-A99 PolarHBondContact O-N 2.92Å; F79-C101 HydrophobicContact CE2-CB 3.89Å; F79-C101 VanDerWaalsContact CE2-SG 3.58Å; F79-F148 HydrophobicContact CB-CE1 4.18Å; F79-F148 HydrophobicContact CB-CE2 4.19Å; F79-F148 HydrophobicContact CB-CZ 3.9Å; F79-F148 HydrophobicContact CD1-CD2 4.46Å; F79-F148 AromaticContact CD1-CE2 3.52Å; F79-F148 HydrophobicContact CD1-CE2 3.52Å; F79-F148 AromaticContact CD1-CZ 3.66Å; F79-F148 HydrophobicContact CD1-CZ 3.66Å; F79-F148 HydrophobicContact CD2-CE1 4.49Å; F79-F148 AromaticContact CD2-CZ 3.86Å; F79-F148 HydrophobicContact CD2-CZ 3.86Å; F79-F148 AromaticContact CE1-CE2 3.99Å; F79-F148 HydrophobicContact CE1-CE2 3.99Å; F79-F148 HydrophobicContact CE1-CZ 4.11Å; F79-F148 HydrophobicContact CE2-CZ 4.3Å; F79-F148 HydrophobicContact CG-CE1 4.22Å; F79-F148 AromaticContact CG-CE2 3.83Å; F79-F148 HydrophobicContact CG-CE2 3.83Å; F79-F148 AromaticContact CG-CZ 3.52Å; F79-F148 HydrophobicContact CG-CZ 3.52Å; F79-F148 HydrophobicContact CZ-CZ 4.41Å; F79-Y155 HydrophobicContact CE1-CD1 4.41Å; F79-Y155 HydrophobicContact CE1-CE1 4.46Å
80	G	95.2	Very high	90.8	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.9	178	-177	0	0	0	0	0	113.9	V87 H88 L89 S95 R96	G80-V87 PolarHBondContact N-O 3.04Å; G80-H88 CarbonylContact O-C 3.6Å; G80-H88 WeakPolarHBondContact O-CA 3.38Å; G80-L89 PolarHBondContact O-N 2.78Å; G80-S95 WeakPolarHBondContact CA-O 3.15Å; G80-R96 CarbonylContact C-O 3.48Å; G80-R96 VanDerWaalsContact CA-O 3.28Å; G80-R96 WeakPolarHBondContact CA-O 3.44Å
81	R	94.4	Very high	91	Very high	117 Å²	117	52.6 Å²	52.6	44%	0.442	27%	0.268	S	S	.	.	S	Bend	trans	-92	-6.7	-177.2	-169.6	165.9	62.6	115.2	2.1	114.1	H88 L89 I94 S95 R96	R81-H88 PolarHBondContact O-NE2 2.89Å; R81-L89 WeakPolarHBondContact CA-O 3.36Å; R81-L89 WeakPolarHBondContact CB-O 3.44Å; R81-L89 WeakPolarHBondContact CG-O 3.43Å; R81-I94 PolarHBondContact NE-O 3.4Å; R81-S95 PolarHBondContact N-O 3.1Å; R81-R96 PolarHBondContact N-O 2.97Å
82	A	92.1	Very high	91.4	Very high	16 Å²	16	57.2 Å²	57.2	13%	0.132	30%	0.298	C	S	.	.	S	Bend	trans	-81.3	154.6	178.2	0	0	0	0	0	111.8	N84 V85 R96	A82-N84 VanDerWaalsContact C-N 3.26Å; A82-N84 WeakPolarHBondContact CB-OD1 3.38Å; A82-N84 PolarHBondContact O-N 3.46Å; A82-V85 HydrophobicContact CB-CG2 3.97Å; A82-V85 WeakPolarHBondContact O-CB 3.39Å; A82-V85 WeakPolarHBondContact O-CG2 3.47Å; A82-R96 HydrophobicContact CB-CB 3.99Å; A82-R96 HydrophobicContact CB-CG 4.48Å; A82-R96 WeakPolarHBondContact CB-O 3.38Å; A82-R96 PolarHBondContact N-O 2.96Å
83	N	89.4	Confident	91.9	Very high	153 Å²	153	54.5 Å²	54.5	82%	0.818	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-17.4	-177.9	-62.9	-0.6	0	0	0	113	V85	N83-V85 PolarHBondContact O-N 3.43Å
84	N	88.6	Confident	92.5	Very high	68 Å²	68	49.4 Å²	49.4	36%	0.364	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	31.7	179.6	68.5	-36.8	0	0	0	112.5	I37 V39 A82 H97	I37-N84 PolarHBondContact O-ND2 3.23Å; V39-N84 WeakPolarHBondContact CG2-ND2 3.38Å; A82-N84 VanDerWaalsContact C-N 3.26Å; A82-N84 WeakPolarHBondContact CB-OD1 3.38Å; A82-N84 PolarHBondContact O-N 3.46Å; N84-H97 PolarHBondContact ND2-NE2 3.34Å; N84-H97 PolarHBondContact OD1-NE2 3.44Å
85	V	91.4	Very high	92.9	Very high	14 Å²	14	49.7 Å²	49.7	9%	0.085	26%	0.26	C	S	.	.	S	Bend	trans	-123.3	141.9	-174.2	176.4	0	0	0	0	108.1	I78 A82 N83 V87	I78-V85 HydrophobicContact CB-CG1 3.93Å; I78-V85 HydrophobicContact CG2-CB 4.48Å; I78-V85 HydrophobicContact CG2-CG1 3.75Å; I78-V85 HydrophobicContact CG2-CG2 4.14Å; I78-V85 WeakPolarHBondContact O-CG1 3.5Å; A82-V85 HydrophobicContact CB-CG2 3.97Å; A82-V85 WeakPolarHBondContact O-CB 3.39Å; A82-V85 WeakPolarHBondContact O-CG2 3.47Å; N83-V85 PolarHBondContact O-N 3.43Å; V85-V87 VanDerWaalsContact C-N 3.34Å; V85-V87 PolarHBondContact O-N 3.44Å
86	D	92.1	Very high	93.1	Very high	94 Å²	94	54.8 Å²	54.8	50%	0.503	27%	0.273	S	S	.	.	S	Bend	trans	-64.3	-40.2	-176.7	-50.7	-60.4	0	0	0	111.9	L77 I78	L77-D86 WeakPolarHBondContact CA-OD2 3.32Å; L77-D86 HydrophobicContact CD2-CB 3.67Å; I78-D86 PolarHBondContact N-OD2 3Å; I78-D86 PolarHBondContact O-N 3.03Å
87	V	93.1	Very high	93.2	Very high	14 Å²	14	53.1 Å²	53.1	9%	0.085	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	100.7	176.8	-173.8	0	0	0	0	110.2	L69 L77 I78 F79 G80 V85 L89	L69-V87 HydrophobicContact CD1-CG1 4.04Å; L69-V87 HydrophobicContact CD1-CG2 4.18Å; L77-V87 HydrophobicContact CD1-CG2 4.42Å; I78-V87 PolarHBondContact O-N 2.7Å; F79-V87 HydrophobicContact CD1-CB 3.59Å; F79-V87 HydrophobicContact CD1-CG1 3.72Å; F79-V87 HydrophobicContact CD1-CG2 4.06Å; F79-V87 HydrophobicContact CE1-CB 3.77Å; F79-V87 HydrophobicContact CE1-CG1 3.82Å; F79-V87 HydrophobicContact CE1-CG2 3.73Å; F79-V87 HydrophobicContact CG-CB 4.36Å; F79-V87 HydrophobicContact CZ-CG2 4.23Å; G80-V87 PolarHBondContact N-O 3.04Å; V85-V87 VanDerWaalsContact C-N 3.34Å; V85-V87 PolarHBondContact O-N 3.44Å; V87-L89 HydrophobicContact CG1-CD2 3.93Å
88	H	94.1	Very high	93.3	Very high	90 Å²	90	52 Å²	52	42%	0.417	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125	177.8	-178.6	-104.9	0	0	0	112.1	G80 R81	G80-H88 CarbonylContact O-C 3.6Å; G80-H88 WeakPolarHBondContact O-CA 3.38Å; R81-H88 PolarHBondContact O-NE2 2.89Å
89	L	93.2	Very high	93.3	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.037	26%	0.257	C	S	.	.			trans	-120.7	123.7	-177.4	-54.6	-177.3	0	0	0	111.2	F79 G80 R81 V87 I94 F148 Y155	F79-L89 HydrophobicContact CB-CD1 4Å; F79-L89 HydrophobicContact CD1-CD1 4.33Å; G80-L89 PolarHBondContact O-N 2.78Å; R81-L89 WeakPolarHBondContact CA-O 3.36Å; R81-L89 WeakPolarHBondContact CB-O 3.44Å; R81-L89 WeakPolarHBondContact CG-O 3.43Å; V87-L89 HydrophobicContact CG1-CD2 3.93Å; L89-I94 HydrophobicContact CB-CD1 3.55Å; L89-I94 HydrophobicContact CB-CG2 4.12Å; L89-I94 HydrophobicContact CD1-CD1 3.79Å; L89-I94 HydrophobicContact CD1-CG2 4.1Å; L89-I94 HydrophobicContact CG-CD1 4.28Å; L89-F148 HydrophobicContact CD1-CB 4.19Å; L89-F148 HydrophobicContact CD1-CD2 3.55Å; L89-F148 HydrophobicContact CD1-CE2 4.15Å; L89-F148 HydrophobicContact CD1-CG 3.98Å; L89-Y155 HydrophobicContact CD2-CE2 4.37Å; L89-Y155 WeakPolarHBondContact CD2-OH 3.45Å
90	E	90	Very high	93.3	Very high	143 Å²	143	51.5 Å²	51.5	67%	0.668	26%	0.257	S	S	*	.			trans	-88	-5.3	-169.5	-66.1	174.5	164.1	0	0	115.2
91	H	92.9	Very high	93.3	Very high	56 Å²	56	51.5 Å²	51.5	26%	0.259	26%	0.257	S	S	.	.			trans	-74.9	134.9	-171.8	-166.8	-91.4	0	0	0	111.7	T93 I94 N150	H91-T93 PolarHBondContact CE1-OG1 3.37Å; H91-T93 PolarHBondContact ND1-N 3.15Å; H91-T93 PolarHBondContact ND1-OG1 2.98Å; H91-T93 PolarHBondContact O-N 3.26Å; H91-I94 HydrophobicContact CB-CD1 3.62Å; H91-I94 HydrophobicContact CB-CG1 3.93Å; H91-I94 WeakPolarHBondContact O-CB 3.4Å; H91-I94 PolarHBondContact O-N 3.31Å; H91-N150 PolarHBondContact CE1-O 3.5Å; H91-N150 PolarHBondContact NE2-O 3.32Å
92	P	93.6	Very high	93.3	Very high	97 Å²	97	46 Å²	46	63%	0.63	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.6	-173.9	24.2	-35.6	0	0	0	114.2	I94	P92-I94 PolarHBondContact O-N 2.95Å
93	T	94.5	Very high	93.3	Very high	24 Å²	24	45.9 Å²	45.9	15%	0.147	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-0.7	176.2	68	0	0	0	0	113.3	H91 H123 N150	H91-T93 PolarHBondContact CE1-OG1 3.37Å; H91-T93 PolarHBondContact ND1-N 3.15Å; H91-T93 PolarHBondContact ND1-OG1 2.98Å; H91-T93 PolarHBondContact O-N 3.26Å; T93-H123 WeakPolarHBondContact CB-CD2 3.43Å; T93-H123 PolarHBondContact O-CD2 3.35Å; T93-N150 HydrophobicContact CG2-CB 4.13Å; T93-N150 PolarHBondContact OG1-N 3.49Å
94	I	95.7	Very high	93.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.198	C	C	.	.	S	Bend	trans	-93.7	122.9	176.3	-59.6	174.4	0	0	0	109	R81 L89 H91 P92 H98 F148	R81-I94 PolarHBondContact NE-O 3.4Å; L89-I94 HydrophobicContact CB-CD1 3.55Å; L89-I94 HydrophobicContact CB-CG2 4.12Å; L89-I94 HydrophobicContact CD1-CD1 3.79Å; L89-I94 HydrophobicContact CD1-CG2 4.1Å; L89-I94 HydrophobicContact CG-CD1 4.28Å; H91-I94 HydrophobicContact CB-CD1 3.62Å; H91-I94 HydrophobicContact CB-CG1 3.93Å; H91-I94 WeakPolarHBondContact O-CB 3.4Å; H91-I94 PolarHBondContact O-N 3.31Å; P92-I94 PolarHBondContact O-N 2.95Å; I94-H98 HydrophobicContact CG2-CB 3.76Å; I94-F148 HydrophobicContact CD1-CB 4.07Å; I94-F148 HydrophobicContact CG1-CB 4.22Å
95	S	94.3	Very high	93.2	Very high	25 Å²	25	38.8 Å²	38.8	18%	0.175	20%	0.199	C	C	.	.			trans	-56.5	156	171	-61.6	0	0	0	0	112.8	G80 R81 H97 H98 T122	G80-S95 WeakPolarHBondContact CA-O 3.15Å; R81-S95 PolarHBondContact N-O 3.1Å; S95-H97 VanDerWaalsContact C-N 3.28Å; S95-H97 WeakPolarHBondContact CB-O 3.44Å; S95-H97 PolarHBondContact O-N 3.23Å; S95-H98 PolarHBondContact N-ND1 3.41Å; S95-T122 PolarHBondContact OG-N 2.99Å
96	R	93.5	Very high	92.5	Very high	143 Å²	143	43.4 Å²	43.4	54%	0.54	22%	0.222	S	C	.	.	S	Bend	trans	-52.4	-46.8	176.1	-74.6	-177	-61.9	-178.8	2.6	112.2	G80 R81 A82	G80-R96 CarbonylContact C-O 3.48Å; G80-R96 VanDerWaalsContact CA-O 3.28Å; G80-R96 WeakPolarHBondContact CA-O 3.44Å; R81-R96 PolarHBondContact N-O 2.97Å; A82-R96 HydrophobicContact CB-CB 3.99Å; A82-R96 HydrophobicContact CB-CG 4.48Å; A82-R96 WeakPolarHBondContact CB-O 3.38Å; A82-R96 PolarHBondContact N-O 2.96Å
97	H	94.6	Very high	91.3	Very high	19 Å²	19	40.9 Å²	40.9	9%	0.088	22%	0.219	C	C	.	.	S	Bend	trans	-120.5	113	166.1	-53.2	89.7	0	0	0	105.7	P40 N84 S95 I119	P40-H97 HydrophobicContact CG-CB 4.25Å; N84-H97 PolarHBondContact ND2-NE2 3.34Å; N84-H97 PolarHBondContact OD1-NE2 3.44Å; S95-H97 VanDerWaalsContact C-N 3.28Å; S95-H97 WeakPolarHBondContact CB-O 3.44Å; S95-H97 PolarHBondContact O-N 3.23Å; H97-I119 HydrophobicContact CB-CD1 4.21Å
98	H	94.9	Very high	90.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.			trans	-102.8	-56.1	-170.8	-169.1	102.9	0	0	0	110.7	F79 I94 S95 I119 S121 G124 T125 F148 G149	F79-H98 WeakPolarHBondContact O-CA 3.4Å; F79-H98 WeakPolarHBondContact O-CB 3.4Å; F79-H98 PolarHBondContact O-N 2.91Å; I94-H98 HydrophobicContact CG2-CB 3.76Å; S95-H98 PolarHBondContact N-ND1 3.41Å; H98-I119 PolarHBondContact O-N 2.89Å; H98-S121 VanDerWaalsContact CE1-CB 3.44Å; H98-S121 WeakPolarHBondContact CE1-CB 3.3Å; H98-S121 PolarHBondContact CE1-OG 3.39Å; H98-S121 WeakPolarHBondContact ND1-CB 3.5Å; H98-S121 PolarHBondContact NE2-OG 2.92Å; H98-G124 PolarHBondContact NE2-O 3.4Å; H98-T125 PolarHBondContact CD2-OG1 2.97Å; H98-T125 VanDerWaalsContact CD2-OG1 3.26Å; H98-T125 PolarHBondContact NE2-OG1 3.35Å; H98-F148 AromaticContact CD2-CD1 3.45Å; H98-F148 VanDerWaalsContact CD2-CD1 3.45Å; H98-F148 WeakPolarHBondContact CD2-CD1 3.45Å; H98-F148 AromaticContact NE2-CD1 3.81Å; H98-G149 PolarHBondContact CE1-N 3.22Å
99	A	96.3	Very high	89.4	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	157.8	179.6	0	0	0	0	0	110.2	F79 I116 F117 F148	F79-A99 PolarHBondContact N-O 3.45Å; F79-A99 PolarHBondContact O-N 2.92Å; A99-I116 HydrophobicContact CB-CG1 4.34Å; A99-F117 CarbonylContact C-O 3.52Å; A99-F117 WeakPolarHBondContact CA-O 3.29Å; A99-F117 WeakPolarHBondContact CB-O 3.48Å; A99-F148 HydrophobicContact CB-CD1 4.33Å; A99-F148 HydrophobicContact CB-CE1 3.79Å
100	A	95.4	Very high	88.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.6	168.9	0	0	0	0	0	109.2	Y41 L77 I78 I116 F117 I119	Y41-A100 HydrophobicContact CD1-CB 4.07Å; Y41-A100 HydrophobicContact CD2-CB 3.88Å; Y41-A100 HydrophobicContact CE1-CB 3.94Å; Y41-A100 HydrophobicContact CE2-CB 3.75Å; Y41-A100 HydrophobicContact CG-CB 4.05Å; L77-A100 CarbonylContact O-C 3.41Å; L77-A100 VanDerWaalsContact O-CA 3.3Å; L77-A100 WeakPolarHBondContact O-CA 3.34Å; I78-A100 HydrophobicContact CG1-CB 4.45Å; A100-I116 CarbonylContact O-C 3.45Å; A100-F117 PolarHBondContact N-O 3Å; A100-F117 PolarHBondContact O-N 3.45Å; A100-I119 HydrophobicContact CB-CD1 4.2Å
101	C	94.8	Very high	88.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.6	162.6	-76.9	0	0	0	0	108.6	H76 L77 F79 W114 Y115	H76-C101 CarbonylContact C-O 3.4Å; H76-C101 WeakPolarHBondContact CA-O 3.44Å; H76-C101 WeakPolarHBondContact CB-O 3.28Å; L77-C101 PolarHBondContact N-O 3.02Å; L77-C101 PolarHBondContact O-N 2.97Å; F79-C101 HydrophobicContact CE2-CB 3.89Å; F79-C101 VanDerWaalsContact CE2-SG 3.58Å; C101-W114 HydrophobicContact CB-CE3 3.99Å; C101-W114 HydrophobicContact CB-CZ3 4.18Å; C101-Y115 CarbonylContact C-O 3.59Å; C101-Y115 VanDerWaalsContact CA-O 3.26Å; C101-Y115 WeakPolarHBondContact CA-O 3.45Å
102	Q	93.9	Very high	88.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.5	-176.6	-176.8	66.1	65.5	0	0	109.4	Y41 P44 W46 S75 Y115 Y137	Y41-Q102 WeakPolarHBondContact OH-CB 3.36Å; Y41-Q102 PolarHBondContact OH-OE1 3Å; P44-Q102 HydrophobicContact CG-CG 4.49Å; W46-Q102 HydrophobicContact CE3-CG 4.42Å; W46-Q102 HydrophobicContact CH2-CB 4.16Å; W46-Q102 HydrophobicContact CH2-CG 3.63Å; W46-Q102 HydrophobicContact CZ3-CB 4.28Å; W46-Q102 HydrophobicContact CZ3-CG 3.47Å; W46-Q102 VanDerWaalsContact CZ3-CG 3.47Å; S75-Q102 PolarHBondContact O-NE2 2.92Å; Q102-Y115 PolarHBondContact N-O 3.41Å; Q102-Y115 PolarHBondContact O-N 2.91Å; Q102-Y137 HydrophobicContact CB-CE1 4.25Å
103	Y	93.3	Very high	88.1	Confident	15 Å²	15	51.2 Å²	51.2	6%	0.059	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135	171.3	-172.1	-101.9	0	0	0	111	S47 G48 V49 S75 A105 W114	S47-Y103 WeakPolarHBondContact CA-O 3.28Å; G48-Y103 PolarHBondContact N-O 3.35Å; V49-Y103 WeakPolarHBondContact O-CE1 3.36Å; S75-Y103 PolarHBondContact O-N 2.87Å; Y103-A105 HydrophobicContact CD1-CB 4.47Å; Y103-A105 HydrophobicContact CE1-CB 4.09Å; Y103-W114 AromaticContact CD2-CD1 3.82Å; Y103-W114 HydrophobicContact CD2-CD2 4.01Å; Y103-W114 AromaticContact CD2-CE2 3.69Å; Y103-W114 HydrophobicContact CD2-CG 4.07Å; Y103-W114 HydrophobicContact CD2-CZ2 4.2Å; Y103-W114 AromaticContact CD2-NE1 3.56Å; Y103-W114 HydrophobicContact CG-CZ2 4.39Å
104	R	90	Very high	88	Confident	26 Å²	26	50 Å²	50	10%	0.098	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.7	175.1	179.9	175.1	176	150.8	-0.7	109.5	W46 L106 Y110 I112 G113 Y115	W46-R104 HydrophobicContact CE3-CB 3.69Å; W46-R104 HydrophobicContact CE3-CG 3.74Å; W46-R104 HydrophobicContact CZ3-CB 3.74Å; W46-R104 HydrophobicContact CZ3-CG 4.25Å; R104-L106 PolarHBondContact NE-O 2.6Å; R104-L106 PolarHBondContact NH2-O 3.45Å; R104-Y110 VanDerWaalsContact NH1-CB 3.33Å; R104-I112 VanDerWaalsContact O-CG2 3.31Å; R104-I112 WeakPolarHBondContact O-CG2 3.47Å; R104-G113 PolarHBondContact N-O 2.68Å; R104-G113 PolarHBondContact O-N 2.6Å; R104-G113 VanDerWaalsContact O-N 3.12Å; R104-Y115 HydrophobicContact CB-CD2 3.98Å; R104-Y115 HydrophobicContact CB-CE2 3.82Å; R104-Y115 HydrophobicContact CG-CE2 4.45Å
105	A	84.7	Confident	87.9	Confident	45 Å²	45	50.8 Å²	50.8	37%	0.372	26%	0.263	S	S	.	.			trans	-97	-8.1	177.7	0	0	0	0	0	114.8	Y103	Y103-A105 HydrophobicContact CD1-CB 4.47Å; Y103-A105 HydrophobicContact CE1-CB 4.09Å
106	L	77.9	Confident	88	Confident	111 Å²	111	49.6 Å²	49.6	58%	0.581	26%	0.255	S	S	*	.			trans	-106.3	115.5	-178	-62.9	170.9	0	0	0	111	R104	R104-L106 PolarHBondContact NE-O 2.6Å; R104-L106 PolarHBondContact NH2-O 3.45Å
107	G	66.7	Low	88.1	Confident	42 Å²	42	44 Å²	44	43%	0.433	24%	0.235	S	C	.	.			trans	-85.5	148.5	176	0	0	0	0	0	113.1
108	E	68.9	Low	88.2	Confident	178 Å²	178	43.2 Å²	43.2	83%	0.832	23%	0.231	S	C	*	.	S	Bend	trans	71.1	124.4	-172.6	-66.3	-165.7	176.5	0	0	116.1	Y110	E108-Y110 PolarHBondContact N-O 2.97Å; E108-Y110 VanDerWaalsContact N-O 3.09Å
109	P	77.9	Confident	88.2	Confident	116 Å²	116	43.9 Å²	43.9	75%	0.753	24%	0.235	S	C	*	.	S	Bend	cis	-82.6	0.9	6.2	31.7	-33.8	0	0	0	115
110	Y	79.9	Confident	88	Confident	146 Å²	146	45.5 Å²	45.5	57%	0.573	25%	0.251	S	S	*	.	S	Bend	trans	-121.5	160.2	178.1	-49.6	-97.4	0	0	0	111.6	R104 E108 Y115	R104-Y110 VanDerWaalsContact NH1-CB 3.33Å; E108-Y110 PolarHBondContact N-O 2.97Å; E108-Y110 VanDerWaalsContact N-O 3.09Å; Y110-Y115 WeakPolarHBondContact CB-OH 3.45Å
111	D	85.1	Confident	88	Confident	101 Å²	101	46.1 Å²	46.1	54%	0.54	26%	0.256	S	S	.	.			trans	-68.4	144.4	-176.3	-56.5	-32.7	0	0	0	112.4	Y115	D111-Y115 PolarHBondContact N-OH 2.7Å; D111-Y115 WeakPolarHBondContact O-CE2 3.31Å; D111-Y115 PolarHBondContact O-OH 3.38Å
112	I	87.9	Confident	88	Confident	82 Å²	82	51.7 Å²	51.7	42%	0.421	29%	0.29	S	S	.	.	S	Bend	trans	-65.8	140	169.1	-63.1	171.2	0	0	0	107.9	R104 R139	R104-I112 VanDerWaalsContact O-CG2 3.31Å; R104-I112 WeakPolarHBondContact O-CG2 3.47Å; I112-R139 PolarHBondContact O-NH2 2.94Å
113	G	89.1	Confident	88.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.7	-165.1	177.2	0	0	0	0	0	114.2	R104	R104-G113 PolarHBondContact N-O 2.68Å; R104-G113 PolarHBondContact O-N 2.6Å; R104-G113 VanDerWaalsContact O-N 3.12Å
114	W	93.1	Very high	88.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.5	-178.3	-74.9	96	0	0	0	112.1	Y55 L71 A74 C101 Y103 R139 L140 M157	Y55-W114 AromaticContact CD1-CD1 3.69Å; Y55-W114 AromaticContact CD1-NE1 3.83Å; Y55-W114 AromaticContact CG-NE1 3.65Å; L71-W114 HydrophobicContact CB-CH2 4.27Å; L71-W114 HydrophobicContact CB-CZ2 3.61Å; L71-W114 HydrophobicContact CD1-CD2 4.07Å; L71-W114 HydrophobicContact CD1-CH2 4.4Å; L71-W114 HydrophobicContact CD1-CZ2 3.86Å; L71-W114 HydrophobicContact CD2-CH2 4.37Å; L71-W114 HydrophobicContact CD2-CZ2 4.41Å; L71-W114 HydrophobicContact CG-CZ2 4.16Å; A74-W114 HydrophobicContact CB-CH2 4.17Å; C101-W114 HydrophobicContact CB-CE3 3.99Å; C101-W114 HydrophobicContact CB-CZ3 4.18Å; Y103-W114 AromaticContact CD2-CD1 3.82Å; Y103-W114 HydrophobicContact CD2-CD2 4.01Å; Y103-W114 AromaticContact CD2-CE2 3.69Å; Y103-W114 HydrophobicContact CD2-CG 4.07Å; Y103-W114 HydrophobicContact CD2-CZ2 4.2Å; Y103-W114 AromaticContact CD2-NE1 3.56Å; Y103-W114 HydrophobicContact CG-CZ2 4.39Å; W114-R139 VanDerWaalsContact O-CD 3.29Å; W114-R139 WeakPolarHBondContact O-CD 3.48Å; W114-L140 HydrophobicContact CB-CB 4.34Å; W114-L140 PolarHBondContact O-N 2.97Å; W114-M157 HydrophobicContact CB-CE 3.7Å; W114-M157 HydrophobicContact CD2-CE 4.5Å; W114-M157 HydrophobicContact CG-CE 3.85Å
115	Y	94.5	Very high	88.5	Confident	17 Å²	17	53.4 Å²	53.4	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.9	174.2	-71	-102.6	0	0	0	109.8	C101 Q102 R104 Y110 D111 V138 R139	C101-Y115 CarbonylContact C-O 3.59Å; C101-Y115 VanDerWaalsContact CA-O 3.26Å; C101-Y115 WeakPolarHBondContact CA-O 3.45Å; Q102-Y115 PolarHBondContact N-O 3.41Å; Q102-Y115 PolarHBondContact O-N 2.91Å; R104-Y115 HydrophobicContact CB-CD2 3.98Å; R104-Y115 HydrophobicContact CB-CE2 3.82Å; R104-Y115 HydrophobicContact CG-CE2 4.45Å; Y110-Y115 WeakPolarHBondContact CB-OH 3.45Å; D111-Y115 PolarHBondContact N-OH 2.7Å; D111-Y115 WeakPolarHBondContact O-CE2 3.31Å; D111-Y115 PolarHBondContact O-OH 3.38Å; Y115-V138 CarbonylContact C-O 3.56Å; Y115-V138 VanDerWaalsContact CA-O 3.23Å; Y115-V138 WeakPolarHBondContact CA-O 3.38Å; Y115-R139 HydrophobicContact CD1-CB 4.07Å; Y115-R139 HydrophobicContact CE1-CB 3.7Å; Y115-R139 HydrophobicContact CE1-CG 4.33Å
116	I	95.9	Very high	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.7	171.8	-168.1	158.9	0	0	0	110.8	A99 A100 T125 V127 I132 Y137 V138 L140 I146 F148	A99-I116 HydrophobicContact CB-CG1 4.34Å; A100-I116 CarbonylContact O-C 3.45Å; I116-T125 HydrophobicContact CD1-CG2 3.7Å; I116-V127 HydrophobicContact CG2-CG2 4.04Å; I116-I132 HydrophobicContact CG1-CD1 4.16Å; I116-I132 HydrophobicContact CG2-CD1 3.7Å; I116-Y137 CarbonylContact O-C 3.48Å; I116-Y137 WeakPolarHBondContact O-CA 3.45Å; I116-V138 HydrophobicContact CG2-CB 3.91Å; I116-V138 PolarHBondContact N-O 3.02Å; I116-V138 PolarHBondContact O-N 3.21Å; I116-L140 HydrophobicContact CB-CD1 3.75Å; I116-L140 HydrophobicContact CB-CD2 4.23Å; I116-L140 HydrophobicContact CB-CG 3.94Å; I116-L140 HydrophobicContact CD1-CD1 4.48Å; I116-L140 HydrophobicContact CG2-CD1 4.23Å; I116-L140 HydrophobicContact CG2-CD2 3.77Å; I116-L140 HydrophobicContact CG2-CG 3.88Å; I116-I146 HydrophobicContact CD1-CD1 4.15Å; I116-I146 HydrophobicContact CD1-CG1 4.49Å; I116-I146 HydrophobicContact CD1-CG2 3.65Å; I116-F148 HydrophobicContact CD1-CE1 4.04Å; I116-F148 HydrophobicContact CD1-CZ 4.39Å
117	F	95.7	Very high	90	Very high	26 Å²	26	48.2 Å²	48.2	11%	0.114	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	115.8	-179.1	-178.6	-93	0	0	0	109.1	Y41 A99 A100 I119 Y135 Y137	Y41-F117 HydrophobicContact CD2-CD1 4.01Å; Y41-F117 HydrophobicContact CD2-CE1 4.2Å; Y41-F117 AromaticContact CE2-CD1 3.87Å; Y41-F117 HydrophobicContact CE2-CD1 3.87Å; Y41-F117 HydrophobicContact CE2-CE1 4.32Å; Y41-F117 HydrophobicContact CE2-CG 4.31Å; A99-F117 CarbonylContact C-O 3.52Å; A99-F117 WeakPolarHBondContact CA-O 3.29Å; A99-F117 WeakPolarHBondContact CB-O 3.48Å; A100-F117 PolarHBondContact N-O 3Å; A100-F117 PolarHBondContact O-N 3.45Å; F117-I119 HydrophobicContact CD1-CG1 4.04Å; F117-I119 HydrophobicContact CE1-CG1 4.31Å; F117-Y135 HydrophobicContact CE1-CD1 4.24Å; F117-Y135 WeakPolarHBondContact CE2-O 3.46Å; F117-Y135 AromaticContact CZ-CD1 3.98Å; F117-Y135 HydrophobicContact CZ-CD1 3.98Å; F117-Y137 HydrophobicContact CB-CD1 3.74Å; F117-Y137 HydrophobicContact CB-CE1 3.61Å; F117-Y137 HydrophobicContact CB-CG 4.46Å; F117-Y137 AromaticContact CD2-CD1 3.91Å; F117-Y137 HydrophobicContact CD2-CD1 3.91Å; F117-Y137 AromaticContact CD2-CD2 3.74Å; F117-Y137 HydrophobicContact CD2-CD2 3.74Å; F117-Y137 AromaticContact CD2-CE1 3.74Å; F117-Y137 HydrophobicContact CD2-CE1 3.74Å; F117-Y137 AromaticContact CD2-CE2 3.55Å; F117-Y137 HydrophobicContact CD2-CE2 3.55Å; F117-Y137 AromaticContact CD2-CG 3.9Å; F117-Y137 HydrophobicContact CD2-CG 3.9Å; F117-Y137 AromaticContact CD2-CZ 3.53Å; F117-Y137 HydrophobicContact CE2-CD2 4.17Å; F117-Y137 AromaticContact CE2-CE2 3.76Å; F117-Y137 HydrophobicContact CE2-CE2 3.76Å; F117-Y137 HydrophobicContact CG-CD1 4.21Å; F117-Y137 AromaticContact CG-CE1 3.86Å; F117-Y137 HydrophobicContact CG-CE1 3.86Å; F117-Y137 HydrophobicContact CG-CE2 4.41Å; F117-Y137 AromaticContact CG-CZ 3.94Å
118	D	96.6	Very high	91.2	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.011	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.6	175	-172.4	-28.1	0	0	0	109.8	G120 S121 G124 T125 I132 Y135	D118-G120 PolarHBondContact O-N 3.29Å; D118-G120 VanDerWaalsContact O-N 3.12Å; D118-G120 PolarHBondContact OD1-N 2.99Å; D118-S121 WeakPolarHBondContact OD1-CB 3.3Å; D118-S121 PolarHBondContact OD1-N 2.94Å; D118-S121 PolarHBondContact OD1-OG 3.28Å; D118-S121 PolarHBondContact OD2-OG 3.5Å; D118-G124 WeakPolarHBondContact OD2-CA 3.48Å; D118-T125 PolarHBondContact OD2-N 2.94Å; D118-T125 PolarHBondContact OD2-OG1 3.24Å; D118-T125 VanDerWaalsContact OD2-OG1 3.05Å; D118-I132 HydrophobicContact CB-CD1 4.17Å; D118-I132 HydrophobicContact CB-CG1 4.38Å; D118-Y135 PolarHBondContact O-N 3.01Å
119	I	94.8	Very high	92.3	Very high	15 Å²	15	50 Å²	50	8%	0.077	26%	0.261	C	S	.	.			trans	-81.5	15.5	-173.9	-51.9	163.8	0	0	0	111.1	P40 I78 H97 H98 A100 F117 Y135	P40-I119 HydrophobicContact CG-CG2 4.14Å; P40-I119 WeakPolarHBondContact O-CG2 3.47Å; I78-I119 HydrophobicContact CG2-CD1 4.39Å; H97-I119 HydrophobicContact CB-CD1 4.21Å; H98-I119 PolarHBondContact O-N 2.89Å; A100-I119 HydrophobicContact CB-CD1 4.2Å; F117-I119 HydrophobicContact CD1-CG1 4.04Å; F117-I119 HydrophobicContact CE1-CG1 4.31Å; I119-Y135 VanDerWaalsContact C-CE1 3.48Å; I119-Y135 VanDerWaalsContact O-CE1 3.28Å; I119-Y135 WeakPolarHBondContact O-CE1 3.44Å; I119-Y135 PolarHBondContact O-OH 3.31Å
120	G	92.8	Very high	93.1	Very high	33 Å²	33	51.8 Å²	51.8	34%	0.34	26%	0.26	S	S	.	.			trans	89.9	42.6	-176.3	0	0	0	0	0	112	D118	D118-G120 PolarHBondContact O-N 3.29Å; D118-G120 VanDerWaalsContact O-N 3.12Å; D118-G120 PolarHBondContact OD1-N 2.99Å
121	S	94.3	Very high	93.9	Very high	14 Å²	14	51 Å²	51	10%	0.098	26%	0.259	C	S	.	.			trans	-63.6	147.4	178.1	72.3	0	0	0	0	112.4	H98 D118 H123 G124	H98-S121 VanDerWaalsContact CE1-CB 3.44Å; H98-S121 WeakPolarHBondContact CE1-CB 3.3Å; H98-S121 PolarHBondContact CE1-OG 3.39Å; H98-S121 WeakPolarHBondContact ND1-CB 3.5Å; H98-S121 PolarHBondContact NE2-OG 2.92Å; D118-S121 WeakPolarHBondContact OD1-CB 3.3Å; D118-S121 PolarHBondContact OD1-N 2.94Å; D118-S121 PolarHBondContact OD1-OG 3.28Å; D118-S121 PolarHBondContact OD2-OG 3.5Å; S121-H123 PolarHBondContact O-N 3.4Å; S121-G124 PolarHBondContact O-N 2.98Å; S121-G124 WeakPolarHBondContact OG-CA 3.31Å; S121-G124 PolarHBondContact OG-N 3.28Å
122	T	95	Very high	94.4	Very high	117 Å²	117	46.8 Å²	46.8	72%	0.718	24%	0.236	S	C	*	.	S	Bend	trans	-66.9	-39.9	-175	-52.4	0	0	0	0	112.5	S95	S95-T122 PolarHBondContact OG-N 2.99Å
123	H	95.3	Very high	94.7	Very high	75 Å²	75	45.6 Å²	45.6	35%	0.347	23%	0.234	S	C	.	.	S	Bend	trans	-95.4	-11	-179.1	-69.5	-86.4	0	0	0	113.3	T93 S121	T93-H123 WeakPolarHBondContact CB-CD2 3.43Å; T93-H123 PolarHBondContact O-CD2 3.35Å; S121-H123 PolarHBondContact O-N 3.4Å
124	G	95.4	Very high	95	Very high	2 Å²	2	49.2 Å²	49.2	2%	0.021	26%	0.258	C	S	.	.			trans	78.6	162.8	-174.9	0	0	0	0	0	114	H98 D118 S121 G149	H98-G124 PolarHBondContact NE2-O 3.4Å; D118-G124 WeakPolarHBondContact OD2-CA 3.48Å; S121-G124 PolarHBondContact O-N 2.98Å; S121-G124 WeakPolarHBondContact OG-CA 3.31Å; S121-G124 PolarHBondContact OG-N 3.28Å; G124-G149 WeakPolarHBondContact O-CA 3.35Å; G124-G149 PolarHBondContact O-N 3.01Å
125	T	97.1	Very high	95	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	142.7	170.2	-52.7	0	0	0	0	110.1	H98 I116 D118 I132 I146 F148	H98-T125 PolarHBondContact CD2-OG1 2.97Å; H98-T125 VanDerWaalsContact CD2-OG1 3.26Å; H98-T125 PolarHBondContact NE2-OG1 3.35Å; I116-T125 HydrophobicContact CD1-CG2 3.7Å; D118-T125 PolarHBondContact OD2-N 2.94Å; D118-T125 PolarHBondContact OD2-OG1 3.24Å; D118-T125 VanDerWaalsContact OD2-OG1 3.05Å; T125-I132 HydrophobicContact CG2-CD1 3.9Å; T125-I132 HydrophobicContact CG2-CG1 4.27Å; T125-I132 WeakPolarHBondContact O-CG1 3.33Å; T125-I132 PolarHBondContact O-N 2.96Å; T125-I146 HydrophobicContact CG2-CG2 3.96Å; T125-F148 HydrophobicContact CG2-CD1 3.74Å; T125-F148 HydrophobicContact CG2-CE1 3.75Å
126	F	96.9	Very high	94.9	Very high	37 Å²	37	60.4 Å²	60.4	16%	0.162	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.3	178	-58.2	-99.4	0	0	0	110.1	E130 K131 I146 R147	F126-E130 CarbonylContact C-O 3.58Å; F126-E130 WeakPolarHBondContact CA-O 3.34Å; F126-K131 HydrophobicContact CD1-CB 3.82Å; F126-K131 HydrophobicContact CD1-CG 4.3Å; F126-K131 HydrophobicContact CE1-CB 3.74Å; F126-K131 HydrophobicContact CE1-CD 4.39Å; F126-K131 HydrophobicContact CE1-CG 4.03Å; F126-K131 HydrophobicContact CZ-CD 4.44Å; F126-K131 HydrophobicContact CZ-CG 4.33Å; F126-I146 CarbonylContact O-C 3.59Å; F126-I146 WeakPolarHBondContact O-CA 3.34Å; F126-R147 HydrophobicContact CB-CB 4.29Å; F126-R147 PolarHBondContact N-O 3.48Å; F126-R147 PolarHBondContact O-N 2.94Å
127	V	96.1	Very high	94.8	Very high	9 Å²	9	63.8 Å²	63.8	6%	0.055	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.6	174.9	-179.9	0	0	0	0	107.4	I116 K129 E130 I132 L140 Y144 V145 I146	I116-V127 HydrophobicContact CG2-CG2 4.04Å; V127-K129 PolarHBondContact O-N 3.41Å; V127-K129 VanDerWaalsContact O-N 3.12Å; V127-E130 PolarHBondContact N-O 2.89Å; V127-E130 PolarHBondContact O-N 2.95Å; V127-E130 VanDerWaalsContact O-O 3.13Å; V127-I132 HydrophobicContact CB-CG2 4.01Å; V127-I132 HydrophobicContact CG2-CD1 4.5Å; V127-I132 HydrophobicContact CG2-CG2 3.63Å; V127-L140 HydrophobicContact CG1-CD2 3.87Å; V127-L140 HydrophobicContact CG2-CD2 4.04Å; V127-Y144 HydrophobicContact CG1-CD2 3.68Å; V127-Y144 HydrophobicContact CG1-CE2 4.34Å; V127-Y144 HydrophobicContact CG1-CG 4.47Å; V127-V145 CarbonylContact C-O 3.44Å; V127-V145 WeakPolarHBondContact CA-O 3.5Å; V127-I146 HydrophobicContact CG2-CG1 4.37Å
128	N	93.4	Very high	94.7	Very high	70 Å²	70	64.1 Å²	64.1	37%	0.374	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	38.8	-176.1	-64.2	-15.9	0	0	0	113.5	E130 Y144 V145	N128-E130 PolarHBondContact O-N 2.83Å; N128-Y144 WeakPolarHBondContact ND2-CD1 3.38Å; N128-Y144 WeakPolarHBondContact OD1-CA 3.42Å; N128-V145 PolarHBondContact N-O 3.37Å; N128-V145 PolarHBondContact OD1-N 2.76Å
129	K	91.6	Very high	94.6	Very high	189 Å²	189	65.8 Å²	65.8	82%	0.822	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-2.3	-175.6	-50.4	171.6	-177.4	173.8	0	115.4	V127	V127-K129 PolarHBondContact O-N 3.41Å; V127-K129 VanDerWaalsContact O-N 3.12Å
130	E	94.4	Very high	94.5	Very high	153 Å²	153	65.1 Å²	65.1	72%	0.715	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	138.9	174.9	-62	-168.9	162	0	0	111.1	F126 V127 N128	F126-E130 CarbonylContact C-O 3.58Å; F126-E130 WeakPolarHBondContact CA-O 3.34Å; V127-E130 PolarHBondContact N-O 2.89Å; V127-E130 PolarHBondContact O-N 2.95Å; V127-E130 VanDerWaalsContact O-O 3.13Å; N128-E130 PolarHBondContact O-N 2.83Å
131	K	96	Very high	94.5	Very high	130 Å²	130	65.4 Å²	65.4	57%	0.565	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.9	179.6	-169	-176.9	-175.3	-176.5	0	109.6	F126	F126-K131 HydrophobicContact CD1-CB 3.82Å; F126-K131 HydrophobicContact CD1-CG 4.3Å; F126-K131 HydrophobicContact CE1-CB 3.74Å; F126-K131 HydrophobicContact CE1-CD 4.39Å; F126-K131 HydrophobicContact CE1-CG 4.03Å; F126-K131 HydrophobicContact CZ-CD 4.44Å; F126-K131 HydrophobicContact CZ-CG 4.33Å
132	I	95.8	Very high	94.4	Very high	11 Å²	11	65.7 Å²	65.7	6%	0.056	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-77.5	146.2	175.4	62.8	172.4	0	0	0	110.5	I116 D118 T125 V127 V138	I116-I132 HydrophobicContact CG1-CD1 4.16Å; I116-I132 HydrophobicContact CG2-CD1 3.7Å; D118-I132 HydrophobicContact CB-CD1 4.17Å; D118-I132 HydrophobicContact CB-CG1 4.38Å; T125-I132 HydrophobicContact CG2-CD1 3.9Å; T125-I132 HydrophobicContact CG2-CG1 4.27Å; T125-I132 WeakPolarHBondContact O-CG1 3.33Å; T125-I132 PolarHBondContact O-N 2.96Å; V127-I132 HydrophobicContact CB-CG2 4.01Å; V127-I132 HydrophobicContact CG2-CD1 4.5Å; V127-I132 HydrophobicContact CG2-CG2 3.63Å; I132-V138 HydrophobicContact CB-CG2 3.99Å; I132-V138 HydrophobicContact CG2-CB 4.25Å; I132-V138 HydrophobicContact CG2-CG1 4.18Å; I132-V138 HydrophobicContact CG2-CG2 3.91Å
133	P	95.3	Very high	94.3	Very high	58 Å²	58	62.1 Å²	62.1	38%	0.377	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-70	144	176.1	28.1	-32.7	0	0	0	110.8	M136	P133-M136 HydrophobicContact CG-CB 4.02Å; P133-M136 HydrophobicContact CG-CE 3.19Å; P133-M136 HydrophobicContact CG-CG 4.44Å; P133-M136 HydrophobicContact CG-SD 3.65Å
134	P	94.1	Very high	94.2	Very high	76 Å²	76	60.4 Å²	60.4	49%	0.494	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	152.3	178.8	29.7	-35	0	0	0	111.5	M136	P134-M136 PolarHBondContact O-N 3.15Å
135	Y	93.6	Very high	94.2	Very high	157 Å²	157	62.5 Å²	62.5	62%	0.616	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	28.2	178.4	-51.6	-66.8	0	0	0	115.1	F117 D118 I119	F117-Y135 HydrophobicContact CE1-CD1 4.24Å; F117-Y135 WeakPolarHBondContact CE2-O 3.46Å; F117-Y135 AromaticContact CZ-CD1 3.98Å; F117-Y135 HydrophobicContact CZ-CD1 3.98Å; D118-Y135 PolarHBondContact O-N 3.01Å; I119-Y135 VanDerWaalsContact C-CE1 3.48Å; I119-Y135 VanDerWaalsContact O-CE1 3.28Å; I119-Y135 WeakPolarHBondContact O-CE1 3.44Å; I119-Y135 PolarHBondContact O-OH 3.31Å
136	M	93.8	Very high	94.2	Very high	94 Å²	94	62.5 Å²	62.5	46%	0.463	31%	0.309	S	S	.	.			trans	-129.6	138.6	178.5	-161.4	175.9	86.6	0	0	110.6	P133 P134 V138	P133-M136 HydrophobicContact CG-CB 4.02Å; P133-M136 HydrophobicContact CG-CE 3.19Å; P133-M136 HydrophobicContact CG-CG 4.44Å; P133-M136 HydrophobicContact CG-SD 3.65Å; P134-M136 PolarHBondContact O-N 3.15Å; M136-V138 HydrophobicContact CE-CG2 3.98Å
137	Y	93.4	Very high	94.2	Very high	71 Å²	71	65 Å²	65	28%	0.278	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	123	174.2	-68.6	-83.5	0	0	0	110	Y41 P44 W46 Q102 I116 F117	Y41-Y137 HydrophobicContact CE2-CE1 4.49Å; Y41-Y137 WeakPolarHBondContact CE2-OH 3.45Å; Y41-Y137 PolarHBondContact OH-OH 3.21Å; P44-Y137 HydrophobicContact CG-CE1 4.23Å; P44-Y137 HydrophobicContact CG-CE2 4.34Å; P44-Y137 WeakPolarHBondContact CG-OH 3.48Å; W46-Y137 AromaticContact CH2-CD1 3.74Å; W46-Y137 HydrophobicContact CH2-CD1 3.74Å; W46-Y137 AromaticContact CH2-CE1 3.74Å; W46-Y137 HydrophobicContact CH2-CE1 3.74Å; W46-Y137 HydrophobicContact CH2-CG 4.22Å; W46-Y137 AromaticContact CZ2-CD1 3.96Å; W46-Y137 HydrophobicContact CZ2-CD1 3.96Å; W46-Y137 HydrophobicContact CZ2-CD2 4.05Å; W46-Y137 AromaticContact CZ2-CE1 3.86Å; W46-Y137 HydrophobicContact CZ2-CE1 3.86Å; W46-Y137 AromaticContact CZ2-CE2 3.96Å; W46-Y137 HydrophobicContact CZ2-CE2 3.96Å; W46-Y137 HydrophobicContact CZ2-CG 4.07Å; W46-Y137 AromaticContact CZ2-CZ 3.89Å; Q102-Y137 HydrophobicContact CB-CE1 4.25Å; I116-Y137 CarbonylContact O-C 3.48Å; I116-Y137 WeakPolarHBondContact O-CA 3.45Å; F117-Y137 HydrophobicContact CB-CD1 3.74Å; F117-Y137 HydrophobicContact CB-CE1 3.61Å; F117-Y137 HydrophobicContact CB-CG 4.46Å; F117-Y137 AromaticContact CD2-CD1 3.91Å; F117-Y137 HydrophobicContact CD2-CD1 3.91Å; F117-Y137 AromaticContact CD2-CD2 3.74Å; F117-Y137 HydrophobicContact CD2-CD2 3.74Å; F117-Y137 AromaticContact CD2-CE1 3.74Å; F117-Y137 HydrophobicContact CD2-CE1 3.74Å; F117-Y137 AromaticContact CD2-CE2 3.55Å; F117-Y137 HydrophobicContact CD2-CE2 3.55Å; F117-Y137 AromaticContact CD2-CG 3.9Å; F117-Y137 HydrophobicContact CD2-CG 3.9Å; F117-Y137 AromaticContact CD2-CZ 3.53Å; F117-Y137 HydrophobicContact CE2-CD2 4.17Å; F117-Y137 AromaticContact CE2-CE2 3.76Å; F117-Y137 HydrophobicContact CE2-CE2 3.76Å; F117-Y137 HydrophobicContact CG-CD1 4.21Å; F117-Y137 AromaticContact CG-CE1 3.86Å; F117-Y137 HydrophobicContact CG-CE1 3.86Å; F117-Y137 HydrophobicContact CG-CE2 4.41Å; F117-Y137 AromaticContact CG-CZ 3.94Å
138	V	94	Very high	94.2	Very high	34 Å²	34	64.5 Å²	64.5	21%	0.206	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131	176.4	179.8	0	0	0	0	109.1	Y115 I116 I132 M136 L140	Y115-V138 CarbonylContact C-O 3.56Å; Y115-V138 VanDerWaalsContact CA-O 3.23Å; Y115-V138 WeakPolarHBondContact CA-O 3.38Å; I116-V138 HydrophobicContact CG2-CB 3.91Å; I116-V138 PolarHBondContact N-O 3.02Å; I116-V138 PolarHBondContact O-N 3.21Å; I132-V138 HydrophobicContact CB-CG2 3.99Å; I132-V138 HydrophobicContact CG2-CB 4.25Å; I132-V138 HydrophobicContact CG2-CG1 4.18Å; I132-V138 HydrophobicContact CG2-CG2 3.91Å; M136-V138 HydrophobicContact CE-CG2 3.98Å; V138-L140 PolarHBondContact O-N 3Å
139	R	93.5	Very high	94.2	Very high	37 Å²	37	61.2 Å²	61.2	14%	0.14	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	128.6	-179.6	-178.8	50.9	162.6	86.2	8	110.6	I112 W114 Y115 K141 D163	I112-R139 PolarHBondContact O-NH2 2.94Å; W114-R139 VanDerWaalsContact O-CD 3.29Å; W114-R139 WeakPolarHBondContact O-CD 3.48Å; Y115-R139 HydrophobicContact CD1-CB 4.07Å; Y115-R139 HydrophobicContact CE1-CB 3.7Å; Y115-R139 HydrophobicContact CE1-CG 4.33Å; R139-K141 HydrophobicContact CG-CG 4.38Å; R139-D163 IonicContact CZ-OD1 3.83Å; R139-D163 IonicContact CZ-OD2 3.46Å; R139-D163 IonicContact NH1-OD1 3.08Å; R139-D163 PolarHBondContact NH1-OD1 2.84Å; R139-D163 IonicContact NH1-OD2 2.76Å; R139-D163 PolarHBondContact NH1-OD2 3.4Å; R139-D163 IonicContact NH2-OD1 3.06Å; R139-D163 PolarHBondContact NH2-OD1 3.16Å; R139-D163 IonicContact NH2-OD2 3.84Å; R139-D163 PolarHBondContact NH2-OD2 3.24Å; R139-D163 VanDerWaalsContact NH2-OD2 3.12Å
140	L	93.5	Very high	94.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.3	175	-67.7	177.6	0	0	0	109.9	F57 W114 I116 V127 V138 Y144 I146 M157	F57-L140 HydrophobicContact CZ-CD1 4.43Å; W114-L140 HydrophobicContact CB-CB 4.34Å; W114-L140 PolarHBondContact O-N 2.97Å; I116-L140 HydrophobicContact CB-CD1 3.75Å; I116-L140 HydrophobicContact CB-CD2 4.23Å; I116-L140 HydrophobicContact CB-CG 3.94Å; I116-L140 HydrophobicContact CD1-CD1 4.48Å; I116-L140 HydrophobicContact CG2-CD1 4.23Å; I116-L140 HydrophobicContact CG2-CD2 3.77Å; I116-L140 HydrophobicContact CG2-CG 3.88Å; V127-L140 HydrophobicContact CG1-CD2 3.87Å; V127-L140 HydrophobicContact CG2-CD2 4.04Å; V138-L140 PolarHBondContact O-N 3Å; L140-Y144 HydrophobicContact CD2-CD2 4.25Å; L140-I146 HydrophobicContact CD1-CD1 3.49Å; L140-I146 VanDerWaalsContact CD1-CD1 3.49Å; L140-I146 HydrophobicContact CD1-CG1 4.49Å; L140-I146 HydrophobicContact CD2-CD1 3.83Å; L140-I146 HydrophobicContact CD2-CG1 3.93Å; L140-I146 HydrophobicContact CG-CD1 4.29Å; L140-M157 HydrophobicContact CB-CE 4.13Å; L140-M157 HydrophobicContact CD1-CE 3.83Å
141	K	92	Very high	94.3	Very high	40 Å²	40	50 Å²	50	17%	0.174	25%	0.251	C	S	.	.			trans	-96.3	169.4	174.8	-73.4	178.7	178.5	174.5	0	111.8	R139 Y144 D163 E165	R139-K141 HydrophobicContact CG-CG 4.38Å; K141-Y144 HydrophobicContact CB-CD1 4.09Å; K141-Y144 HydrophobicContact CB-CE1 3.94Å; K141-Y144 VanDerWaalsContact O-CB 3.3Å; K141-Y144 WeakPolarHBondContact O-CB 3.43Å; K141-Y144 PolarHBondContact O-N 3.02Å; K141-D163 WeakPolarHBondContact CB-O 3.39Å; K141-E165 HydrophobicContact CB-CG 4.02Å; K141-E165 HydrophobicContact CD-CB 4.38Å; K141-E165 HydrophobicContact CD-CG 3.08Å; K141-E165 WeakPolarHBondContact CD-OE1 3.43Å; K141-E165 HydrophobicContact CG-CG 4.21Å; K141-E165 IonicContact NZ-OE1 2.7Å; K141-E165 PolarHBondContact NZ-OE1 3.01Å
142	V	92.7	Very high	94.1	Very high	19 Å²	19	47 Å²	47	12%	0.115	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-61.6	138.1	177.9	-178.6	0	0	0	0	109.4	Y55 Y144 D163	Y55-V142 HydrophobicContact CE1-CG2 4.32Å; V142-Y144 VanDerWaalsContact C-N 3.35Å; V142-D163 HydrophobicContact CG2-CB 3.92Å; V142-D163 PolarHBondContact N-O 3.28Å
143	G	91.8	Very high	94	Very high	42 Å²	42	49.7 Å²	49.7	43%	0.433	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-11	-175.3	0	0	0	0	0	115.1	M157	G143-M157 PolarHBondContact N-O 3.42Å
144	Y	94.4	Very high	94	Very high	40 Å²	40	49.4 Å²	49.4	16%	0.157	25%	0.251	C	S	.	.			trans	-67.7	139.2	-179	-81.9	28.6	0	0	0	112	V127 N128 L140 K141 V142 I156 M157 E165	V127-Y144 HydrophobicContact CG1-CD2 3.68Å; V127-Y144 HydrophobicContact CG1-CE2 4.34Å; V127-Y144 HydrophobicContact CG1-CG 4.47Å; N128-Y144 WeakPolarHBondContact ND2-CD1 3.38Å; N128-Y144 WeakPolarHBondContact OD1-CA 3.42Å; L140-Y144 HydrophobicContact CD2-CD2 4.25Å; K141-Y144 HydrophobicContact CB-CD1 4.09Å; K141-Y144 HydrophobicContact CB-CE1 3.94Å; K141-Y144 VanDerWaalsContact O-CB 3.3Å; K141-Y144 WeakPolarHBondContact O-CB 3.43Å; K141-Y144 PolarHBondContact O-N 3.02Å; V142-Y144 VanDerWaalsContact C-N 3.35Å; Y144-I156 WeakPolarHBondContact O-CA 3.37Å; Y144-M157 PolarHBondContact O-N 2.9Å; Y144-E165 HydrophobicContact CE1-CG 3.97Å; Y144-E165 WeakPolarHBondContact CE1-OE2 3.12Å; Y144-E165 PolarHBondContact OH-OE1 3.12Å; Y144-E165 VanDerWaalsContact OH-OE1 3.13Å; Y144-E165 PolarHBondContact OH-OE2 3.09Å
145	V	95.6	Very high	94.1	Very high	45 Å²	45	46 Å²	46	27%	0.273	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.8	-178	-173.4	0	0	0	0	110.6	V127 N128 L154 Y155 I156	V127-V145 CarbonylContact C-O 3.44Å; V127-V145 WeakPolarHBondContact CA-O 3.5Å; N128-V145 PolarHBondContact N-O 3.37Å; N128-V145 PolarHBondContact OD1-N 2.76Å; V145-L154 HydrophobicContact CG1-CB 3.85Å; V145-L154 HydrophobicContact CG1-CD1 4.16Å; V145-L154 HydrophobicContact CG1-CD2 4.22Å; V145-L154 HydrophobicContact CG1-CG 4.3Å; V145-Y155 CarbonylContact C-O 3.44Å; V145-Y155 WeakPolarHBondContact CA-O 3.46Å; V145-I156 HydrophobicContact CG2-CG1 4.24Å
146	I	96.7	Very high	94.2	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.4	-177.9	-50.7	161.1	0	0	0	109.6	F57 I116 T125 F126 V127 L140 F148 Y155	F57-I146 HydrophobicContact CD1-CD1 4.49Å; F57-I146 HydrophobicContact CE1-CD1 3.51Å; F57-I146 HydrophobicContact CZ-CD1 4Å; I116-I146 HydrophobicContact CD1-CD1 4.15Å; I116-I146 HydrophobicContact CD1-CG1 4.49Å; I116-I146 HydrophobicContact CD1-CG2 3.65Å; T125-I146 HydrophobicContact CG2-CG2 3.96Å; F126-I146 CarbonylContact O-C 3.59Å; F126-I146 WeakPolarHBondContact O-CA 3.34Å; V127-I146 HydrophobicContact CG2-CG1 4.37Å; L140-I146 HydrophobicContact CD1-CD1 3.49Å; L140-I146 VanDerWaalsContact CD1-CD1 3.49Å; L140-I146 HydrophobicContact CD1-CG1 4.49Å; L140-I146 HydrophobicContact CD2-CD1 3.83Å; L140-I146 HydrophobicContact CD2-CG1 3.93Å; L140-I146 HydrophobicContact CG-CD1 4.29Å; I146-F148 HydrophobicContact CG2-CD1 4.39Å; I146-F148 HydrophobicContact CG2-CE1 3.82Å; I146-F148 HydrophobicContact CG2-CE2 4.2Å; I146-F148 HydrophobicContact CG2-CZ 3.71Å; I146-Y155 PolarHBondContact N-O 3.28Å; I146-Y155 PolarHBondContact O-N 3.33Å
147	R	96	Very high	94.2	Very high	88 Å²	88	36.2 Å²	36.2	33%	0.332	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.8	174	-176.1	179.5	66.8	-166	-2.3	109.9	F126 L154	F126-R147 HydrophobicContact CB-CB 4.29Å; F126-R147 PolarHBondContact N-O 3.48Å; F126-R147 PolarHBondContact O-N 2.94Å; R147-L154 HydrophobicContact CB-CD2 3.8Å; R147-L154 HydrophobicContact CG-CD2 3.98Å
148	F	96.4	Very high	94.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.5	178.2	-59.4	-65.5	0	0	0	110.8	F79 L89 I94 H98 A99 I116 T125 I146 N150 S151 Y155	F79-F148 HydrophobicContact CB-CE1 4.18Å; F79-F148 HydrophobicContact CB-CE2 4.19Å; F79-F148 HydrophobicContact CB-CZ 3.9Å; F79-F148 HydrophobicContact CD1-CD2 4.46Å; F79-F148 AromaticContact CD1-CE2 3.52Å; F79-F148 HydrophobicContact CD1-CE2 3.52Å; F79-F148 AromaticContact CD1-CZ 3.66Å; F79-F148 HydrophobicContact CD1-CZ 3.66Å; F79-F148 HydrophobicContact CD2-CE1 4.49Å; F79-F148 AromaticContact CD2-CZ 3.86Å; F79-F148 HydrophobicContact CD2-CZ 3.86Å; F79-F148 AromaticContact CE1-CE2 3.99Å; F79-F148 HydrophobicContact CE1-CE2 3.99Å; F79-F148 HydrophobicContact CE1-CZ 4.11Å; F79-F148 HydrophobicContact CE2-CZ 4.3Å; F79-F148 HydrophobicContact CG-CE1 4.22Å; F79-F148 AromaticContact CG-CE2 3.83Å; F79-F148 HydrophobicContact CG-CE2 3.83Å; F79-F148 AromaticContact CG-CZ 3.52Å; F79-F148 HydrophobicContact CG-CZ 3.52Å; F79-F148 HydrophobicContact CZ-CZ 4.41Å; L89-F148 HydrophobicContact CD1-CB 4.19Å; L89-F148 HydrophobicContact CD1-CD2 3.55Å; L89-F148 HydrophobicContact CD1-CE2 4.15Å; L89-F148 HydrophobicContact CD1-CG 3.98Å; I94-F148 HydrophobicContact CD1-CB 4.07Å; I94-F148 HydrophobicContact CG1-CB 4.22Å; H98-F148 AromaticContact CD2-CD1 3.45Å; H98-F148 VanDerWaalsContact CD2-CD1 3.45Å; H98-F148 WeakPolarHBondContact CD2-CD1 3.45Å; H98-F148 AromaticContact NE2-CD1 3.81Å; A99-F148 HydrophobicContact CB-CD1 4.33Å; A99-F148 HydrophobicContact CB-CE1 3.79Å; I116-F148 HydrophobicContact CD1-CE1 4.04Å; I116-F148 HydrophobicContact CD1-CZ 4.39Å; T125-F148 HydrophobicContact CG2-CD1 3.74Å; T125-F148 HydrophobicContact CG2-CE1 3.75Å; I146-F148 HydrophobicContact CG2-CD1 4.39Å; I146-F148 HydrophobicContact CG2-CE1 3.82Å; I146-F148 HydrophobicContact CG2-CE2 4.2Å; I146-F148 HydrophobicContact CG2-CZ 3.71Å; F148-N150 PolarHBondContact O-N 2.89Å; F148-S151 VanDerWaalsContact O-CB 3.24Å; F148-S151 WeakPolarHBondContact O-CB 3.48Å; F148-S151 PolarHBondContact O-N 2.91Å; F148-S151 VanDerWaalsContact O-N 3.08Å; F148-Y155 AromaticContact CD2-CD2 3.81Å; F148-Y155 HydrophobicContact CD2-CD2 3.81Å; F148-Y155 AromaticContact CD2-CE2 3.75Å; F148-Y155 HydrophobicContact CD2-CE2 3.75Å; F148-Y155 AromaticContact CE2-CD2 3.66Å; F148-Y155 HydrophobicContact CE2-CD2 3.66Å; F148-Y155 AromaticContact CE2-CE2 3.9Å; F148-Y155 HydrophobicContact CE2-CE2 3.9Å; F148-Y155 HydrophobicContact CE2-CG 4.11Å
149	G	94	Very high	93.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-126.3	-175.5	0	0	0	0	0	112.7	H98 G124	H98-G149 PolarHBondContact CE1-N 3.22Å; G124-G149 WeakPolarHBondContact O-CA 3.35Å; G124-G149 PolarHBondContact O-N 3.01Å
150	N	93.3	Very high	93.4	Very high	98 Å²	98	34.9 Å²	34.9	52%	0.524	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	24.8	179.3	-62.6	0.4	0	0	0	112.5	H91 T93 F148	H91-N150 PolarHBondContact CE1-O 3.5Å; H91-N150 PolarHBondContact NE2-O 3.32Å; T93-N150 HydrophobicContact CG2-CB 4.13Å; T93-N150 PolarHBondContact OG1-N 3.49Å; F148-N150 PolarHBondContact O-N 2.89Å
151	S	93.6	Very high	92.8	Very high	10 Å²	10	43 Å²	43	7%	0.07	23%	0.23	C	C	.	.			trans	-62.7	142.3	176.1	-172.8	0	0	0	0	111.4	F148 R153	F148-S151 VanDerWaalsContact O-CB 3.24Å; F148-S151 WeakPolarHBondContact O-CB 3.48Å; F148-S151 PolarHBondContact O-N 2.91Å; F148-S151 VanDerWaalsContact O-N 3.08Å; S151-R153 PolarHBondContact OG-N 3.5Å
152	S	92.7	Very high	92.2	Very high	65 Å²	65	46.9 Å²	46.9	46%	0.455	26%	0.262	S	S	.	.	S	Bend	trans	-76.4	-11.1	169.6	55.1	0	0	0	0	113.4
153	R	93.9	Very high	91.7	Very high	68 Å²	68	47 Å²	47	26%	0.257	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.9	176.4	-59.1	-178.8	-174.5	-133.3	8.1	110.1	V59 L60 K61 S151 Y155	V59-R153 HydrophobicContact CG1-CB 4.19Å; V59-R153 HydrophobicContact CG1-CG 4.46Å; L60-R153 CarbonylContact O-C 3.58Å; L60-R153 VanDerWaalsContact O-CA 3.3Å; L60-R153 WeakPolarHBondContact O-CA 3.46Å; K61-R153 HydrophobicContact CB-CG 4.37Å; K61-R153 HydrophobicContact CD-CG 4.33Å; K61-R153 HydrophobicContact CG-CG 4.29Å; S151-R153 PolarHBondContact OG-N 3.5Å; R153-Y155 HydrophobicContact CB-CE2 4.07Å
154	L	95.2	Very high	91.2	Very high	52 Å²	52	50 Å²	50	27%	0.272	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143	172.3	-57.7	176.1	0	0	0	108.8	V59 L60 V145 R147	V59-L154 CarbonylContact C-O 3.55Å; V59-L154 WeakPolarHBondContact CA-O 3.37Å; L60-L154 HydrophobicContact CB-CB 4.33Å; L60-L154 HydrophobicContact CD2-CD1 4.18Å; L60-L154 PolarHBondContact N-O 3.02Å; L60-L154 PolarHBondContact O-N 3.41Å; V145-L154 HydrophobicContact CG1-CB 3.85Å; V145-L154 HydrophobicContact CG1-CD1 4.16Å; V145-L154 HydrophobicContact CG1-CD2 4.22Å; V145-L154 HydrophobicContact CG1-CG 4.3Å; R147-L154 HydrophobicContact CB-CD2 3.8Å; R147-L154 HydrophobicContact CG-CD2 3.98Å
155	Y	95.9	Very high	90.3	Very high	5 Å²	5	52 Å²	52	2%	0.02	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.9	179.1	-65.3	-100.1	0	0	0	108.1	F57 E58 V59 L69 F79 L89 V145 I146 F148 R153	F57-Y155 HydrophobicContact CB-CD1 4.43Å; E58-Y155 CarbonylContact O-C 3.55Å; E58-Y155 WeakPolarHBondContact O-CA 3.37Å; V59-Y155 HydrophobicContact CB-CE1 4.33Å; V59-Y155 HydrophobicContact CG1-CE1 4Å; V59-Y155 HydrophobicContact CG2-CD1 3.7Å; V59-Y155 HydrophobicContact CG2-CE1 3.46Å; V59-Y155 VanDerWaalsContact CG2-CE1 3.46Å; L69-Y155 HydrophobicContact CD1-CD1 4.39Å; L69-Y155 HydrophobicContact CD1-CE1 4.14Å; F79-Y155 HydrophobicContact CE1-CD1 4.41Å; F79-Y155 HydrophobicContact CE1-CE1 4.46Å; L89-Y155 HydrophobicContact CD2-CE2 4.37Å; L89-Y155 WeakPolarHBondContact CD2-OH 3.45Å; V145-Y155 CarbonylContact C-O 3.44Å; V145-Y155 WeakPolarHBondContact CA-O 3.46Å; I146-Y155 PolarHBondContact N-O 3.28Å; I146-Y155 PolarHBondContact O-N 3.33Å; F148-Y155 AromaticContact CD2-CD2 3.81Å; F148-Y155 HydrophobicContact CD2-CD2 3.81Å; F148-Y155 AromaticContact CD2-CE2 3.75Å; F148-Y155 HydrophobicContact CD2-CE2 3.75Å; F148-Y155 AromaticContact CE2-CD2 3.66Å; F148-Y155 HydrophobicContact CE2-CD2 3.66Å; F148-Y155 AromaticContact CE2-CE2 3.9Å; F148-Y155 HydrophobicContact CE2-CE2 3.9Å; F148-Y155 HydrophobicContact CE2-CG 4.11Å; R153-Y155 HydrophobicContact CB-CE2 4.07Å
156	I	95.4	Very high	89.2	Confident	43 Å²	43	55.2 Å²	55.2	22%	0.221	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.9	-178.1	-51.9	177.8	0	0	0	107.8	F57 E58 L60 Y144 V145 Q158	F57-I156 CarbonylContact C-O 3.54Å; F57-I156 VanDerWaalsContact CA-O 3.31Å; F57-I156 WeakPolarHBondContact CA-O 3.29Å; E58-I156 HydrophobicContact CB-CB 4.37Å; E58-I156 PolarHBondContact N-O 3.39Å; E58-I156 PolarHBondContact O-N 2.99Å; L60-I156 HydrophobicContact CB-CD1 4.46Å; Y144-I156 WeakPolarHBondContact O-CA 3.37Å; V145-I156 HydrophobicContact CG2-CG1 4.24Å; I156-Q158 PolarHBondContact O-N 3.01Å
157	M	93.9	Very high	87.7	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	122.5	176.1	-176	63.8	81.5	0	0	110	F57 L71 W114 L140 G143 Y144	F57-M157 HydrophobicContact CD1-CB 4.41Å; F57-M157 HydrophobicContact CD1-CE 4.26Å; F57-M157 HydrophobicContact CD1-SD 4.18Å; F57-M157 HydrophobicContact CE1-CB 4.11Å; F57-M157 HydrophobicContact CE1-CE 3.27Å; F57-M157 HydrophobicContact CE1-SD 3.74Å; F57-M157 HydrophobicContact CE2-CE 4.02Å; F57-M157 HydrophobicContact CZ-CE 3.13Å; F57-M157 HydrophobicContact CZ-SD 3.97Å; L71-M157 HydrophobicContact CD1-CE 4.14Å; L71-M157 HydrophobicContact CD1-SD 3.79Å; W114-M157 HydrophobicContact CB-CE 3.7Å; W114-M157 HydrophobicContact CD2-CE 4.5Å; W114-M157 HydrophobicContact CG-CE 3.85Å; L140-M157 HydrophobicContact CB-CE 4.13Å; L140-M157 HydrophobicContact CD1-CE 3.83Å; G143-M157 PolarHBondContact N-O 3.42Å; Y144-M157 PolarHBondContact O-N 2.9Å
158	Q	92.7	Very high	86.2	Confident	65 Å²	65	63.2 Å²	63.2	30%	0.304	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	149.8	171	-57.9	-162.7	-53.4	0	0	109.4	H54 Y55 G56 E58 I156	H54-Q158 CarbonylContact O-C 3.6Å; Y55-Q158 VanDerWaalsContact CA-O 3.32Å; Y55-Q158 WeakPolarHBondContact CA-O 3.3Å; Y55-Q158 WeakPolarHBondContact CD1-O 3.38Å; G56-Q158 PolarHBondContact N-O 3.48Å; G56-Q158 VanDerWaalsContact N-O 3.07Å; G56-Q158 PolarHBondContact O-N 2.94Å; E58-Q158 VanDerWaalsContact CG-CD 3.47Å; E58-Q158 HydrophobicContact CG-CG 4.23Å; E58-Q158 PolarHBondContact OE1-NE2 3.47Å; E58-Q158 PolarHBondContact OE1-OE1 2.97Å; E58-Q158 PolarHBondContact OE2-NE2 3.27Å; I156-Q158 PolarHBondContact O-N 3.01Å
159	G	87.6	Confident	84.4	Confident	21 Å²	21	69.1 Å²	69.1	22%	0.216	39%	0.387	C	S	.	.			trans	-177.5	-177.1	-179.8	0	0	0	0	0	111.6	H54	H54-G159 WeakPolarHBondContact O-CA 3.49Å; H54-G159 PolarHBondContact O-N 2.83Å
160	P	84.9	Confident	82.8	Confident	29 Å²	29	72 Å²	72	19%	0.188	40%	0.402	C	S	.	.			trans	-69.1	148.9	176.6	30.1	-32.6	0	0	0	111.3	Y55 S162 D163	Y55-P160 HydrophobicContact CE2-CG 4.26Å; P160-S162 PolarHBondContact O-N 3.4Å; P160-D163 PolarHBondContact O-N 2.93Å
161	E	79.7	Confident	81.5	Confident	171 Å²	171	70.3 Å²	70.3	80%	0.799	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-54.2	-24.2	178.5	-65.1	173.6	-176.4	0	0	113	D163 E164	E161-D163 PolarHBondContact O-N 3.18Å; E161-E164 WeakPolarHBondContact O-CB 3.32Å; E161-E164 PolarHBondContact O-N 3.07Å
162	S	80.4	Confident	80.1	Confident	121 Å²	121	75.6 Å²	75.6	85%	0.846	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60.4	-24.7	175.5	-54.6	0	0	0	0	114.4	P160	P160-S162 PolarHBondContact O-N 3.4Å
163	D	81.2	Confident	79	Confident	20 Å²	20	76.7 Å²	76.7	11%	0.107	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-108.2	15.6	179.7	-166.6	36.4	0	0	0	113.5	Y55 R139 K141 V142 P160 E161	Y55-D163 WeakPolarHBondContact OH-CB 3.48Å; R139-D163 IonicContact CZ-OD1 3.83Å; R139-D163 IonicContact CZ-OD2 3.46Å; R139-D163 IonicContact NH1-OD1 3.08Å; R139-D163 PolarHBondContact NH1-OD1 2.84Å; R139-D163 IonicContact NH1-OD2 2.76Å; R139-D163 PolarHBondContact NH1-OD2 3.4Å; R139-D163 IonicContact NH2-OD1 3.06Å; R139-D163 PolarHBondContact NH2-OD1 3.16Å; R139-D163 IonicContact NH2-OD2 3.84Å; R139-D163 PolarHBondContact NH2-OD2 3.24Å; R139-D163 VanDerWaalsContact NH2-OD2 3.12Å; K141-D163 WeakPolarHBondContact CB-O 3.39Å; V142-D163 HydrophobicContact CG2-CB 3.92Å; V142-D163 PolarHBondContact N-O 3.28Å; P160-D163 PolarHBondContact O-N 2.93Å; E161-D163 PolarHBondContact O-N 3.18Å
164	E	81	Confident	78.2	Confident	106 Å²	106	77.9 Å²	77.9	50%	0.495	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-76.8	143.3	173	-167.3	162	-162.7	0	0	110.7	E161	E161-E164 WeakPolarHBondContact O-CB 3.32Å; E161-E164 PolarHBondContact O-N 3.07Å
165	E	76.5	Confident	76.9	Confident	82 Å²	82	78.9 Å²	78.9	38%	0.383	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-67.7	131.2	172	-77.3	-149.9	130.7	0	0	110.3	K141 Y144 E167	K141-E165 HydrophobicContact CB-CG 4.02Å; K141-E165 HydrophobicContact CD-CB 4.38Å; K141-E165 HydrophobicContact CD-CG 3.08Å; K141-E165 WeakPolarHBondContact CD-OE1 3.43Å; K141-E165 HydrophobicContact CG-CG 4.21Å; K141-E165 IonicContact NZ-OE1 2.7Å; K141-E165 PolarHBondContact NZ-OE1 3.01Å; Y144-E165 HydrophobicContact CE1-CG 3.97Å; Y144-E165 WeakPolarHBondContact CE1-OE2 3.12Å; Y144-E165 PolarHBondContact OH-OE1 3.12Å; Y144-E165 VanDerWaalsContact OH-OE1 3.13Å; Y144-E165 PolarHBondContact OH-OE2 3.09Å; E165-E167 PolarHBondContact O-N 2.63Å
166	P	71.7	Confident	76	Confident	112 Å²	112	85.6 Å²	85.6	73%	0.727	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-59.2	119.4	172.1	26.1	-32.4	0	0	0	107.2	S168	P166-S168 PolarHBondContact O-N 3.31Å; P166-S168 VanDerWaalsContact O-N 3.16Å
167	E	66.6	Low	75.2	Confident	182 Å²	182	88.5 Å²	88.5	85%	0.85	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-49.8	127.6	175.5	-66.6	-167	149.3	0	0	108.3	E165 S169	E165-E167 PolarHBondContact O-N 2.63Å; E167-S169 PolarHBondContact O-N 3.17Å
168	S	63.7	Low	74.2	Confident	75 Å²	75	95.6 Å²	95.6	52%	0.524	52%	0.52	S	S	.	.			trans	-64.2	113.2	178.8	61.7	0	0	0	0	107.8	P166 L170 I175	P166-S168 PolarHBondContact O-N 3.31Å; P166-S168 VanDerWaalsContact O-N 3.16Å; S168-L170 PolarHBondContact O-N 3Å; S168-I175 WeakPolarHBondContact OG-CD1 3.14Å
169	S	59	Low	73.6	Confident	124 Å²	124	94.4 Å²	94.4	87%	0.867	52%	0.521	S	S	*	.			trans	-65.5	9.6	177.4	69.6	0	0	0	0	114	E167	E167-S169 PolarHBondContact O-N 3.17Å
170	L	58.8	Low	73.2	Confident	60 Å²	60	97.8 Å²	97.8	31%	0.314	53%	0.534	S	S	.	.	S	Bend	trans	-98.8	131.4	-176.6	-69.3	165.2	0	0	0	108.5	S168 E174 I175	S168-L170 PolarHBondContact O-N 3Å; L170-E174 VanDerWaalsContact CA-OE2 3.31Å; L170-E174 WeakPolarHBondContact CA-OE2 3.37Å; L170-E174 HydrophobicContact CB-CB 4.05Å; L170-E174 HydrophobicContact CD2-CB 3.96Å; L170-E174 WeakPolarHBondContact CD2-OE2 3.36Å; L170-I175 HydrophobicContact CB-CG1 3.81Å; L170-I175 WeakPolarHBondContact O-CD1 3.27Å
171	S	67.9	Low	73	Confident	63 Å²	63	101.6 Å²	101.6	44%	0.441	55%	0.547	S	S	.	.			trans	-57	150.5	172.2	169.1	0	0	0	0	110.4	S173 E174 I175	S171-S173 PolarHBondContact O-N 3.42Å; S171-S173 PolarHBondContact OG-N 3.32Å; S171-E174 PolarHBondContact N-OE2 3.47Å; S171-E174 WeakPolarHBondContact O-CA 3.27Å; S171-E174 WeakPolarHBondContact O-CB 3.43Å; S171-E174 PolarHBondContact O-N 2.69Å; S171-I175 PolarHBondContact O-N 2.91Å
172	V	63.4	Low	72.8	Confident	122 Å²	122	98.9 Å²	98.9	74%	0.739	54%	0.535	S	S	*	.	H	α-helix	trans	-48.4	-33.1	175.8	179.2	0	0	0	0	111.9	K176	V172-K176 WeakPolarHBondContact O-CB 3.28Å; V172-K176 PolarHBondContact O-N 3.38Å
173	S	70.3	Confident	72.7	Confident	87 Å²	87	100.2 Å²	100.2	61%	0.608	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-41.9	174.8	-47	0	0	0	0	113.2	S171 K176 E177	S171-S173 PolarHBondContact O-N 3.42Å; S171-S173 PolarHBondContact OG-N 3.32Å; S173-K176 PolarHBondContact O-N 3.3Å; S173-E177 PolarHBondContact O-N 2.73Å
174	E	76.1	Confident	72.6	Confident	94 Å²	94	104.1 Å²	104.1	44%	0.439	54%	0.543	S	S	.	.	H	α-helix	trans	-75.1	-34.7	-178.8	-63.9	170.9	154.6	0	0	111.6	L170 S171 E177 R178	L170-E174 VanDerWaalsContact CA-OE2 3.31Å; L170-E174 WeakPolarHBondContact CA-OE2 3.37Å; L170-E174 HydrophobicContact CB-CB 4.05Å; L170-E174 HydrophobicContact CD2-CB 3.96Å; L170-E174 WeakPolarHBondContact CD2-OE2 3.36Å; S171-E174 PolarHBondContact N-OE2 3.47Å; S171-E174 WeakPolarHBondContact O-CA 3.27Å; S171-E174 WeakPolarHBondContact O-CB 3.43Å; S171-E174 PolarHBondContact O-N 2.69Å; E174-E177 PolarHBondContact O-N 3.02Å; E174-R178 WeakPolarHBondContact O-CB 3.31Å; E174-R178 PolarHBondContact O-N 3.41Å
175	I	67.5	Low	72.3	Confident	73 Å²	73	104.2 Å²	104.2	37%	0.374	55%	0.546	S	S	.	.	H	α-helix	trans	-62	-45.4	172.2	-60.5	171.4	0	0	0	109.9	S168 L170 S171 R178 A179	S168-I175 WeakPolarHBondContact OG-CD1 3.14Å; L170-I175 HydrophobicContact CB-CG1 3.81Å; L170-I175 WeakPolarHBondContact O-CD1 3.27Å; S171-I175 PolarHBondContact O-N 2.91Å; I175-R178 PolarHBondContact O-N 2.78Å; I175-A179 WeakPolarHBondContact O-CB 3.44Å; I175-A179 PolarHBondContact O-N 3.49Å
176	K	77.2	Confident	71.8	Confident	146 Å²	146	106.8 Å²	106.8	64%	0.635	56%	0.559	S	S	*	*	H	α-helix	trans	-64.2	-42.1	177.7	-168.3	175.3	-177.6	-179.3	0	111.7	V172 S173 A179 N180	V172-K176 WeakPolarHBondContact O-CB 3.28Å; V172-K176 PolarHBondContact O-N 3.38Å; S173-K176 PolarHBondContact O-N 3.3Å; K176-A179 PolarHBondContact O-N 2.96Å; K176-N180 PolarHBondContact O-N 3.43Å; K176-N180 VanDerWaalsContact O-N 3.09Å
177	E	78.2	Confident	71.9	Confident	103 Å²	103	104.4 Å²	104.4	48%	0.481	55%	0.546	S	S	.	.	H	α-helix	trans	-65.1	-40.9	177.1	-163.1	-173.9	149.1	0	0	111.9	S173 E174 N180 K181	S173-E177 PolarHBondContact O-N 2.73Å; E174-E177 PolarHBondContact O-N 3.02Å; E177-N180 PolarHBondContact O-N 3.01Å; E177-K181 PolarHBondContact O-N 3.44Å; E177-K181 IonicContact OE1-NZ 2.6Å; E177-K181 PolarHBondContact OE1-NZ 3.38Å
178	R	73.8	Confident	72	Confident	152 Å²	152	101.1 Å²	101.1	57%	0.574	53%	0.525	S	S	*	.	H	α-helix	trans	-66.5	-40.2	177.5	-170.4	175.2	-177.3	151.7	0	112.5	E174 I175 N180 K181 Q182	E174-R178 WeakPolarHBondContact O-CB 3.31Å; E174-R178 PolarHBondContact O-N 3.41Å; I175-R178 PolarHBondContact O-N 2.78Å; R178-N180 VanDerWaalsContact C-N 3.34Å; R178-K181 PolarHBondContact O-N 3.44Å; R178-Q182 WeakPolarHBondContact O-CB 3.38Å; R178-Q182 PolarHBondContact O-N 3.03Å
179	A	79.9	Confident	71.9	Confident	40 Å²	40	101.9 Å²	101.9	33%	0.331	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.3	0	0	0	0	0	111.8	I175 K176 Q182 K183	I175-A179 WeakPolarHBondContact O-CB 3.44Å; I175-A179 PolarHBondContact O-N 3.49Å; K176-A179 PolarHBondContact O-N 2.96Å; A179-Q182 PolarHBondContact O-N 3.38Å; A179-K183 WeakPolarHBondContact O-CG 3.46Å; A179-K183 PolarHBondContact O-N 3.36Å
180	N	79.4	Confident	72	Confident	91 Å²	91	104.4 Å²	104.4	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-47.2	174.9	-75.8	0.2	0	0	0	111.6	K176 E177 R178 Q182 K183 E184	K176-N180 PolarHBondContact O-N 3.43Å; K176-N180 VanDerWaalsContact O-N 3.09Å; E177-N180 PolarHBondContact O-N 3.01Å; R178-N180 VanDerWaalsContact C-N 3.34Å; N180-Q182 VanDerWaalsContact C-N 3.34Å; N180-Q182 PolarHBondContact O-N 2.85Å; N180-K183 PolarHBondContact O-N 3.37Å; N180-E184 PolarHBondContact O-N 2.91Å
181	K	80	Confident	71.9	Confident	109 Å²	109	105.1 Å²	105.1	47%	0.474	53%	0.533	S	S	.	.	H	α-helix	trans	-59.6	-40.7	175.3	-81.5	172.6	171.1	161	0	112.5	E177 R178 E184 I185	E177-K181 PolarHBondContact O-N 3.44Å; E177-K181 IonicContact OE1-NZ 2.6Å; E177-K181 PolarHBondContact OE1-NZ 3.38Å; R178-K181 PolarHBondContact O-N 3.44Å; K181-E184 PolarHBondContact O-N 2.94Å; K181-I185 VanDerWaalsContact O-CG1 3.28Å; K181-I185 WeakPolarHBondContact O-CG1 3.28Å; K181-I185 PolarHBondContact O-N 2.94Å
182	Q	75.7	Confident	71.2	Confident	115 Å²	115	107.3 Å²	107.3	54%	0.537	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.9	-88.5	-176.3	-24.9	0	0	112.2	R178 A179 N180 E184 I185 M186	R178-Q182 WeakPolarHBondContact O-CB 3.38Å; R178-Q182 PolarHBondContact O-N 3.03Å; A179-Q182 PolarHBondContact O-N 3.38Å; N180-Q182 VanDerWaalsContact C-N 3.34Å; N180-Q182 PolarHBondContact O-N 2.85Å; Q182-E184 VanDerWaalsContact C-N 3.3Å; Q182-E184 PolarHBondContact O-N 3.41Å; Q182-I185 PolarHBondContact O-N 3.21Å; Q182-M186 WeakPolarHBondContact O-CB 3.46Å; Q182-M186 VanDerWaalsContact O-CG 3.31Å; Q182-M186 WeakPolarHBondContact O-CG 3.48Å; Q182-M186 PolarHBondContact O-N 3.21Å
183	K	79.2	Confident	70.2	Confident	149 Å²	149	106.5 Å²	106.5	65%	0.648	54%	0.535	S	S	*	.	H	α-helix	trans	-59.6	-42	174.9	-75.3	177.7	179.5	-177.5	0	111.6	A179 N180 M186 S187	A179-K183 WeakPolarHBondContact O-CG 3.46Å; A179-K183 PolarHBondContact O-N 3.36Å; N180-K183 PolarHBondContact O-N 3.37Å; K183-M186 PolarHBondContact O-N 3.04Å; K183-S187 PolarHBondContact O-N 2.93Å; K183-S187 PolarHBondContact O-OG 3.1Å; K183-S187 VanDerWaalsContact O-OG 3.13Å
184	E	78	Confident	68.9	Low	101 Å²	101	108.1 Å²	108.1	47%	0.472	54%	0.543	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.2	-167.2	-177.5	162.6	0	0	112.7	N180 K181 Q182 S187 R188	N180-E184 PolarHBondContact O-N 2.91Å; K181-E184 PolarHBondContact O-N 2.94Å; Q182-E184 VanDerWaalsContact C-N 3.3Å; Q182-E184 PolarHBondContact O-N 3.41Å; E184-S187 WeakPolarHBondContact CA-OG 3.47Å; E184-S187 PolarHBondContact O-N 3.24Å; E184-S187 PolarHBondContact O-OG 3.45Å; E184-R188 PolarHBondContact O-N 2.96Å
185	I	75.8	Confident	67.2	Low	108 Å²	108	108.3 Å²	108.3	55%	0.554	56%	0.561	S	S	*	*	H	α-helix	trans	-66.9	-39.9	176.3	-65.3	163.9	0	0	0	111.1	K181 Q182 S187 R188 T189	K181-I185 VanDerWaalsContact O-CG1 3.28Å; K181-I185 WeakPolarHBondContact O-CG1 3.28Å; K181-I185 PolarHBondContact O-N 2.94Å; Q182-I185 PolarHBondContact O-N 3.21Å; I185-S187 VanDerWaalsContact C-N 3.34Å; I185-R188 PolarHBondContact O-N 2.91Å; I185-T189 PolarHBondContact O-N 3.02Å; I185-T189 PolarHBondContact O-OG1 2.98Å
186	M	65.3	Low	66	Low	136 Å²	136	113.6 Å²	113.6	67%	0.67	58%	0.584	S	S	*	*	H	α-helix	trans	-66.8	-34.9	175.9	-72.5	-174.2	78.2	0	0	112.1	Q182 K183 T189 K190	Q182-M186 WeakPolarHBondContact O-CB 3.46Å; Q182-M186 VanDerWaalsContact O-CG 3.31Å; Q182-M186 WeakPolarHBondContact O-CG 3.48Å; Q182-M186 PolarHBondContact O-N 3.21Å; K183-M186 PolarHBondContact O-N 3.04Å; M186-T189 PolarHBondContact O-OG1 3.29Å; M186-K190 WeakPolarHBondContact O-CB 3.26Å; M186-K190 PolarHBondContact O-N 3.12Å
187	S	75.2	Confident	64.3	Low	63 Å²	63	112.7 Å²	112.7	44%	0.441	59%	0.591	S	S	.	*	H	α-helix	trans	-68.7	-39.1	173.1	49	0	0	0	0	112.3	K183 E184 I185 K190 S191	K183-S187 PolarHBondContact O-N 2.93Å; K183-S187 PolarHBondContact O-OG 3.1Å; K183-S187 VanDerWaalsContact O-OG 3.13Å; E184-S187 WeakPolarHBondContact CA-OG 3.47Å; E184-S187 PolarHBondContact O-N 3.24Å; E184-S187 PolarHBondContact O-OG 3.45Å; I185-S187 VanDerWaalsContact C-N 3.34Å; S187-K190 PolarHBondContact O-N 3.24Å; S187-S191 PolarHBondContact O-N 2.82Å; S187-S191 PolarHBondContact O-OG 3Å
188	R	67.9	Low	62.5	Low	112 Å²	112	113.3 Å²	113.3	42%	0.423	60%	0.604	S	S	.	*	H	α-helix	trans	-66.6	-45.7	177.5	-83.4	-177.7	157.6	163.9	-2.7	113.3	E184 I185 K190 S191 D192	E184-R188 PolarHBondContact O-N 2.96Å; I185-R188 PolarHBondContact O-N 2.91Å; R188-K190 PolarHBondContact O-N 3.22Å; R188-K190 VanDerWaalsContact O-N 3.16Å; R188-S191 PolarHBondContact O-N 3.42Å; R188-S191 VanDerWaalsContact O-N 3.16Å; R188-S191 PolarHBondContact O-OG 3.04Å; R188-D192 PolarHBondContact O-N 3.12Å
189	T	60.5	Low	60.9	Low	92 Å²	92	111.7 Å²	111.7	56%	0.564	62%	0.616	S	S	*	*	H	α-helix	trans	-65.9	-19.6	178.9	44.7	0	0	0	0	113.5	I185 M186	I185-T189 PolarHBondContact O-N 3.02Å; I185-T189 PolarHBondContact O-OG1 2.98Å; M186-T189 PolarHBondContact O-OG1 3.29Å
190	K	62	Low	58.9	Low	177 Å²	177	114.6 Å²	114.6	77%	0.77	64%	0.64	S	S	*	*	H	α-helix	trans	-87.9	-20.2	177	-149.4	172.4	-173.8	179.1	0	113.3	M186 S187 R188	M186-K190 WeakPolarHBondContact O-CB 3.26Å; M186-K190 PolarHBondContact O-N 3.12Å; S187-K190 PolarHBondContact O-N 3.24Å; R188-K190 PolarHBondContact O-N 3.22Å; R188-K190 VanDerWaalsContact O-N 3.16Å
191	S	57.2	Low	56.8	Low	75 Å²	75	116.4 Å²	116.4	52%	0.524	66%	0.657	S	S	.	*	H	α-helix	trans	-88	-24.2	173.8	51.9	0	0	0	0	113.5	S187 R188	S187-S191 PolarHBondContact O-N 2.82Å; S187-S191 PolarHBondContact O-OG 3Å; R188-S191 PolarHBondContact O-N 3.42Å; R188-S191 VanDerWaalsContact O-N 3.16Å; R188-S191 PolarHBondContact O-OG 3.04Å
192	D	52.6	Low	54.8	Low	109 Å²	109	116 Å²	116	58%	0.583	67%	0.673	S	S	*	*			trans	-95.8	6.4	-171.1	-72.2	-16.8	0	0	0	116	R188 P194	R188-D192 PolarHBondContact O-N 3.12Å; D192-P194 WeakPolarHBondContact O-CD 3.47Å
193	T	42.5	Very low	53.1	Low	105 Å²	105	116 Å²	116	64%	0.644	69%	0.686	S	S	*	*			trans	-80.2	111.7	168.6	41.8	0	0	0	0	110.5	A195	T193-A195 PolarHBondContact O-N 2.84Å; T193-A195 VanDerWaalsContact O-N 3.16Å
194	P	42.7	Very low	50.9	Low	120 Å²	120	118.8 Å²	118.8	78%	0.779	70%	0.698	S	S	*	*			trans	-71.7	112.1	176.9	-9	27.2	0	0	0	108.7	D192 E196	D192-P194 WeakPolarHBondContact O-CD 3.47Å; P194-E196 PolarHBondContact O-N 3.3Å
195	A	41.2	Very low	49.1	Very low	99 Å²	99	118.6 Å²	118.6	82%	0.818	71%	0.714	S	S	*	*			trans	-73.2	89.2	176.3	0	0	0	0	0	110.7	T193 T197	T193-A195 PolarHBondContact O-N 2.84Å; T193-A195 VanDerWaalsContact O-N 3.16Å; A195-T197 PolarHBondContact O-N 3.39Å; A195-T197 VanDerWaalsContact O-N 3.09Å
196	E	42.3	Very low	47.4	Very low	183 Å²	183	118.8 Å²	118.8	86%	0.855	72%	0.722	S	S	*	*			trans	-70.2	95.1	156.2	-79.6	-173.2	156.7	0	0	109.2	P194	P194-E196 PolarHBondContact O-N 3.3Å
197	T	40.1	Very low	45.8	Very low	127 Å²	127	121.3 Å²	121.3	78%	0.779	73%	0.733	S	S	*	*			trans	24.3	151.6	137.1	36.6	0	0	0	0	122.6	A195	A195-T197 PolarHBondContact O-N 3.39Å; A195-T197 VanDerWaalsContact O-N 3.09Å
198	P	42	Very low	44.2	Very low	117 Å²	117	124.5 Å²	124.5	76%	0.76	75%	0.75	S	S	*	*				-129.1	161.9	-120	40.3	-24.7	0	0	0	114.1
199	S	38.7	Very low	43	Very low	118 Å²	118	126.4 Å²	126.4	83%	0.825	77%	0.767	S	S	*	*			trans	-174.9	115.8	154.3	54.7	0	0	0	0	112.2
200	A	39.3	Very low	42.2	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	77%	0.774	S	S	*	*				158.3	130.1	129.9	0	0	0	0	0	111.5
201	P	34.1	Very low	41.1	Very low	130 Å²	130	125.5 Å²	125.5	84%	0.844	77%	0.773	S	S	*	*			trans	-101.9	128	-176.7	36.6	-27.9	0	0	0	112.2
202	A	38.3	Very low	40.2	Very low	99 Å²	99	131.7 Å²	131.7	82%	0.818	79%	0.785	S	S	*	*			trans	-174	140.6	163.6	0	0	0	0	0	107.1
203	S	40.7	Very low	39.4	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	80%	0.796	S	S	*	*			cis	-171.8	147.5	8.2	37	0	0	0	0	107.3
204	K	32.1	Very low	39.4	Very low	207 Å²	207	130.5 Å²	130.5	90%	0.9	79%	0.792	S	S	*	*			trans	-59.6	145.5	179.2	-62.1	159.1	175.9	168.6	0	113.7
205	A	41.3	Very low	39.3	Very low	97 Å²	97	132.2 Å²	132.2	80%	0.802	80%	0.795	S	S	*	*			trans	-163.6	152.7	138.7	0	0	0	0	0	110.6
206	P	38.9	Very low	39.3	Very low	113 Å²	113	137.2 Å²	137.2	73%	0.734	79%	0.793	S	S	*	*			trans	-102.7	145.7	-139.6	36.6	-31.2	0	0	0	115	T208	P206-T208 PolarHBondContact O-N 3.19Å
207	E	32.6	Very low	39.6	Very low	189 Å²	189	132.4 Å²	132.4	88%	0.883	79%	0.792	S	S	*	*			trans	-72.2	119.1	164.1	-67	-178.2	168.6	0	0	110.4
208	T	40.1	Very low	39.8	Very low	130 Å²	130	132 Å²	132	80%	0.798	79%	0.785	S	S	*	*			trans	-110.1	95.6	160.5	47.9	0	0	0	0	108.5	P206	P206-T208 PolarHBondContact O-N 3.19Å
209	L	44.3	Very low	39.8	Very low	152 Å²	152	135.1 Å²	135.1	80%	0.796	79%	0.794	S	S	*	*			trans	-73.2	164.3	141.9	-78.5	166	0	0	0	107.7
210	P	42.4	Very low	40.3	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	79%	0.787	S	S	*	*			cis	-145.4	158.9	22.5	37.9	-17.6	0	0	0	116
211	D	40.2	Very low	40.5	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	79%	0.787	S	S	*	*			trans	-170.8	109.2	132.8	-123	-9.6	0	0	0	112.8
212	R	38	Very low	40.7	Very low	206 Å²	206	136.6 Å²	136.6	78%	0.777	78%	0.782	S	S	*	*				65.6	76	121.9	-153.6	172.7	-171.6	165	1.1	119.2
213	G	36.5	Very low	40.6	Very low	79 Å²	79	140.4 Å²	140.4	81%	0.814	78%	0.783	S	S	*	*			trans	-115	104.7	147.3	0	0	0	0	0	108.9	D215	G213-D215 PolarHBondContact O-N 2.78Å
214	I	40.7	Very low	40.3	Very low	109 Å²	109	143 Å²	143	56%	0.559	79%	0.788	S	S	*	*			trans	-82.3	108.9	176.1	-54.4	157.2	0	0	0	107.1	W216	I214-W216 HydrophobicContact CG2-CD2 3.86Å; I214-W216 VanDerWaalsContact CG2-CE2 3.49Å; I214-W216 HydrophobicContact CG2-CG 3.7Å; I214-W216 HydrophobicContact CG2-CZ2 4.21Å
215	D	41.2	Very low	40.8	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	79%	0.785	S	S	*	*			trans	-92.5	93	164.6	-165.4	11.1	0	0	0	107.7	G213 G217	G213-D215 PolarHBondContact O-N 2.78Å; D215-G217 PolarHBondContact O-N 3.13Å
216	W	41.1	Very low	40.8	Very low	204 Å²	204	145.2 Å²	145.2	77%	0.773	79%	0.785	S	S	*	*			trans	-74.1	107.4	175	-76.5	106.9	0	0	0	107.5	I214 L218	I214-W216 HydrophobicContact CG2-CD2 3.86Å; I214-W216 VanDerWaalsContact CG2-CE2 3.49Å; I214-W216 HydrophobicContact CG2-CG 3.7Å; I214-W216 HydrophobicContact CG2-CZ2 4.21Å; W216-L218 PolarHBondContact O-N 2.62Å
217	G	49.1	Very low	40.6	Very low	82 Å²	82	147 Å²	147	85%	0.845	79%	0.789	S	S	*	*	S	Bend	trans	-53.1	76.3	170.8	0	0	0	0	0	113.3	D215	D215-G217 PolarHBondContact O-N 3.13Å
218	L	43.7	Very low	41	Very low	117 Å²	117	144.5 Å²	144.5	61%	0.613	78%	0.781	S	S	*	*			trans	-162.3	59.5	-174.2	-160.3	78	0	0	0	110.4	W216 Y221	W216-L218 PolarHBondContact O-N 2.62Å; L218-Y221 HydrophobicContact CD1-CD2 3.95Å; L218-Y221 HydrophobicContact CD1-CE2 3.71Å
219	L	43.2	Very low	40.8	Very low	184 Å²	184	144.9 Å²	144.9	96%	0.963	78%	0.778	S	S	*	*			trans	-134.9	50	137.6	-92.3	166.9	0	0	0	107.8
220	S	48.1	Very low	40.8	Very low	97 Å²	97	144.5 Å²	144.5	68%	0.678	78%	0.777	S	S	*	*			trans	-109.7	77.7	162.6	150.4	0	0	0	0	105.1
221	Y	44.1	Very low	40.9	Very low	208 Å²	208	146 Å²	146	82%	0.816	78%	0.779	S	S	*	*			trans	-157.8	107.8	164.4	-88.5	-72.2	0	0	0	109.2	L218	L218-Y221 HydrophobicContact CD1-CD2 3.95Å; L218-Y221 HydrophobicContact CD1-CE2 3.71Å
222	G	37.2	Very low	41.2	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	79%	0.786	S	S	*	*			trans	97.6	77.7	158.2	0	0	0	0	0	115.2
223	E	37.9	Very low	41.3	Very low	179 Å²	179	145 Å²	145	84%	0.836	78%	0.779	S	S	*	*			trans	-158.8	121.9	133.1	-109.1	161.3	-163.5	0	0	108	E225	E223-E225 PolarHBondContact O-N 3.48Å
224	D	34.5	Very low	41.6	Very low	172 Å²	172	145.9 Å²	145.9	92%	0.92	77%	0.772	S	S	*	*			trans	-64.5	93.4	173.9	-60.5	-55.1	0	0	0	108	E226	D224-E226 PolarHBondContact O-N 2.73Å
225	E	42.8	Very low	41.8	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	78%	0.779	S	S	*	*			trans	-90.3	101.4	166.5	-76.7	-170	166.1	0	0	108.6	E223 N227	E223-E225 PolarHBondContact O-N 3.48Å; E225-N227 PolarHBondContact O-N 3.12Å
226	E	41.2	Very low	41.8	Very low	174 Å²	174	146 Å²	146	81%	0.813	77%	0.773	S	S	*	*			trans	-41.2	126.9	158.9	-71.6	175.8	150.9	0	0	109.8	D224 N228	D224-E226 PolarHBondContact O-N 2.73Å; E226-N228 PolarHBondContact O-N 2.69Å
227	N	33.8	Very low	41.9	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	77%	0.77	S	S	*	*			trans	-47.4	106.1	169.8	-61.9	-64.7	0	0	0	109.9	E225	E225-N227 PolarHBondContact O-N 3.12Å
228	N	40.2	Very low	41.3	Very low	136 Å²	136	143.9 Å²	143.9	73%	0.727	77%	0.765	S	S	*	*			trans	-113.1	97.3	156.5	-89.9	-44.9	0	0	0	107.2	E226 D230	E226-N228 PolarHBondContact O-N 2.69Å; N228-D230 VanDerWaalsContact C-N 3.33Å; N228-D230 PolarHBondContact O-N 2.78Å
229	D	37.2	Very low	41.2	Very low	137 Å²	137	144.6 Å²	144.6	73%	0.733	77%	0.77	S	S	*	*			trans	-58.4	92.4	162.3	-67.5	-53.5	0	0	0	109
230	D	43.2	Very low	41.4	Very low	144 Å²	144	140.1 Å²	140.1	77%	0.77	77%	0.768	S	S	*	*			trans	-103.3	81.3	165.2	-87.2	-32.4	0	0	0	109	N228 Q232	N228-D230 VanDerWaalsContact C-N 3.33Å; N228-D230 PolarHBondContact O-N 2.78Å; D230-Q232 PolarHBondContact O-N 3.21Å; D230-Q232 VanDerWaalsContact O-N 3.07Å
231	D	45.7	Very low	41.2	Very low	141 Å²	141	142.9 Å²	142.9	75%	0.754	77%	0.77	S	S	*	*			trans	-59.2	100.6	166.4	-73.6	-51	0	0	0	110.3	E233	D231-E233 VanDerWaalsContact C-N 3.35Å; D231-E233 PolarHBondContact O-N 2.82Å; D231-E233 VanDerWaalsContact O-N 3.15Å
232	Q	45.8	Very low	41.3	Very low	190 Å²	190	139.4 Å²	139.4	89%	0.888	76%	0.761	S	S	*	*			trans	-79.8	87.2	161.7	-74.9	-175.6	28.2	0	0	109.3	D230 S234	D230-Q232 PolarHBondContact O-N 3.21Å; D230-Q232 VanDerWaalsContact O-N 3.07Å; Q232-S234 PolarHBondContact O-N 3.41Å
233	E	39.7	Very low	41.7	Very low	135 Å²	135	140.5 Å²	140.5	63%	0.631	75%	0.749	S	S	*	*			trans	-64.7	114.3	170.8	-72.3	-174.8	146.4	0	0	111.1	D231	D231-E233 VanDerWaalsContact C-N 3.35Å; D231-E233 PolarHBondContact O-N 2.82Å; D231-E233 VanDerWaalsContact O-N 3.15Å
234	S	43.3	Very low	42.5	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	73%	0.728	S	S	*	*			trans	-93.4	107.9	156.7	50.7	0	0	0	0	108.1	Q232 H236	Q232-S234 PolarHBondContact O-N 3.41Å; S234-H236 PolarHBondContact O-N 2.78Å
235	V	44.2	Very low	43.2	Very low	115 Å²	115	133 Å²	133	70%	0.697	71%	0.713	S	S	*	*			trans	-68.6	104.8	176	-177.5	0	0	0	0	108.2
236	H	41.7	Very low	43.9	Very low	155 Å²	155	130.9 Å²	130.9	72%	0.718	70%	0.703	S	S	*	*			trans	-107.4	106.1	167.7	-87.6	-66.2	0	0	0	109.4	S234	S234-H236 PolarHBondContact O-N 2.78Å
237	S	42.4	Very low	45	Very low	100 Å²	100	126.6 Å²	126.6	70%	0.699	68%	0.683	S	S	*	*			trans	-61.3	133.2	168.4	41.4	0	0	0	0	111.1	D239	S237-D239 PolarHBondContact O-N 2.88Å; S237-D239 VanDerWaalsContact O-N 3.15Å
238	D	37.3	Very low	46.3	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	66%	0.664	S	S	*	*			trans	-71.1	87	180	-176.1	35.8	0	0	0	110.8
239	D	41.7	Very low	47.4	Very low	133 Å²	133	121.1 Å²	121.1	71%	0.711	65%	0.65	S	S	*	*	S	Bend	trans	-143.8	93	163	-79.5	-49.3	0	0	0	108.2	S237 E241	S237-D239 PolarHBondContact O-N 2.88Å; S237-D239 VanDerWaalsContact O-N 3.15Å; D239-E241 WeakPolarHBondContact O-CG 3.44Å; D239-E241 PolarHBondContact O-N 3.12Å
240	G	47.8	Very low	48.9	Very low	90 Å²	90	119.8 Å²	119.8	93%	0.928	64%	0.639	S	S	*	*			trans	47.9	5.6	144.8	0	0	0	0	0	123.1
241	E	43.7	Very low	50.1	Low	155 Å²	155	115.3 Å²	115.3	72%	0.724	61%	0.612	S	S	*	*			trans	-110.2	119.5	-165.8	-68	-173.5	-177.1	0	0	113.1	D239	D239-E241 WeakPolarHBondContact O-CG 3.44Å; D239-E241 PolarHBondContact O-N 3.12Å
242	E	47	Very low	51.5	Low	134 Å²	134	112.2 Å²	112.2	63%	0.626	59%	0.593	S	S	*	*			trans	23.3	103.7	155	-65.5	172.3	179.8	0	0	117.8	S244	E242-S244 PolarHBondContact O-N 3.07Å
243	I	45.5	Very low	52.9	Low	96 Å²	96	108.4 Å²	108.4	49%	0.492	58%	0.575	S	S	.	*			trans	-51.4	115.2	170.4	-55.2	164.9	0	0	0	108.8	Q247 L248	I243-Q247 HydrophobicContact CG2-CB 3.8Å; I243-L248 HydrophobicContact CB-CD1 4.29Å; I243-L248 HydrophobicContact CG2-CD1 4.04Å; I243-L248 HydrophobicContact CG2-CG 3.89Å
244	S	53.4	Low	54.7	Low	57 Å²	57	106.6 Å²	106.6	40%	0.399	56%	0.563	S	S	.	*			trans	-60.4	145.6	179.8	74.8	0	0	0	0	110.7	E242 E246 Q247 L248	E242-S244 PolarHBondContact O-N 3.07Å; S244-E246 PolarHBondContact O-N 3.48Å; S244-E246 VanDerWaalsContact O-N 3.08Å; S244-Q247 WeakPolarHBondContact O-CA 3.45Å; S244-Q247 WeakPolarHBondContact O-CB 3.49Å; S244-Q247 PolarHBondContact O-N 3.44Å; S244-Q247 PolarHBondContact OG-N 2.76Å; S244-L248 PolarHBondContact O-N 2.93Å
245	F	49	Very low	56.7	Low	137 Å²	137	102.3 Å²	102.3	60%	0.601	53%	0.532	S	S	*	.	H	α-helix	trans	-52.2	-33.9	178.7	177.5	-99.5	0	0	0	112.6	L248 E249	F245-L248 WeakPolarHBondContact O-CB 3.43Å; F245-L248 PolarHBondContact O-N 3.49Å; F245-E249 HydrophobicContact CD1-CG 4.38Å; F245-E249 HydrophobicContact CE1-CG 3.89Å; F245-E249 WeakPolarHBondContact CE1-OE1 3.48Å; F245-E249 HydrophobicContact CZ-CG 3.99Å; F245-E249 WeakPolarHBondContact CZ-OE1 3.47Å; F245-E249 PolarHBondContact O-N 3.19Å
246	E	59	Low	58.6	Low	132 Å²	132	100.2 Å²	100.2	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-70.3	-36.8	177.5	-161.6	161.4	-164.6	0	0	112.3	S244 L248 E249 Q250	S244-E246 PolarHBondContact O-N 3.48Å; S244-E246 VanDerWaalsContact O-N 3.08Å; E246-L248 VanDerWaalsContact C-N 3.33Å; E246-E249 PolarHBondContact O-N 2.76Å; E246-Q250 WeakPolarHBondContact O-CB 3.5Å; E246-Q250 WeakPolarHBondContact O-CG 3.23Å; E246-Q250 PolarHBondContact O-N 3Å
247	Q	62.6	Low	60.6	Low	84 Å²	84	99.1 Å²	99.1	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-32.4	169.4	-81.6	177.3	-7.8	0	0	112	I243 S244 R251	I243-Q247 HydrophobicContact CG2-CB 3.8Å; S244-Q247 WeakPolarHBondContact O-CA 3.45Å; S244-Q247 WeakPolarHBondContact O-CB 3.49Å; S244-Q247 PolarHBondContact O-N 3.44Å; S244-Q247 PolarHBondContact OG-N 2.76Å; Q247-R251 VanDerWaalsContact O-CB 3.26Å; Q247-R251 WeakPolarHBondContact O-CB 3.44Å; Q247-R251 WeakPolarHBondContact O-CG 3.32Å; Q247-R251 PolarHBondContact O-N 3.43Å
248	L	61.5	Low	62.8	Low	80 Å²	80	97.9 Å²	97.9	42%	0.419	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-46	171.9	-88.5	142.7	0	0	0	111.5	I243 S244 F245 E246 Q250 R251 E252	I243-L248 HydrophobicContact CB-CD1 4.29Å; I243-L248 HydrophobicContact CG2-CD1 4.04Å; I243-L248 HydrophobicContact CG2-CG 3.89Å; S244-L248 PolarHBondContact O-N 2.93Å; F245-L248 WeakPolarHBondContact O-CB 3.43Å; F245-L248 PolarHBondContact O-N 3.49Å; E246-L248 VanDerWaalsContact C-N 3.33Å; L248-Q250 PolarHBondContact O-N 3.36Å; L248-R251 CarbonylContact O-C 3.55Å; L248-R251 WeakPolarHBondContact O-CA 3.18Å; L248-R251 VanDerWaalsContact O-CB 3.27Å; L248-R251 WeakPolarHBondContact O-CB 3.37Å; L248-R251 PolarHBondContact O-N 2.68Å; L248-E252 VanDerWaalsContact O-CG 3.32Å; L248-E252 WeakPolarHBondContact O-CG 3.28Å; L248-E252 PolarHBondContact O-N 3.45Å
249	E	64.5	Low	65.3	Low	91 Å²	91	91.7 Å²	91.7	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-42.9	175.5	-76.6	-170.8	159.9	0	0	111.8	F245 E246 R251 E252 Q253	F245-E249 HydrophobicContact CD1-CG 4.38Å; F245-E249 HydrophobicContact CE1-CG 3.89Å; F245-E249 WeakPolarHBondContact CE1-OE1 3.48Å; F245-E249 HydrophobicContact CZ-CG 3.99Å; F245-E249 WeakPolarHBondContact CZ-OE1 3.47Å; F245-E249 PolarHBondContact O-N 3.19Å; E246-E249 PolarHBondContact O-N 2.76Å; E249-R251 PolarHBondContact O-N 3.09Å; E249-E252 PolarHBondContact O-N 2.6Å; E249-E252 VanDerWaalsContact O-N 3.13Å; E249-Q253 WeakPolarHBondContact O-CB 3.31Å; E249-Q253 WeakPolarHBondContact O-CG 3.38Å; E249-Q253 PolarHBondContact O-N 3.33Å
250	Q	67.3	Low	67.6	Low	109 Å²	109	90 Å²	90	51%	0.509	46%	0.456	S	S	.	.	H	α-helix	trans	-62.7	-31.8	171.9	-70.4	173	20.9	0	0	112	E246 L248 R336	E246-Q250 WeakPolarHBondContact O-CB 3.5Å; E246-Q250 WeakPolarHBondContact O-CG 3.23Å; E246-Q250 PolarHBondContact O-N 3Å; L248-Q250 PolarHBondContact O-N 3.36Å; Q250-R336 PolarHBondContact O-NH2 3.37Å
251	R	68.2	Low	69.6	Low	51 Å²	51	91.5 Å²	91.5	19%	0.192	44%	0.436	C	S	.	.	H	α-helix	trans	-67.2	-41.8	172.5	-79.1	172.3	105.3	90.8	5.3	111.2	Q247 L248 E249 Y255 R336	Q247-R251 VanDerWaalsContact O-CB 3.26Å; Q247-R251 WeakPolarHBondContact O-CB 3.44Å; Q247-R251 WeakPolarHBondContact O-CG 3.32Å; Q247-R251 PolarHBondContact O-N 3.43Å; L248-R251 CarbonylContact O-C 3.55Å; L248-R251 WeakPolarHBondContact O-CA 3.18Å; L248-R251 VanDerWaalsContact O-CB 3.27Å; L248-R251 WeakPolarHBondContact O-CB 3.37Å; L248-R251 PolarHBondContact O-N 2.68Å; E249-R251 PolarHBondContact O-N 3.09Å; R251-Y255 WeakPolarHBondContact O-CD1 3.42Å; R251-Y255 WeakPolarHBondContact O-CE1 3.47Å; R251-R336 VanDerWaalsContact C-NH2 3.31Å; R251-R336 PolarHBondContact O-NH2 3.28Å
252	E	75	Confident	71.7	Confident	76 Å²	76	84.4 Å²	84.4	36%	0.355	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-39.9	178.2	-58.2	-150.3	148.4	0	0	112.7	L248 E249 Y254 Y255 V256	L248-E252 VanDerWaalsContact O-CG 3.32Å; L248-E252 WeakPolarHBondContact O-CG 3.28Å; L248-E252 PolarHBondContact O-N 3.45Å; E249-E252 PolarHBondContact O-N 2.6Å; E249-E252 VanDerWaalsContact O-N 3.13Å; E252-Y254 PolarHBondContact O-N 2.85Å; E252-Y255 VanDerWaalsContact CA-CE1 3.48Å; E252-Y255 HydrophobicContact CB-CE1 4.43Å; E252-Y255 WeakPolarHBondContact CG-OH 3.42Å; E252-Y255 PolarHBondContact O-N 3.02Å; E252-Y255 VanDerWaalsContact O-N 3.12Å; E252-V256 HydrophobicContact CB-CG2 4.1Å; E252-V256 WeakPolarHBondContact O-CB 3.31Å; E252-V256 WeakPolarHBondContact O-CG2 3.32Å; E252-V256 PolarHBondContact O-N 3.48Å
253	Q	76.9	Confident	73.7	Confident	109 Å²	109	78 Å²	78	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-55.3	-30.6	-176.7	-78.1	170.7	18.4	0	0	114.2	E249 Y255 N257	E249-Q253 WeakPolarHBondContact O-CB 3.31Å; E249-Q253 WeakPolarHBondContact O-CG 3.38Å; E249-Q253 PolarHBondContact O-N 3.33Å; Q253-Y255 VanDerWaalsContact C-N 3.35Å; Q253-Y255 PolarHBondContact O-N 3.46Å; Q253-N257 PolarHBondContact O-ND2 3.34Å
254	Y	77.4	Confident	75.8	Confident	97 Å²	97	78.6 Å²	78.6	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-35.2	-180	178.1	-100.4	0	0	0	114	E252 A262	E252-Y254 PolarHBondContact O-N 2.85Å; Y254-A262 HydrophobicContact CD1-CB 4.41Å; Y254-A262 HydrophobicContact CE1-CB 4.13Å
255	Y	84	Confident	77.4	Confident	7 Å²	7	81.1 Å²	81.1	3%	0.027	37%	0.374	C	S	.	.	H	α-helix	trans	-110	-14.9	-178.5	60.9	-95	0	0	0	112.9	R251 E252 Q253 D258 P259 C326 R327 D330 L335	R251-Y255 WeakPolarHBondContact O-CD1 3.42Å; R251-Y255 WeakPolarHBondContact O-CE1 3.47Å; E252-Y255 VanDerWaalsContact CA-CE1 3.48Å; E252-Y255 HydrophobicContact CB-CE1 4.43Å; E252-Y255 WeakPolarHBondContact CG-OH 3.42Å; E252-Y255 PolarHBondContact O-N 3.02Å; E252-Y255 VanDerWaalsContact O-N 3.12Å; Q253-Y255 VanDerWaalsContact C-N 3.35Å; Q253-Y255 PolarHBondContact O-N 3.46Å; Y255-D258 CarbonylContact O-C 3.58Å; Y255-P259 WeakPolarHBondContact O-CA 3.44Å; Y255-P259 VanDerWaalsContact O-CB 3.28Å; Y255-P259 WeakPolarHBondContact O-CB 3.33Å; Y255-P259 WeakPolarHBondContact O-CD 3.47Å; Y255-C326 HydrophobicContact CD1-CB 4.26Å; Y255-C326 HydrophobicContact CD2-CB 3.58Å; Y255-C326 HydrophobicContact CE2-CB 4.17Å; Y255-C326 HydrophobicContact CG-CB 3.61Å; Y255-R327 HydrophobicContact CE2-CG 3.86Å; Y255-D330 WeakPolarHBondContact CD1-OD2 3.36Å; Y255-D330 WeakPolarHBondContact CE1-OD2 3.45Å; Y255-L335 HydrophobicContact CD1-CD2 4.13Å
256	V	85.6	Confident	79.2	Confident	72 Å²	72	74.8 Å²	74.8	44%	0.436	35%	0.346	S	S	.	.	H	α-helix	trans	-64.1	-40.2	174.8	167.9	0	0	0	0	111.5	E252	E252-V256 HydrophobicContact CB-CG2 4.1Å; E252-V256 WeakPolarHBondContact O-CB 3.31Å; E252-V256 WeakPolarHBondContact O-CG2 3.32Å; E252-V256 PolarHBondContact O-N 3.48Å
257	N	83.3	Confident	80.5	Confident	132 Å²	132	68.9 Å²	68.9	71%	0.706	32%	0.319	S	S	*	.	S	Bend	trans	-69.4	-36.1	-179.7	-68.3	-22.9	0	0	0	112.8	Q253	Q253-N257 PolarHBondContact O-ND2 3.34Å
258	D	87.8	Confident	81.7	Confident	74 Å²	74	71.3 Å²	71.3	40%	0.396	33%	0.33	S	S	.	.			trans	-149.4	67.5	-174	-94.6	-38	0	0	0	112	Y255 R260 K261 A262	Y255-D258 CarbonylContact O-C 3.58Å; D258-R260 PolarHBondContact O-N 2.94Å; D258-R260 VanDerWaalsContact O-N 3.14Å; D258-K261 HydrophobicContact CB-CB 4.16Å; D258-K261 HydrophobicContact CB-CD 4.06Å; D258-K261 HydrophobicContact CB-CG 4.21Å; D258-K261 PolarHBondContact O-N 2.87Å; D258-K261 IonicContact OD1-NZ 3.08Å; D258-K261 WeakPolarHBondContact OD2-CD 3.36Å; D258-K261 WeakPolarHBondContact OD2-CE 3.2Å; D258-K261 IonicContact OD2-NZ 2.74Å; D258-K261 PolarHBondContact OD2-NZ 2.87Å; D258-A262 PolarHBondContact O-N 3.26Å; D258-A262 VanDerWaalsContact O-N 3.1Å
259	P	90.7	Very high	82.7	Confident	9 Å²	9	72.6 Å²	72.6	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-32	-172.1	23.6	-33.2	0	0	0	111.7	Y255 K261 L263 T319 A322 L323	Y255-P259 WeakPolarHBondContact O-CA 3.44Å; Y255-P259 VanDerWaalsContact O-CB 3.28Å; Y255-P259 WeakPolarHBondContact O-CB 3.33Å; Y255-P259 WeakPolarHBondContact O-CD 3.47Å; P259-K261 PolarHBondContact O-N 3.13Å; P259-L263 VanDerWaalsContact O-CB 3.27Å; P259-L263 WeakPolarHBondContact O-CB 3.35Å; P259-L263 PolarHBondContact O-N 2.81Å; P259-T319 HydrophobicContact CG-CG2 3.66Å; P259-A322 HydrophobicContact CB-CB 4.06Å; P259-L323 HydrophobicContact CB-CB 4.13Å; P259-L323 HydrophobicContact CG-CB 4.47Å
260	R	89.9	Confident	83.5	Confident	99 Å²	99	72.8 Å²	72.8	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-67.8	-34.3	178.1	-63	175.9	69.1	-149	1.9	112.7	D258 R264 M318 A322	D258-R260 PolarHBondContact O-N 2.94Å; D258-R260 VanDerWaalsContact O-N 3.14Å; R260-R264 VanDerWaalsContact O-CB 3.32Å; R260-R264 WeakPolarHBondContact O-CB 3.27Å; R260-R264 PolarHBondContact O-N 2.88Å; R260-M318 PolarHBondContact NE-SD 3.5Å; R260-M318 PolarHBondContact NH2-SD 3.49Å; R260-A322 HydrophobicContact CG-CB 4.08Å
261	K	88.9	Confident	84	Confident	121 Å²	121	70.7 Å²	70.7	53%	0.526	34%	0.338	S	S	.	.	H	α-helix	trans	-79.1	-41.3	178.2	-64.2	-177.9	-170.6	155.9	0	110.6	D258 P259 L263 R264 K265	D258-K261 HydrophobicContact CB-CB 4.16Å; D258-K261 HydrophobicContact CB-CD 4.06Å; D258-K261 HydrophobicContact CB-CG 4.21Å; D258-K261 PolarHBondContact O-N 2.87Å; D258-K261 IonicContact OD1-NZ 3.08Å; D258-K261 WeakPolarHBondContact OD2-CD 3.36Å; D258-K261 WeakPolarHBondContact OD2-CE 3.2Å; D258-K261 IonicContact OD2-NZ 2.74Å; D258-K261 PolarHBondContact OD2-NZ 2.87Å; P259-K261 PolarHBondContact O-N 3.13Å; K261-L263 VanDerWaalsContact C-N 3.32Å; K261-L263 PolarHBondContact O-N 2.98Å; K261-R264 PolarHBondContact O-N 3.01Å; K261-K265 WeakPolarHBondContact O-CB 3.5Å; K261-K265 WeakPolarHBondContact O-CG 3.31Å; K261-K265 PolarHBondContact O-N 3.37Å
262	A	88.1	Confident	84.5	Confident	5 Å²	5	73.2 Å²	73.2	4%	0.041	35%	0.352	C	S	.	.	H	α-helix	trans	-57.2	-47.6	176.2	0	0	0	0	0	111.2	Y254 D258 F266	Y254-A262 HydrophobicContact CD1-CB 4.41Å; Y254-A262 HydrophobicContact CE1-CB 4.13Å; D258-A262 PolarHBondContact O-N 3.26Å; D258-A262 VanDerWaalsContact O-N 3.1Å; A262-F266 PolarHBondContact O-N 3.37Å
263	L	89.5	Confident	84.8	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-44.3	177.9	-164.6	156.5	0	0	0	112.2	P259 K261 K265 F266 F267 L274 A322 A325	P259-L263 VanDerWaalsContact O-CB 3.27Å; P259-L263 WeakPolarHBondContact O-CB 3.35Å; P259-L263 PolarHBondContact O-N 2.81Å; K261-L263 VanDerWaalsContact C-N 3.32Å; K261-L263 PolarHBondContact O-N 2.98Å; L263-K265 PolarHBondContact O-N 3.35Å; L263-F266 WeakPolarHBondContact O-CB 3.38Å; L263-F266 PolarHBondContact O-N 2.94Å; L263-F266 VanDerWaalsContact O-N 3.09Å; L263-F267 HydrophobicContact CD2-CD2 3.39Å; L263-F267 HydrophobicContact CD2-CE2 3.42Å; L263-F267 VanDerWaalsContact CD2-CE2 3.42Å; L263-F267 HydrophobicContact CD2-CG 4.43Å; L263-F267 HydrophobicContact CD2-CZ 4.47Å; L263-F267 HydrophobicContact CG-CD2 4.05Å; L263-F267 HydrophobicContact CG-CE2 3.94Å; L263-F267 WeakPolarHBondContact O-CD2 3.33Å; L263-F267 PolarHBondContact O-N 3.4Å; L263-L274 HydrophobicContact CD2-CD1 3.21Å; L263-L274 HydrophobicContact CD2-CD2 3.51Å; L263-L274 HydrophobicContact CD2-CG 3.97Å; L263-A322 HydrophobicContact CD1-CB 3.99Å; L263-A325 HydrophobicContact CD1-CB 3.24Å; L263-A325 HydrophobicContact CG-CB 4.45Å
264	R	88.4	Confident	85.2	Confident	108 Å²	108	73.4 Å²	73.4	41%	0.408	35%	0.353	S	S	.	.	H	α-helix	trans	-60.3	-45.3	177.7	-160.9	-172.5	-50.8	-90.6	-7	112.1	R260 K261 F266 F267 E268	R260-R264 VanDerWaalsContact O-CB 3.32Å; R260-R264 WeakPolarHBondContact O-CB 3.27Å; R260-R264 PolarHBondContact O-N 2.88Å; K261-R264 PolarHBondContact O-N 3.01Å; R264-F266 VanDerWaalsContact C-N 3.27Å; R264-F266 PolarHBondContact O-N 3.41Å; R264-F267 PolarHBondContact O-N 2.99Å; R264-E268 WeakPolarHBondContact CG-OE1 3.41Å; R264-E268 WeakPolarHBondContact O-CB 3.49Å; R264-E268 WeakPolarHBondContact O-CG 3.33Å; R264-E268 PolarHBondContact O-N 3.48Å
265	K	86.7	Confident	85.6	Confident	111 Å²	111	74.5 Å²	74.5	48%	0.483	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-38.4	173.9	-74.4	-176.5	176.3	-173.6	0	111.7	K261 L263 R269	K261-K265 WeakPolarHBondContact O-CB 3.5Å; K261-K265 WeakPolarHBondContact O-CG 3.31Å; K261-K265 PolarHBondContact O-N 3.37Å; L263-K265 PolarHBondContact O-N 3.35Å; K265-R269 VanDerWaalsContact O-CG 3.29Å; K265-R269 WeakPolarHBondContact O-CG 3.09Å; K265-R269 PolarHBondContact O-N 3.09Å; K265-R269 VanDerWaalsContact O-N 3.17Å; K265-R269 PolarHBondContact O-NE 3.47Å
266	F	86.9	Confident	85.9	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-63.8	-50.4	176.8	176.1	-93.4	0	0	0	111.9	A262 L263 R264 E268 R269 E270 P295 L329 I334 L335	A262-F266 PolarHBondContact O-N 3.37Å; L263-F266 WeakPolarHBondContact O-CB 3.38Å; L263-F266 PolarHBondContact O-N 2.94Å; L263-F266 VanDerWaalsContact O-N 3.09Å; R264-F266 VanDerWaalsContact C-N 3.27Å; R264-F266 PolarHBondContact O-N 3.41Å; F266-E268 VanDerWaalsContact C-N 3.33Å; F266-E268 PolarHBondContact O-N 2.88Å; F266-R269 VanDerWaalsContact N-NH2 3.16Å; F266-R269 WeakPolarHBondContact O-CB 3.49Å; F266-R269 PolarHBondContact O-N 3.04Å; F266-E270 HydrophobicContact CD1-CG 4.37Å; F266-E270 HydrophobicContact CD2-CG 4.43Å; F266-E270 HydrophobicContact CE1-CG 3.77Å; F266-E270 HydrophobicContact CE2-CG 3.86Å; F266-E270 HydrophobicContact CZ-CG 3.49Å; F266-E270 VanDerWaalsContact CZ-CG 3.49Å; F266-E270 PolarHBondContact O-N 2.97Å; F266-P295 HydrophobicContact CE1-CG 3.97Å; F266-P295 HydrophobicContact CZ-CG 4.48Å; F266-L329 HydrophobicContact CD1-CD1 3.58Å; F266-L329 HydrophobicContact CD1-CD2 4.25Å; F266-L329 HydrophobicContact CD2-CD1 4.36Å; F266-L329 HydrophobicContact CE1-CD1 3.82Å; F266-L329 HydrophobicContact CE1-CD2 3.6Å; F266-L329 HydrophobicContact CE1-CG 4.37Å; F266-L329 HydrophobicContact CE2-CD2 4.22Å; F266-L329 HydrophobicContact CG-CD1 3.88Å; F266-L329 HydrophobicContact CZ-CD1 4.3Å; F266-L329 HydrophobicContact CZ-CD2 3.57Å; F266-I334 HydrophobicContact CE2-CB 4.35Å; F266-I334 HydrophobicContact CE2-CG2 3.78Å; F266-I334 HydrophobicContact CZ-CG2 4.04Å; F266-L335 HydrophobicContact CB-CD1 3.88Å; F266-L335 HydrophobicContact CD2-CD1 3.97Å; F266-L335 HydrophobicContact CG-CD1 4.01Å
267	F	87.8	Confident	86.1	Confident	8 Å²	8	76.6 Å²	76.6	4%	0.035	37%	0.372	C	S	.	.	H	α-helix	trans	-64.5	-35.7	178.8	-85.1	-100.5	0	0	0	112.9	L263 R264 R269 E270 G271 H272 L274 V292 E293 L294	L263-F267 HydrophobicContact CD2-CD2 3.39Å; L263-F267 HydrophobicContact CD2-CE2 3.42Å; L263-F267 VanDerWaalsContact CD2-CE2 3.42Å; L263-F267 HydrophobicContact CD2-CG 4.43Å; L263-F267 HydrophobicContact CD2-CZ 4.47Å; L263-F267 HydrophobicContact CG-CD2 4.05Å; L263-F267 HydrophobicContact CG-CE2 3.94Å; L263-F267 WeakPolarHBondContact O-CD2 3.33Å; L263-F267 PolarHBondContact O-N 3.4Å; R264-F267 PolarHBondContact O-N 2.99Å; F267-R269 VanDerWaalsContact C-N 3.28Å; F267-R269 PolarHBondContact O-N 3.22Å; F267-E270 PolarHBondContact O-N 3.18Å; F267-G271 PolarHBondContact O-N 3.48Å; F267-H272 HydrophobicContact CD1-CB 3.77Å; F267-H272 HydrophobicContact CE1-CB 4.21Å; F267-H272 PolarHBondContact O-N 3.36Å; F267-H272 VanDerWaalsContact O-N 3.13Å; F267-L274 HydrophobicContact CB-CB 4.26Å; F267-L274 HydrophobicContact CD1-CB 4.15Å; F267-L274 HydrophobicContact CD1-CD1 4.31Å; F267-L274 HydrophobicContact CD2-CD1 4.03Å; F267-L274 HydrophobicContact CE1-CD1 4.22Å; F267-L274 HydrophobicContact CE2-CD1 3.93Å; F267-L274 HydrophobicContact CG-CB 4.12Å; F267-L274 HydrophobicContact CG-CD1 4.21Å; F267-L274 HydrophobicContact CZ-CD1 4.02Å; F267-V292 HydrophobicContact CZ-CG1 4.07Å; F267-E293 WeakPolarHBondContact CZ-O 3.48Å; F267-L294 HydrophobicContact CE2-CD2 4.08Å; F267-L294 HydrophobicContact CZ-CD2 4.07Å
268	E	87.2	Confident	86.4	Confident	134 Å²	134	74.7 Å²	74.7	63%	0.626	36%	0.357	S	S	*	.	H	α-helix	trans	-62.5	-33.7	172.1	-76	167.6	-170	0	0	112.6	R264 F266	R264-E268 WeakPolarHBondContact CG-OE1 3.41Å; R264-E268 WeakPolarHBondContact O-CB 3.49Å; R264-E268 WeakPolarHBondContact O-CG 3.33Å; R264-E268 PolarHBondContact O-N 3.48Å; F266-E268 VanDerWaalsContact C-N 3.33Å; F266-E268 PolarHBondContact O-N 2.88Å
269	R	81.6	Confident	86.5	Confident	107 Å²	107	73.6 Å²	73.6	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-75.9	-41.4	177.8	-77.1	171.8	-75.3	-169.3	1.8	112.7	K265 F266 F267 G271	K265-R269 VanDerWaalsContact O-CG 3.29Å; K265-R269 WeakPolarHBondContact O-CG 3.09Å; K265-R269 PolarHBondContact O-N 3.09Å; K265-R269 VanDerWaalsContact O-N 3.17Å; K265-R269 PolarHBondContact O-NE 3.47Å; F266-R269 VanDerWaalsContact N-NH2 3.16Å; F266-R269 WeakPolarHBondContact O-CB 3.49Å; F266-R269 PolarHBondContact O-N 3.04Å; F267-R269 VanDerWaalsContact C-N 3.28Å; F267-R269 PolarHBondContact O-N 3.22Å; R269-G271 VanDerWaalsContact C-N 3.27Å
270	E	81.2	Confident	86.3	Confident	95 Å²	95	77.8 Å²	77.8	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-79.4	-10.2	177.8	-62.3	-64.7	141.3	0	0	112.7	F266 F267 H272	F266-E270 HydrophobicContact CD1-CG 4.37Å; F266-E270 HydrophobicContact CD2-CG 4.43Å; F266-E270 HydrophobicContact CE1-CG 3.77Å; F266-E270 HydrophobicContact CE2-CG 3.86Å; F266-E270 HydrophobicContact CZ-CG 3.49Å; F266-E270 VanDerWaalsContact CZ-CG 3.49Å; F266-E270 PolarHBondContact O-N 2.97Å; F267-E270 PolarHBondContact O-N 3.18Å; E270-H272 VanDerWaalsContact C-N 3.31Å; E270-H272 PolarHBondContact O-N 3.39Å
271	G	79	Confident	86	Confident	66 Å²	66	76.8 Å²	76.8	68%	0.68	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	18.6	179.9	0	0	0	0	0	114.5	F267 R269	F267-G271 PolarHBondContact O-N 3.48Å; R269-G271 VanDerWaalsContact C-N 3.27Å
272	H	78.9	Confident	85.1	Confident	103 Å²	103	72.9 Å²	72.9	48%	0.477	38%	0.376	S	S	.	.			trans	-95.9	142.9	177.9	-72.9	-65.8	0	0	0	111.9	F267 E270 L274	F267-H272 HydrophobicContact CD1-CB 3.77Å; F267-H272 HydrophobicContact CE1-CB 4.21Å; F267-H272 PolarHBondContact O-N 3.36Å; F267-H272 VanDerWaalsContact O-N 3.13Å; E270-H272 VanDerWaalsContact C-N 3.31Å; E270-H272 PolarHBondContact O-N 3.39Å; H272-L274 PolarHBondContact O-N 2.91Å
273	E	81.8	Confident	84.1	Confident	154 Å²	154	79.4 Å²	79.4	72%	0.72	42%	0.421	S	S	*	.			trans	-77.2	123.6	176.1	-168.8	-178.2	-161.7	0	0	110.9	Q275	E273-Q275 HydrophobicContact CG-CG 4.23Å; E273-Q275 PolarHBondContact O-N 3.38Å; E273-Q275 PolarHBondContact OE2-NE2 2.97Å
274	L	84.1	Confident	83	Confident	35 Å²	35	88.8 Å²	88.8	18%	0.183	46%	0.463	C	S	.	.			trans	-79.1	100.4	179	178.1	59.1	0	0	0	111.3	L263 F267 H272 Y276 V292	L263-L274 HydrophobicContact CD2-CD1 3.21Å; L263-L274 HydrophobicContact CD2-CD2 3.51Å; L263-L274 HydrophobicContact CD2-CG 3.97Å; F267-L274 HydrophobicContact CB-CB 4.26Å; F267-L274 HydrophobicContact CD1-CB 4.15Å; F267-L274 HydrophobicContact CD1-CD1 4.31Å; F267-L274 HydrophobicContact CD2-CD1 4.03Å; F267-L274 HydrophobicContact CE1-CD1 4.22Å; F267-L274 HydrophobicContact CE2-CD1 3.93Å; F267-L274 HydrophobicContact CG-CB 4.12Å; F267-L274 HydrophobicContact CG-CD1 4.21Å; F267-L274 HydrophobicContact CZ-CD1 4.02Å; H272-L274 PolarHBondContact O-N 2.91Å; L274-Y276 HydrophobicContact CD1-CE2 4.1Å; L274-Y276 HydrophobicContact CD2-CE2 3.6Å; L274-Y276 HydrophobicContact CG-CD2 4.24Å; L274-Y276 HydrophobicContact CG-CE2 3.59Å; L274-V292 HydrophobicContact CD1-CG1 3.77Å; L274-V292 HydrophobicContact CD1-CG2 4.45Å
275	Q	86.9	Confident	82.4	Confident	121 Å²	121	92.2 Å²	92.2	57%	0.565	48%	0.475	S	S	*	.			trans	-105.7	122.3	177.7	-61.4	-174.6	7.1	0	0	111.6	E273	E273-Q275 HydrophobicContact CG-CG 4.23Å; E273-Q275 PolarHBondContact O-N 3.38Å; E273-Q275 PolarHBondContact OE2-NE2 2.97Å
276	Y	88.5	Confident	82	Confident	43 Å²	43	95.2 Å²	95.2	17%	0.169	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.5	174.6	-67.4	-87.8	0	0	0	110.1	L274 F278 C290 V292 M318	L274-Y276 HydrophobicContact CD1-CE2 4.1Å; L274-Y276 HydrophobicContact CD2-CE2 3.6Å; L274-Y276 HydrophobicContact CG-CD2 4.24Å; L274-Y276 HydrophobicContact CG-CE2 3.59Å; Y276-F278 HydrophobicContact CG-CZ 4.48Å; Y276-C290 VanDerWaalsContact CD1-SG 3.6Å; Y276-V292 HydrophobicContact CD1-CG2 3.2Å; Y276-V292 HydrophobicContact CE1-CG2 3.45Å; Y276-V292 VanDerWaalsContact CE1-CG2 3.45Å; Y276-V292 HydrophobicContact CG-CG2 3.96Å; Y276-M318 HydrophobicContact CD1-CE 4.34Å; Y276-M318 HydrophobicContact CD1-CG 3.98Å; Y276-M318 HydrophobicContact CD2-CE 4.08Å; Y276-M318 HydrophobicContact CE1-CG 3.65Å; Y276-M318 HydrophobicContact CE1-SD 4.48Å; Y276-M318 HydrophobicContact CE2-CE 4.38Å; Y276-M318 HydrophobicContact CE2-SD 4.49Å; Y276-M318 HydrophobicContact CG-CE 4.06Å
277	T	91	Very high	82.1	Confident	80 Å²	80	98.9 Å²	98.9	49%	0.491	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.3	170.8	59.4	0	0	0	0	109.9	C290 R291	T277-C290 CarbonylContact O-C 3.58Å; T277-C290 VanDerWaalsContact O-CA 3.32Å; T277-C290 WeakPolarHBondContact O-CA 3.42Å; T277-R291 PolarHBondContact N-O 3.13Å; T277-R291 PolarHBondContact O-N 3.34Å; T277-R291 WeakPolarHBondContact OG1-CB 3.46Å; T277-R291 PolarHBondContact OG1-O 2.91Å
278	F	90.1	Very high	82.2	Confident	92 Å²	92	101 Å²	101	40%	0.404	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.7	-179.2	-55.4	-86.7	0	0	0	110.2	Y276 T289 C290 M318	Y276-F278 HydrophobicContact CG-CZ 4.48Å; F278-T289 CarbonylContact C-O 3.48Å; F278-T289 WeakPolarHBondContact CA-O 3.41Å; F278-C290 HydrophobicContact CD1-CB 4.17Å; F278-C290 HydrophobicContact CE1-CB 4.28Å; F278-M318 HydrophobicContact CE1-CE 4.07Å; F278-M318 HydrophobicContact CZ-CE 3.52Å
279	A	89	Confident	82.4	Confident	50 Å²	50	95.8 Å²	95.8	41%	0.413	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135	172.2	0	0	0	0	0	110.1	V281 T289	A279-V281 HydrophobicContact CB-CG2 4.39Å; A279-T289 PolarHBondContact N-O 2.98Å; A279-T289 PolarHBondContact O-N 3.29Å
280	E	87.4	Confident	82.9	Confident	97 Å²	97	90.7 Å²	90.7	45%	0.453	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.3	171.5	-170.8	173.4	-179.6	0	0	107.9	R286 W288	E280-R286 IonicContact OE1-NH1 3.12Å; E280-R286 PolarHBondContact OE1-NH1 2.87Å; E280-R286 VanDerWaalsContact OE1-NH1 3.08Å; E280-W288 HydrophobicContact CB-CE3 4.34Å; E280-W288 HydrophobicContact CB-CH2 4.39Å; E280-W288 HydrophobicContact CB-CZ3 4.03Å; E280-W288 HydrophobicContact CG-CH2 4.39Å; E280-W288 HydrophobicContact CG-CZ3 4.44Å
281	V	81.8	Confident	83.4	Confident	78 Å²	78	90.5 Å²	90.5	47%	0.473	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.8	-178.5	-175.9	0	0	0	0	108.1	A279 Q287	A279-V281 HydrophobicContact CB-CG2 4.39Å; V281-Q287 PolarHBondContact N-O 3.34Å; V281-Q287 WeakPolarHBondContact O-CA 3.41Å; V281-Q287 WeakPolarHBondContact O-CB 3.26Å; V281-Q287 PolarHBondContact O-N 2.89Å
282	G	71.3	Confident	84.1	Confident	40 Å²	40	87.4 Å²	87.4	41%	0.412	43%	0.43	S	S	.	.			trans	124.6	116.1	171	0	0	0	0	0	114.7
283	S	66.7	Low	84.6	Confident	142 Å²	142	88.2 Å²	88.2	99%	0.993	43%	0.434	S	S	*	.	S	Bend	trans	-79.8	-21.2	175.8	-54.5	0	0	0	0	113.9
284	F	66.2	Low	84.8	Confident	197 Å²	197	81.2 Å²	81.2	86%	0.864	40%	0.401	S	S	*	.	S	Bend	trans	-113.1	-28.7	-174.5	-165.3	-101.8	0	0	0	114
285	R	75.3	Confident	84.7	Confident	179 Å²	179	82 Å²	82	68%	0.675	41%	0.409	S	S	*	.	S	Bend	trans	-135	115.4	165.6	-70.1	-169.6	-178.3	-155.9	-1	107.5	Q287	R285-Q287 PolarHBondContact O-N 3.33Å; R285-Q287 VanDerWaalsContact O-N 3.1Å
286	R	79.4	Confident	84.3	Confident	175 Å²	175	77.1 Å²	77.1	66%	0.66	39%	0.386	S	S	*	.			trans	-66.1	107.2	-178.9	-63.3	175.8	-178.2	-116.2	8.3	109.3	E280	E280-R286 IonicContact OE1-NH1 3.12Å; E280-R286 PolarHBondContact OE1-NH1 2.87Å; E280-R286 VanDerWaalsContact OE1-NH1 3.08Å
287	Q	89.1	Confident	83.9	Confident	80 Å²	80	83 Å²	83	37%	0.374	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.6	173.9	-63.2	176.2	-32.6	0	0	109.2	V281 R285 V309	V281-Q287 PolarHBondContact N-O 3.34Å; V281-Q287 WeakPolarHBondContact O-CA 3.41Å; V281-Q287 WeakPolarHBondContact O-CB 3.26Å; V281-Q287 PolarHBondContact O-N 2.89Å; R285-Q287 PolarHBondContact O-N 3.33Å; R285-Q287 VanDerWaalsContact O-N 3.1Å; Q287-V309 HydrophobicContact CB-CG1 4.07Å; Q287-V309 HydrophobicContact CG-CG1 4.5Å
288	W	90.1	Very high	83.2	Confident	53 Å²	53	81.7 Å²	81.7	20%	0.201	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	122.2	172.9	-65.8	91.3	0	0	0	108.2	E280 V309 A310 K314 A317	E280-W288 HydrophobicContact CB-CE3 4.34Å; E280-W288 HydrophobicContact CB-CH2 4.39Å; E280-W288 HydrophobicContact CB-CZ3 4.03Å; E280-W288 HydrophobicContact CG-CH2 4.39Å; E280-W288 HydrophobicContact CG-CZ3 4.44Å; W288-V309 WeakPolarHBondContact O-CA 3.44Å; W288-A310 PolarHBondContact N-O 2.82Å; W288-A310 PolarHBondContact O-N 3.09Å; W288-K314 HydrophobicContact CD2-CG 3.56Å; W288-K314 HydrophobicContact CE3-CD 4.21Å; W288-K314 HydrophobicContact CE3-CG 3.55Å; W288-K314 HydrophobicContact CG-CG 4.13Å; W288-K314 HydrophobicContact CH2-CD 4.35Å; W288-K314 HydrophobicContact CH2-CG 4.29Å; W288-K314 HydrophobicContact CZ2-CG 4.27Å; W288-K314 HydrophobicContact CZ3-CD 4.12Å; W288-K314 HydrophobicContact CZ3-CG 3.95Å; W288-A317 HydrophobicContact CB-CB 3.85Å; W288-A317 VanDerWaalsContact O-CB 3.29Å; W288-A317 WeakPolarHBondContact O-CB 3.42Å
289	T	90.7	Very high	82.5	Confident	25 Å²	25	87.6 Å²	87.6	15%	0.153	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.8	174.2	-47.9	0	0	0	0	108	F278 A279 G308 V309	F278-T289 CarbonylContact C-O 3.48Å; F278-T289 WeakPolarHBondContact CA-O 3.41Å; A279-T289 PolarHBondContact N-O 2.98Å; A279-T289 PolarHBondContact O-N 3.29Å; T289-G308 WeakPolarHBondContact CA-O 3.38Å; T289-V309 HydrophobicContact CG2-CG2 4.15Å
290	C	92.1	Very high	81.7	Confident	0 Å²	0	91.1 Å²	91.1	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.5	175.4	-172.6	0	0	0	0	109.2	Y276 T277 F278 E307 G308 A317 C321	Y276-C290 VanDerWaalsContact CD1-SG 3.6Å; T277-C290 CarbonylContact O-C 3.58Å; T277-C290 VanDerWaalsContact O-CA 3.32Å; T277-C290 WeakPolarHBondContact O-CA 3.42Å; F278-C290 HydrophobicContact CD1-CB 4.17Å; F278-C290 HydrophobicContact CE1-CB 4.28Å; C290-E307 CarbonylContact O-C 3.59Å; C290-E307 WeakPolarHBondContact O-CA 3.4Å; C290-G308 PolarHBondContact N-O 3.42Å; C290-G308 PolarHBondContact O-N 2.8Å; C290-A317 HydrophobicContact CB-CB 4Å; C290-A317 WeakPolarHBondContact CB-O 3.37Å; C290-C321 HydrophobicContact CB-CB 3.87Å; C290-C321 PolarHBondContact O-SG 2.97Å
291	R	92.8	Very high	81.3	Confident	91 Å²	91	89.3 Å²	89.3	34%	0.343	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.6	-178.3	178.2	177	178.4	-179.1	-4.9	110.9	T277 F305 A306 E307	T277-R291 PolarHBondContact N-O 3.13Å; T277-R291 PolarHBondContact O-N 3.34Å; T277-R291 WeakPolarHBondContact OG1-CB 3.46Å; T277-R291 PolarHBondContact OG1-O 2.91Å; R291-F305 HydrophobicContact CG-CB 4.06Å; R291-F305 HydrophobicContact CG-CD1 3.97Å; R291-F305 HydrophobicContact CG-CG 4.41Å; R291-F305 VanDerWaalsContact NH2-CD1 3.31Å; R291-A306 WeakPolarHBondContact CA-O 3.42Å; R291-E307 HydrophobicContact CB-CG 4.14Å; R291-E307 WeakPolarHBondContact CD-OE1 3.46Å; R291-E307 HydrophobicContact CG-CG 3.97Å; R291-E307 IonicContact CZ-OE1 3.83Å; R291-E307 IonicContact NE-OE1 2.71Å; R291-E307 IonicContact NH1-OE1 3.82Å
292	V	92.4	Very high	81.1	Confident	1 Å²	1	92.3 Å²	92.3	1%	0.006	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.1	177.6	170.9	0	0	0	0	109.2	F267 L274 Y276 F305 A306 C321	F267-V292 HydrophobicContact CZ-CG1 4.07Å; L274-V292 HydrophobicContact CD1-CG1 3.77Å; L274-V292 HydrophobicContact CD1-CG2 4.45Å; Y276-V292 HydrophobicContact CD1-CG2 3.2Å; Y276-V292 HydrophobicContact CE1-CG2 3.45Å; Y276-V292 VanDerWaalsContact CE1-CG2 3.45Å; Y276-V292 HydrophobicContact CG-CG2 3.96Å; V292-F305 WeakPolarHBondContact O-CA 3.3Å; V292-A306 PolarHBondContact N-O 2.98Å; V292-A306 PolarHBondContact O-N 2.97Å; V292-C321 VanDerWaalsContact CG2-SG 3.52Å
293	E	90.1	Very high	81.6	Confident	120 Å²	120	93.9 Å²	93.9	56%	0.561	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.4	173.6	-41.8	-161	154.9	0	0	109.3	F267 F305	F267-E293 WeakPolarHBondContact CZ-O 3.48Å; E293-F305 HydrophobicContact CB-CD1 4.21Å; E293-F305 HydrophobicContact CB-CE1 4.18Å; E293-F305 HydrophobicContact CG-CD1 3.75Å; E293-F305 HydrophobicContact CG-CE1 3.46Å; E293-F305 VanDerWaalsContact CG-CE1 3.46Å; E293-F305 HydrophobicContact CG-CZ 4.48Å; E293-F305 VanDerWaalsContact OE1-CE1 3.24Å; E293-F305 WeakPolarHBondContact OE1-CE1 3.47Å
294	L	86	Confident	82.6	Confident	6 Å²	6	88.4 Å²	88.4	3%	0.031	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140	175.5	-63.2	176	0	0	0	109.6	F267 I296 T304 A306 A325 L328 L329	F267-L294 HydrophobicContact CE2-CD2 4.08Å; F267-L294 HydrophobicContact CZ-CD2 4.07Å; L294-I296 HydrophobicContact CB-CD1 4.33Å; L294-I296 HydrophobicContact CB-CG1 4.36Å; L294-I296 HydrophobicContact CD1-CD1 4.29Å; L294-I296 PolarHBondContact O-N 3.36Å; L294-T304 PolarHBondContact N-O 3.1Å; L294-A306 HydrophobicContact CD1-CB 4.14Å; L294-A306 HydrophobicContact CG-CB 4.39Å; L294-A325 HydrophobicContact CD1-CB 4.33Å; L294-A325 HydrophobicContact CD2-CB 3.85Å; L294-L328 HydrophobicContact CD1-CB 3.77Å; L294-L328 HydrophobicContact CD1-CD1 3.76Å; L294-L328 HydrophobicContact CD1-CG 4.43Å; L294-L329 HydrophobicContact CD2-CD1 4.18Å; L294-L329 HydrophobicContact CD2-CD2 4.38Å; L294-L329 HydrophobicContact CD2-CG 4.29Å
295	P	81	Confident	83.7	Confident	52 Å²	52	82 Å²	82	34%	0.338	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	55.2	173	33.8	-35.8	0	0	0	110.7	F266	F266-P295 HydrophobicContact CE1-CG 3.97Å; F266-P295 HydrophobicContact CZ-CG 4.48Å
296	I	79.3	Confident	84.4	Confident	18 Å²	18	73.6 Å²	73.6	9%	0.092	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.4	174.3	-56.7	168	0	0	0	107.3	L294 S298 T304 L329 Q332 I334	L294-I296 HydrophobicContact CB-CD1 4.33Å; L294-I296 HydrophobicContact CB-CG1 4.36Å; L294-I296 HydrophobicContact CD1-CD1 4.29Å; L294-I296 PolarHBondContact O-N 3.36Å; I296-S298 PolarHBondContact O-N 2.81Å; I296-T304 WeakPolarHBondContact O-CB 3.12Å; I296-T304 PolarHBondContact O-N 2.9Å; I296-T304 PolarHBondContact O-OG1 3.37Å; I296-L329 HydrophobicContact CD1-CD2 3.39Å; I296-L329 HydrophobicContact CD1-CG 4.23Å; I296-L329 HydrophobicContact CG1-CD2 3.93Å; I296-Q332 HydrophobicContact CD1-CG 4.02Å; I296-Q332 HydrophobicContact CG2-CG 4.07Å; I296-I334 HydrophobicContact CG1-CD1 4.24Å
297	E	79.1	Confident	85	Confident	168 Å²	168	70 Å²	70	79%	0.785	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	115.4	169.6	-64.3	-178	170.9	0	0	109.2
298	S	77.3	Confident	85.1	Confident	51 Å²	51	66.2 Å²	66.2	36%	0.357	34%	0.338	S	S	.	.			trans	-63.2	159.2	164.7	-176.7	0	0	0	0	108.9	I296 D300 G301 K302 T304	I296-S298 PolarHBondContact O-N 2.81Å; S298-D300 PolarHBondContact O-N 2.94Å; S298-G301 PolarHBondContact O-N 2.82Å; S298-K302 PolarHBondContact N-O 2.92Å; S298-T304 PolarHBondContact N-OG1 3.49Å
299	K	74.6	Confident	85.1	Confident	216 Å²	216	67.5 Å²	67.5	94%	0.939	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-18.7	-178.8	-66	-179.5	179.1	178.6	0	114.3
300	D	73.4	Confident	85	Confident	125 Å²	125	66.6 Å²	66.6	67%	0.668	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	10.1	178.3	-57.9	-44.7	0	0	0	114.7	S298 K302	S298-D300 PolarHBondContact O-N 2.94Å; D300-K302 PolarHBondContact O-N 2.85Å; D300-K302 VanDerWaalsContact O-N 3.17Å
301	G	77.7	Confident	84.7	Confident	58 Å²	58	69.9 Å²	69.9	60%	0.598	37%	0.37	S	S	*	.	S	Bend	trans	67.6	11.5	-178.7	0	0	0	0	0	114.6	S298	S298-G301 PolarHBondContact O-N 2.82Å
302	K	79.2	Confident	84	Confident	141 Å²	141	71.4 Å²	71.4	61%	0.613	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-91.8	142.3	177	-67.1	173.1	-174.7	166.6	0	109.8	S298 D300 T304	S298-K302 PolarHBondContact N-O 2.92Å; D300-K302 PolarHBondContact O-N 2.85Å; D300-K302 VanDerWaalsContact O-N 3.17Å; K302-T304 PolarHBondContact O-N 2.85Å
303	P	82.2	Confident	83.7	Confident	73 Å²	73	72.2 Å²	72.2	47%	0.474	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	134.7	174.6	23.7	-31.8	0	0	0	109.8	F305	P303-F305 HydrophobicContact CB-CE2 4.28Å; P303-F305 HydrophobicContact CB-CZ 4.37Å; P303-F305 HydrophobicContact CG-CE2 3.86Å; P303-F305 HydrophobicContact CG-CZ 3.92Å; P303-F305 WeakPolarHBondContact O-CD2 3.24Å; P303-F305 WeakPolarHBondContact O-CE2 3.33Å
304	T	86.2	Confident	83.7	Confident	28 Å²	28	71.8 Å²	71.8	17%	0.172	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.4	-179.5	-52.2	0	0	0	0	109.4	L294 I296 S298 K302 L328	L294-T304 PolarHBondContact N-O 3.1Å; I296-T304 WeakPolarHBondContact O-CB 3.12Å; I296-T304 PolarHBondContact O-N 2.9Å; I296-T304 PolarHBondContact O-OG1 3.37Å; S298-T304 PolarHBondContact N-OG1 3.49Å; K302-T304 PolarHBondContact O-N 2.85Å; T304-L328 HydrophobicContact CG2-CD1 4.3Å
305	F	89.6	Confident	83.9	Confident	62 Å²	62	80 Å²	80	27%	0.272	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133	179.5	-61.4	-92.4	0	0	0	110.5	R291 V292 E293 P303	R291-F305 HydrophobicContact CG-CB 4.06Å; R291-F305 HydrophobicContact CG-CD1 3.97Å; R291-F305 HydrophobicContact CG-CG 4.41Å; R291-F305 VanDerWaalsContact NH2-CD1 3.31Å; V292-F305 WeakPolarHBondContact O-CA 3.3Å; E293-F305 HydrophobicContact CB-CD1 4.21Å; E293-F305 HydrophobicContact CB-CE1 4.18Å; E293-F305 HydrophobicContact CG-CD1 3.75Å; E293-F305 HydrophobicContact CG-CE1 3.46Å; E293-F305 VanDerWaalsContact CG-CE1 3.46Å; E293-F305 HydrophobicContact CG-CZ 4.48Å; E293-F305 VanDerWaalsContact OE1-CE1 3.24Å; E293-F305 WeakPolarHBondContact OE1-CE1 3.47Å; P303-F305 HydrophobicContact CB-CE2 4.28Å; P303-F305 HydrophobicContact CB-CZ 4.37Å; P303-F305 HydrophobicContact CG-CE2 3.86Å; P303-F305 HydrophobicContact CG-CZ 3.92Å; P303-F305 WeakPolarHBondContact O-CD2 3.24Å; P303-F305 WeakPolarHBondContact O-CE2 3.33Å
306	A	91.2	Very high	84.3	Confident	2 Å²	2	81.8 Å²	81.8	2%	0.017	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.3	169.1	0	0	0	0	0	109.1	R291 V292 L294 C321 A325 L328	R291-A306 WeakPolarHBondContact CA-O 3.42Å; V292-A306 PolarHBondContact N-O 2.98Å; V292-A306 PolarHBondContact O-N 2.97Å; L294-A306 HydrophobicContact CD1-CB 4.14Å; L294-A306 HydrophobicContact CG-CB 4.39Å; A306-C321 PolarHBondContact O-SG 2.9Å; A306-A325 HydrophobicContact CB-CB 3.58Å; A306-L328 HydrophobicContact CB-CD1 4.16Å
307	E	91.8	Very high	84.9	Confident	99 Å²	99	80.9 Å²	80.9	46%	0.463	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	140.7	177.4	-63	-174.3	169.3	0	0	110.4	C290 R291 N324	C290-E307 CarbonylContact O-C 3.59Å; C290-E307 WeakPolarHBondContact O-CA 3.4Å; R291-E307 HydrophobicContact CB-CG 4.14Å; R291-E307 WeakPolarHBondContact CD-OE1 3.46Å; R291-E307 HydrophobicContact CG-CG 3.97Å; R291-E307 IonicContact CZ-OE1 3.83Å; R291-E307 IonicContact NE-OE1 2.71Å; R291-E307 IonicContact NH1-OE1 3.82Å; E307-N324 PolarHBondContact O-ND2 3.42Å
308	G	90.6	Very high	85.5	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.01	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127	174	0	0	0	0	0	110.4	T289 C290	T289-G308 WeakPolarHBondContact CA-O 3.38Å; C290-G308 PolarHBondContact N-O 3.42Å; C290-G308 PolarHBondContact O-N 2.8Å
309	V	90.6	Very high	86.3	Confident	80 Å²	80	74.5 Å²	74.5	49%	0.485	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.8	179.7	-177.2	0	0	0	0	108.8	Q287 W288 T289	Q287-V309 HydrophobicContact CB-CG1 4.07Å; Q287-V309 HydrophobicContact CG-CG1 4.5Å; W288-V309 WeakPolarHBondContact O-CA 3.44Å; T289-V309 HydrophobicContact CG2-CG2 4.15Å
310	A	88.7	Confident	87.1	Confident	7 Å²	7	67.8 Å²	67.8	6%	0.058	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.4	173.1	0	0	0	0	0	111.8	W288 E316 A317	W288-A310 PolarHBondContact N-O 2.82Å; W288-A310 PolarHBondContact O-N 3.09Å; A310-E316 HydrophobicContact CB-CB 3.86Å; A310-E316 HydrophobicContact CB-CG 3.95Å; A310-A317 HydrophobicContact CB-CB 3.93Å; A310-A317 VanDerWaalsContact CB-N 3.29Å
311	S	84.7	Confident	88.1	Confident	69 Å²	69	61.9 Å²	61.9	48%	0.483	34%	0.337	S	S	.	.	S	Bend	trans	-86.8	-18.6	179.7	-169.6	0	0	0	0	113.6
312	V	77.7	Confident	88.8	Confident	122 Å²	122	59.1 Å²	59.1	74%	0.739	31%	0.309	S	S	*	.	S	Bend	trans	-96.6	-25.1	-166.3	-174.9	0	0	0	0	112.1	E316	V312-E316 WeakPolarHBondContact CB-OE2 3.47Å
313	G	86.5	Confident	89.5	Confident	18 Å²	18	53.7 Å²	53.7	19%	0.186	29%	0.286	C	S	.	.			trans	169.3	172.6	171.1	0	0	0	0	0	116.2	K315 E316 A317	G313-K315 VanDerWaalsContact C-N 3.32Å; G313-K315 PolarHBondContact O-N 3.07Å; G313-E316 PolarHBondContact O-N 2.78Å; G313-A317 PolarHBondContact O-N 3.41Å; G313-A317 VanDerWaalsContact O-N 3.16Å
314	K	89.5	Confident	90	Very high	111 Å²	111	52.7 Å²	52.7	48%	0.483	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-38.7	179.1	-68.2	-179.2	178.3	-179.3	0	113.7	W288 M318	W288-K314 HydrophobicContact CD2-CG 3.56Å; W288-K314 HydrophobicContact CE3-CD 4.21Å; W288-K314 HydrophobicContact CE3-CG 3.55Å; W288-K314 HydrophobicContact CG-CG 4.13Å; W288-K314 HydrophobicContact CH2-CD 4.35Å; W288-K314 HydrophobicContact CH2-CG 4.29Å; W288-K314 HydrophobicContact CZ2-CG 4.27Å; W288-K314 HydrophobicContact CZ3-CD 4.12Å; W288-K314 HydrophobicContact CZ3-CG 3.95Å; K314-M318 PolarHBondContact O-N 2.91Å
315	K	90.4	Very high	90.3	Very high	180 Å²	180	51.3 Å²	51.3	78%	0.783	27%	0.269	S	S	*	.	H	α-helix	trans	-65.5	-39.7	-178.8	-71.7	-176.4	-180	178.2	0	111.6	G313 M318 T319	G313-K315 VanDerWaalsContact C-N 3.32Å; G313-K315 PolarHBondContact O-N 3.07Å; K315-M318 WeakPolarHBondContact O-CB 3.46Å; K315-M318 PolarHBondContact O-N 2.98Å; K315-T319 PolarHBondContact O-N 3.48Å; K315-T319 PolarHBondContact O-OG1 3.18Å; K315-T319 VanDerWaalsContact O-OG1 3.09Å
316	E	90.5	Very high	90.3	Very high	88 Å²	88	48.4 Å²	48.4	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-74.6	-37.9	-179.8	-166.4	169.1	163.6	0	0	111.5	A310 V312 G313 M318 T319 Q320	A310-E316 HydrophobicContact CB-CB 3.86Å; A310-E316 HydrophobicContact CB-CG 3.95Å; V312-E316 WeakPolarHBondContact CB-OE2 3.47Å; G313-E316 PolarHBondContact O-N 2.78Å; E316-M318 VanDerWaalsContact C-N 3.25Å; E316-M318 PolarHBondContact O-N 3.36Å; E316-T319 PolarHBondContact O-N 2.84Å; E316-T319 VanDerWaalsContact O-N 3.17Å; E316-Q320 WeakPolarHBondContact O-CB 3.38Å; E316-Q320 WeakPolarHBondContact O-CG 3.36Å; E316-Q320 PolarHBondContact O-N 3.41Å
317	A	91.5	Very high	90.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-39.7	170.9	0	0	0	0	0	111.4	W288 C290 A310 G313 C321	W288-A317 HydrophobicContact CB-CB 3.85Å; W288-A317 VanDerWaalsContact O-CB 3.29Å; W288-A317 WeakPolarHBondContact O-CB 3.42Å; C290-A317 HydrophobicContact CB-CB 4Å; C290-A317 WeakPolarHBondContact CB-O 3.37Å; A310-A317 HydrophobicContact CB-CB 3.93Å; A310-A317 VanDerWaalsContact CB-N 3.29Å; G313-A317 PolarHBondContact O-N 3.41Å; G313-A317 VanDerWaalsContact O-N 3.16Å; A317-C321 WeakPolarHBondContact O-CB 3.45Å; A317-C321 PolarHBondContact O-N 3.4Å
318	M	92.7	Very high	90.1	Very high	31 Å²	31	51.9 Å²	51.9	15%	0.153	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-44.4	174.3	-178.2	-174.3	-76.5	0	0	112.4	R260 Y276 F278 K314 K315 E316 C321 A322	R260-M318 PolarHBondContact NE-SD 3.5Å; R260-M318 PolarHBondContact NH2-SD 3.49Å; Y276-M318 HydrophobicContact CD1-CE 4.34Å; Y276-M318 HydrophobicContact CD1-CG 3.98Å; Y276-M318 HydrophobicContact CD2-CE 4.08Å; Y276-M318 HydrophobicContact CE1-CG 3.65Å; Y276-M318 HydrophobicContact CE1-SD 4.48Å; Y276-M318 HydrophobicContact CE2-CE 4.38Å; Y276-M318 HydrophobicContact CE2-SD 4.49Å; Y276-M318 HydrophobicContact CG-CE 4.06Å; F278-M318 HydrophobicContact CE1-CE 4.07Å; F278-M318 HydrophobicContact CZ-CE 3.52Å; K314-M318 PolarHBondContact O-N 2.91Å; K315-M318 WeakPolarHBondContact O-CB 3.46Å; K315-M318 PolarHBondContact O-N 2.98Å; E316-M318 VanDerWaalsContact C-N 3.25Å; E316-M318 PolarHBondContact O-N 3.36Å; M318-C321 PolarHBondContact O-N 2.69Å; M318-A322 WeakPolarHBondContact O-CB 3.45Å; M318-A322 PolarHBondContact O-N 3.2Å
319	T	92.7	Very high	90	Very high	53 Å²	53	51.9 Å²	51.9	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-42.3	178.4	-56.2	0	0	0	0	111.5	P259 K315 E316 A322 L323	P259-T319 HydrophobicContact CG-CG2 3.66Å; K315-T319 PolarHBondContact O-N 3.48Å; K315-T319 PolarHBondContact O-OG1 3.18Å; K315-T319 VanDerWaalsContact O-OG1 3.09Å; E316-T319 PolarHBondContact O-N 2.84Å; E316-T319 VanDerWaalsContact O-N 3.17Å; T319-A322 PolarHBondContact O-N 3.02Å; T319-L323 WeakPolarHBondContact O-CB 3.21Å; T319-L323 PolarHBondContact O-N 3.09Å
320	Q	91.8	Very high	89.7	Confident	76 Å²	76	49 Å²	49	36%	0.355	25%	0.25	S	S	.	.	H	α-helix	trans	-65.1	-42.6	175.8	-71.2	-68.2	-11.6	0	0	112	E316 A322 L323 N324	E316-Q320 WeakPolarHBondContact O-CB 3.38Å; E316-Q320 WeakPolarHBondContact O-CG 3.36Å; E316-Q320 PolarHBondContact O-N 3.41Å; Q320-A322 VanDerWaalsContact C-N 3.33Å; Q320-A322 PolarHBondContact O-N 3.3Å; Q320-L323 PolarHBondContact O-N 2.91Å; Q320-N324 PolarHBondContact O-N 3.45Å
321	C	93.4	Very high	89.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-44.4	173.9	176.9	0	0	0	0	111	C290 V292 A306 A317 M318 L323 N324 A325	C290-C321 HydrophobicContact CB-CB 3.87Å; C290-C321 PolarHBondContact O-SG 2.97Å; V292-C321 VanDerWaalsContact CG2-SG 3.52Å; A306-C321 PolarHBondContact O-SG 2.9Å; A317-C321 WeakPolarHBondContact O-CB 3.45Å; A317-C321 PolarHBondContact O-N 3.4Å; M318-C321 PolarHBondContact O-N 2.69Å; C321-L323 PolarHBondContact O-N 3.15Å; C321-N324 PolarHBondContact O-N 3.24Å; C321-A325 VanDerWaalsContact O-CB 3.3Å; C321-A325 WeakPolarHBondContact O-CB 3.42Å; C321-A325 PolarHBondContact O-N 3.4Å
322	A	93.3	Very high	89.5	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-36.8	177.3	0	0	0	0	0	113	P259 R260 L263 M318 T319 Q320 A325 C326	P259-A322 HydrophobicContact CB-CB 4.06Å; R260-A322 HydrophobicContact CG-CB 4.08Å; L263-A322 HydrophobicContact CD1-CB 3.99Å; M318-A322 WeakPolarHBondContact O-CB 3.45Å; M318-A322 PolarHBondContact O-N 3.2Å; T319-A322 PolarHBondContact O-N 3.02Å; Q320-A322 VanDerWaalsContact C-N 3.33Å; Q320-A322 PolarHBondContact O-N 3.3Å; A322-A325 PolarHBondContact O-N 3.16Å; A322-C326 PolarHBondContact O-N 3.34Å; A322-C326 PolarHBondContact O-SG 2.94Å
323	L	93.1	Very high	89.6	Confident	27 Å²	27	50.4 Å²	50.4	14%	0.141	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-50	176.7	-166	170.7	0	0	0	110.7	P259 T319 Q320 C321 A325 C326 R327	P259-L323 HydrophobicContact CB-CB 4.13Å; P259-L323 HydrophobicContact CG-CB 4.47Å; T319-L323 WeakPolarHBondContact O-CB 3.21Å; T319-L323 PolarHBondContact O-N 3.09Å; Q320-L323 PolarHBondContact O-N 2.91Å; C321-L323 PolarHBondContact O-N 3.15Å; L323-A325 VanDerWaalsContact C-N 3.26Å; L323-A325 PolarHBondContact O-N 3.02Å; L323-C326 PolarHBondContact O-N 2.91Å; L323-C326 VanDerWaalsContact O-N 3.15Å; L323-R327 HydrophobicContact CD2-CG 4.01Å; L323-R327 VanDerWaalsContact CD2-NE 3.32Å; L323-R327 PolarHBondContact O-N 3.37Å
324	N	92.7	Very high	89.3	Confident	52 Å²	52	51.3 Å²	51.3	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-38.3	176.4	-73.8	-15.2	0	0	0	111.9	E307 Q320 C321 R327 L328	E307-N324 PolarHBondContact O-ND2 3.42Å; Q320-N324 PolarHBondContact O-N 3.45Å; C321-N324 PolarHBondContact O-N 3.24Å; N324-R327 PolarHBondContact O-N 3.16Å; N324-L328 WeakPolarHBondContact O-CG 3.27Å; N324-L328 PolarHBondContact O-N 2.78Å
325	A	92.5	Very high	88.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-46.1	173	0	0	0	0	0	113	L263 L294 A306 C321 A322 L323 R327 L328 L329	L263-A325 HydrophobicContact CD1-CB 3.24Å; L263-A325 HydrophobicContact CG-CB 4.45Å; L294-A325 HydrophobicContact CD1-CB 4.33Å; L294-A325 HydrophobicContact CD2-CB 3.85Å; A306-A325 HydrophobicContact CB-CB 3.58Å; C321-A325 VanDerWaalsContact O-CB 3.3Å; C321-A325 WeakPolarHBondContact O-CB 3.42Å; C321-A325 PolarHBondContact O-N 3.4Å; A322-A325 PolarHBondContact O-N 3.16Å; L323-A325 VanDerWaalsContact C-N 3.26Å; L323-A325 PolarHBondContact O-N 3.02Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.35Å; A325-L328 PolarHBondContact O-N 3.13Å; A325-L329 VanDerWaalsContact O-CG 3.29Å; A325-L329 WeakPolarHBondContact O-CG 3.45Å; A325-L329 PolarHBondContact O-N 3.34Å
326	C	90.4	Very high	87.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-42	176.4	-66.3	0	0	0	0	111.5	Y255 A322 L323 L328 L329 D330 L335	Y255-C326 HydrophobicContact CD1-CB 4.26Å; Y255-C326 HydrophobicContact CD2-CB 3.58Å; Y255-C326 HydrophobicContact CE2-CB 4.17Å; Y255-C326 HydrophobicContact CG-CB 3.61Å; A322-C326 PolarHBondContact O-N 3.34Å; A322-C326 PolarHBondContact O-SG 2.94Å; L323-C326 PolarHBondContact O-N 2.91Å; L323-C326 VanDerWaalsContact O-N 3.15Å; C326-L328 PolarHBondContact O-N 3.44Å; C326-L329 PolarHBondContact O-N 3.37Å; C326-D330 WeakPolarHBondContact O-CB 3.19Å; C326-D330 PolarHBondContact O-N 3.48Å; C326-L335 HydrophobicContact CB-CD2 4.12Å
327	R	90.3	Very high	86.6	Confident	110 Å²	110	41.1 Å²	41.1	42%	0.415	22%	0.215	S	C	.	.	H	α-helix	trans	-58.9	-44	174.7	-75.8	178.1	169.1	158.6	-1.4	112.7	Y255 L323 N324 A325 D330 A331	Y255-R327 HydrophobicContact CE2-CG 3.86Å; L323-R327 HydrophobicContact CD2-CG 4.01Å; L323-R327 VanDerWaalsContact CD2-NE 3.32Å; L323-R327 PolarHBondContact O-N 3.37Å; N324-R327 PolarHBondContact O-N 3.16Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.35Å; R327-D330 PolarHBondContact O-N 2.94Å; R327-A331 VanDerWaalsContact O-CB 3.3Å; R327-A331 WeakPolarHBondContact O-CB 3.18Å; R327-A331 PolarHBondContact O-N 3.34Å
328	L	88.6	Confident	85	Confident	65 Å²	65	44.2 Å²	44.2	34%	0.34	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-41.5	176.3	-73.9	169.5	0	0	0	111.8	L294 T304 A306 N324 A325 C326 A331 Q332	L294-L328 HydrophobicContact CD1-CB 3.77Å; L294-L328 HydrophobicContact CD1-CD1 3.76Å; L294-L328 HydrophobicContact CD1-CG 4.43Å; T304-L328 HydrophobicContact CG2-CD1 4.3Å; A306-L328 HydrophobicContact CB-CD1 4.16Å; N324-L328 WeakPolarHBondContact O-CG 3.27Å; N324-L328 PolarHBondContact O-N 2.78Å; A325-L328 PolarHBondContact O-N 3.13Å; C326-L328 PolarHBondContact O-N 3.44Å; L328-A331 PolarHBondContact O-N 3Å; L328-Q332 WeakPolarHBondContact O-CG 3.45Å; L328-Q332 PolarHBondContact O-N 3.01Å
329	L	87.6	Confident	83.5	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.2	-35.7	178.6	-67.1	168.3	0	0	0	112.8	F266 L294 I296 A325 C326 G333 I334 L335	F266-L329 HydrophobicContact CD1-CD1 3.58Å; F266-L329 HydrophobicContact CD1-CD2 4.25Å; F266-L329 HydrophobicContact CD2-CD1 4.36Å; F266-L329 HydrophobicContact CE1-CD1 3.82Å; F266-L329 HydrophobicContact CE1-CD2 3.6Å; F266-L329 HydrophobicContact CE1-CG 4.37Å; F266-L329 HydrophobicContact CE2-CD2 4.22Å; F266-L329 HydrophobicContact CG-CD1 3.88Å; F266-L329 HydrophobicContact CZ-CD1 4.3Å; F266-L329 HydrophobicContact CZ-CD2 3.57Å; L294-L329 HydrophobicContact CD2-CD1 4.18Å; L294-L329 HydrophobicContact CD2-CD2 4.38Å; L294-L329 HydrophobicContact CD2-CG 4.29Å; I296-L329 HydrophobicContact CD1-CD2 3.39Å; I296-L329 HydrophobicContact CD1-CG 4.23Å; I296-L329 HydrophobicContact CG1-CD2 3.93Å; A325-L329 VanDerWaalsContact O-CG 3.29Å; A325-L329 WeakPolarHBondContact O-CG 3.45Å; A325-L329 PolarHBondContact O-N 3.34Å; C326-L329 PolarHBondContact O-N 3.37Å; L329-G333 PolarHBondContact O-N 3.38Å; L329-I334 PolarHBondContact O-N 3.33Å; L329-L335 HydrophobicContact CB-CB 3.86Å; L329-L335 HydrophobicContact CB-CD1 3.89Å; L329-L335 HydrophobicContact CB-CG 4.37Å; L329-L335 HydrophobicContact CD1-CD1 3.69Å; L329-L335 HydrophobicContact CG-CD1 4.45Å; L329-L335 PolarHBondContact O-N 2.89Å
330	D	86.3	Confident	81.9	Confident	19 Å²	19	47 Å²	47	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-74.1	-35.5	175.5	-93.4	-33.1	0	0	0	112.5	Y255 C326 R327 Q332 G333 L335 R336	Y255-D330 WeakPolarHBondContact CD1-OD2 3.36Å; Y255-D330 WeakPolarHBondContact CE1-OD2 3.45Å; C326-D330 WeakPolarHBondContact O-CB 3.19Å; C326-D330 PolarHBondContact O-N 3.48Å; R327-D330 PolarHBondContact O-N 2.94Å; D330-Q332 PolarHBondContact O-N 3Å; D330-G333 WeakPolarHBondContact O-CA 3.3Å; D330-G333 PolarHBondContact O-N 2.93Å; D330-L335 VanDerWaalsContact CG-CD2 3.47Å; D330-L335 VanDerWaalsContact OD1-CB 3.31Å; D330-L335 WeakPolarHBondContact OD1-CB 2.92Å; D330-L335 WeakPolarHBondContact OD2-CD2 3.42Å; D330-R336 IonicContact OD1-NE 3.73Å
331	A	85	Confident	80.2	Confident	81 Å²	81	49.6 Å²	49.6	67%	0.669	27%	0.266	S	S	*	.	H	α-helix	trans	-61.6	-31	173.2	0	0	0	0	0	112.3	R327 L328 G333	R327-A331 VanDerWaalsContact O-CB 3.3Å; R327-A331 WeakPolarHBondContact O-CB 3.18Å; R327-A331 PolarHBondContact O-N 3.34Å; L328-A331 PolarHBondContact O-N 3Å; A331-G333 VanDerWaalsContact C-N 3.34Å
332	Q	82.6	Confident	78.4	Confident	121 Å²	121	52.2 Å²	52.2	57%	0.565	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.5	172.7	-59.9	-58.4	-33.6	0	0	113.2	I296 L328 D330 I334	I296-Q332 HydrophobicContact CD1-CG 4.02Å; I296-Q332 HydrophobicContact CG2-CG 4.07Å; L328-Q332 WeakPolarHBondContact O-CG 3.45Å; L328-Q332 PolarHBondContact O-N 3.01Å; D330-Q332 PolarHBondContact O-N 3Å; Q332-I334 HydrophobicContact CB-CD1 3.82Å; Q332-I334 HydrophobicContact CB-CG1 3.77Å; Q332-I334 WeakPolarHBondContact O-CG1 2.92Å; Q332-I334 PolarHBondContact O-N 3.32Å
333	G	80	Confident	76.8	Confident	27 Å²	27	59.7 Å²	59.7	28%	0.278	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	15.7	-178.2	0	0	0	0	0	114.9	L329 D330 A331 K337	L329-G333 PolarHBondContact O-N 3.38Å; D330-G333 WeakPolarHBondContact O-CA 3.3Å; D330-G333 PolarHBondContact O-N 2.93Å; A331-G333 VanDerWaalsContact C-N 3.34Å; G333-K337 WeakPolarHBondContact O-CG 3.41Å
334	I	81.4	Confident	75.2	Confident	37 Å²	37	67 Å²	67	19%	0.19	34%	0.342	C	S	.	.			trans	-90.6	-32.2	-173.8	-46	176.5	0	0	0	111.4	F266 I296 L329 Q332 R336 K337	F266-I334 HydrophobicContact CE2-CB 4.35Å; F266-I334 HydrophobicContact CE2-CG2 3.78Å; F266-I334 HydrophobicContact CZ-CG2 4.04Å; I296-I334 HydrophobicContact CG1-CD1 4.24Å; L329-I334 PolarHBondContact O-N 3.33Å; Q332-I334 HydrophobicContact CB-CD1 3.82Å; Q332-I334 HydrophobicContact CB-CG1 3.77Å; Q332-I334 WeakPolarHBondContact O-CG1 2.92Å; Q332-I334 PolarHBondContact O-N 3.32Å; I334-R336 PolarHBondContact O-N 2.8Å; I334-K337 HydrophobicContact CG2-CD 4.25Å; I334-K337 PolarHBondContact O-N 2.87Å
335	L	75.9	Confident	73.7	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.016	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.6	-172.7	-166.9	69.8	0	0	0	114	Y255 F266 C326 L329 D330	Y255-L335 HydrophobicContact CD1-CD2 4.13Å; F266-L335 HydrophobicContact CB-CD1 3.88Å; F266-L335 HydrophobicContact CD2-CD1 3.97Å; F266-L335 HydrophobicContact CG-CD1 4.01Å; C326-L335 HydrophobicContact CB-CD2 4.12Å; L329-L335 HydrophobicContact CB-CB 3.86Å; L329-L335 HydrophobicContact CB-CD1 3.89Å; L329-L335 HydrophobicContact CB-CG 4.37Å; L329-L335 HydrophobicContact CD1-CD1 3.69Å; L329-L335 HydrophobicContact CG-CD1 4.45Å; L329-L335 PolarHBondContact O-N 2.89Å; D330-L335 VanDerWaalsContact CG-CD2 3.47Å; D330-L335 VanDerWaalsContact OD1-CB 3.31Å; D330-L335 WeakPolarHBondContact OD1-CB 2.92Å; D330-L335 WeakPolarHBondContact OD2-CD2 3.42Å
336	R	69.6	Low	72.1	Confident	41 Å²	41	76.6 Å²	76.6	16%	0.155	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	6.1	-169	-69.8	179.5	176.7	-110.3	20.6	115.9	Q250 R251 D330 I334 S338 A339 Q340	Q250-R336 PolarHBondContact O-NH2 3.37Å; R251-R336 VanDerWaalsContact C-NH2 3.31Å; R251-R336 PolarHBondContact O-NH2 3.28Å; D330-R336 IonicContact OD1-NE 3.73Å; I334-R336 PolarHBondContact O-N 2.8Å; R336-S338 PolarHBondContact O-N 2.8Å; R336-A339 PolarHBondContact O-N 2.87Å; R336-Q340 PolarHBondContact O-N 2.84Å
337	K	66.9	Low	70.5	Confident	120 Å²	120	82 Å²	82	52%	0.522	41%	0.409	S	S	.	.	H	α-helix	trans	-44	-42.2	-173.2	-73.8	179	174.5	175.9	0	113.3	G333 I334 A339 E341	G333-K337 WeakPolarHBondContact O-CG 3.41Å; I334-K337 HydrophobicContact CG2-CD 4.25Å; I334-K337 PolarHBondContact O-N 2.87Å; K337-A339 PolarHBondContact O-N 3.28Å; K337-E341 WeakPolarHBondContact O-CB 3.34Å; K337-E341 PolarHBondContact O-N 3.36Å; K337-E341 VanDerWaalsContact O-N 3.11Å
338	S	58.1	Low	69.1	Low	66 Å²	66	84.2 Å²	84.2	46%	0.462	42%	0.422	S	S	.	.	H	α-helix	trans	-68.7	-30.3	-180	69.5	0	0	0	0	115.9	R336 S342	R336-S338 PolarHBondContact O-N 2.8Å; S338-S342 WeakPolarHBondContact O-CB 3.45Å; S338-S342 PolarHBondContact O-N 2.86Å; S338-S342 VanDerWaalsContact O-N 3.17Å; S338-S342 PolarHBondContact O-OG 2.8Å
339	A	61	Low	67.7	Low	47 Å²	47	84.7 Å²	84.7	39%	0.388	42%	0.424	S	S	.	.	H	α-helix	trans	-81.4	-25.7	-176.7	0	0	0	0	0	112.6	R336 K337 S342	R336-A339 PolarHBondContact O-N 2.87Å; K337-A339 PolarHBondContact O-N 3.28Å; A339-S342 PolarHBondContact O-OG 3.12Å
340	Q	59.2	Low	66.4	Low	96 Å²	96	90 Å²	90	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-84	-36.6	172.8	-67.9	-172.4	-62.1	0	0	110.9	R336 K343 R344	R336-Q340 PolarHBondContact O-N 2.84Å; Q340-K343 PolarHBondContact O-N 2.78Å; Q340-R344 WeakPolarHBondContact O-CG 3.27Å; Q340-R344 PolarHBondContact O-N 3.4Å; Q340-R344 VanDerWaalsContact O-N 3.12Å
341	E	56.3	Low	65.2	Low	130 Å²	130	97.5 Å²	97.5	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-65.6	-42.3	177.6	-164.1	157	-157.1	0	0	112	K337 K343 R344 T345	K337-E341 WeakPolarHBondContact O-CB 3.34Å; K337-E341 PolarHBondContact O-N 3.36Å; K337-E341 VanDerWaalsContact O-N 3.11Å; E341-K343 VanDerWaalsContact C-N 3.29Å; E341-K343 PolarHBondContact O-N 2.77Å; E341-R344 PolarHBondContact O-N 3.02Å; E341-T345 WeakPolarHBondContact O-CG2 3.4Å; E341-T345 PolarHBondContact O-N 3.14Å; E341-T345 PolarHBondContact O-OG1 2.78Å
342	S	56.2	Low	64.1	Low	55 Å²	55	97 Å²	97	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-29.6	176.9	64.7	0	0	0	0	114.4	S338 A339 T345 R346	S338-S342 WeakPolarHBondContact O-CB 3.45Å; S338-S342 PolarHBondContact O-N 2.86Å; S338-S342 VanDerWaalsContact O-N 3.17Å; S338-S342 PolarHBondContact O-OG 2.8Å; A339-S342 PolarHBondContact O-OG 3.12Å; S342-T345 WeakPolarHBondContact CA-OG1 3.02Å; S342-T345 PolarHBondContact O-OG1 2.82Å; S342-T345 VanDerWaalsContact O-OG1 3.06Å; S342-R346 WeakPolarHBondContact O-CB 3.35Å; S342-R346 VanDerWaalsContact O-CG 3.25Å; S342-R346 WeakPolarHBondContact O-CG 3.38Å; S342-R346 PolarHBondContact O-N 2.82Å
343	K	59.9	Low	62.9	Low	157 Å²	157	95 Å²	95	68%	0.683	48%	0.475	S	S	*	.	H	α-helix	trans	-74.9	-41.2	174.4	-76.7	-172.8	175	-166.5	0	111.7	Q340 E341 R346 M347	Q340-K343 PolarHBondContact O-N 2.78Å; E341-K343 VanDerWaalsContact C-N 3.29Å; E341-K343 PolarHBondContact O-N 2.77Å; K343-R346 PolarHBondContact O-N 2.88Å; K343-M347 PolarHBondContact O-N 2.76Å
344	R	59.4	Low	62	Low	181 Å²	181	96.6 Å²	96.6	68%	0.683	48%	0.478	S	S	*	.	H	α-helix	trans	-67.1	-38.5	178.1	-69.5	-177.5	81.3	-167.1	10.8	111.9	Q340 E341 K348	Q340-R344 WeakPolarHBondContact O-CG 3.27Å; Q340-R344 PolarHBondContact O-N 3.4Å; Q340-R344 VanDerWaalsContact O-N 3.12Å; E341-R344 PolarHBondContact O-N 3.02Å; R344-K348 WeakPolarHBondContact O-CB 3.31Å; R344-K348 PolarHBondContact O-N 2.79Å; R344-K348 VanDerWaalsContact O-N 3.15Å
345	T	59.5	Low	60.7	Low	69 Å²	69	102.8 Å²	102.8	42%	0.423	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-49.8	173.6	57.5	0	0	0	0	109.9	E341 S342 M347 K348 D349	E341-T345 WeakPolarHBondContact O-CG2 3.4Å; E341-T345 PolarHBondContact O-N 3.14Å; E341-T345 PolarHBondContact O-OG1 2.78Å; S342-T345 WeakPolarHBondContact CA-OG1 3.02Å; S342-T345 PolarHBondContact O-OG1 2.82Å; S342-T345 VanDerWaalsContact O-OG1 3.06Å; T345-M347 PolarHBondContact O-N 2.84Å; T345-K348 PolarHBondContact O-N 3.24Å; T345-K348 VanDerWaalsContact O-N 3.16Å; T345-D349 VanDerWaalsContact O-CB 3.27Å; T345-D349 WeakPolarHBondContact O-CB 3.43Å; T345-D349 PolarHBondContact O-N 3.21Å; T345-D349 VanDerWaalsContact O-OD2 3.07Å
346	R	58.9	Low	59.7	Low	183 Å²	183	111.6 Å²	111.6	69%	0.691	53%	0.534	S	S	*	.	H	α-helix	trans	-56.3	-44.3	178.1	-77.5	177.7	180	-166.9	-2.2	114.1	S342 K343 D349 L350	S342-R346 WeakPolarHBondContact O-CB 3.35Å; S342-R346 VanDerWaalsContact O-CG 3.25Å; S342-R346 WeakPolarHBondContact O-CG 3.38Å; S342-R346 PolarHBondContact O-N 2.82Å; K343-R346 PolarHBondContact O-N 2.88Å; R346-D349 PolarHBondContact O-N 3.11Å; R346-L350 WeakPolarHBondContact O-CD1 3.4Å; R346-L350 WeakPolarHBondContact O-CG 3.4Å; R346-L350 PolarHBondContact O-N 3.49Å
347	M	58.9	Low	58.9	Low	115 Å²	115	115.1 Å²	115.1	57%	0.567	56%	0.556	S	S	*	*	H	α-helix	trans	-67.7	-37.1	179.5	-168.2	-178.2	176.6	0	0	112.5	K343 T345 L350	K343-M347 PolarHBondContact O-N 2.76Å; T345-M347 PolarHBondContact O-N 2.84Å; M347-L350 PolarHBondContact O-N 2.77Å
348	K	59.7	Low	58.4	Low	156 Å²	156	114.6 Å²	114.6	68%	0.678	57%	0.568	S	S	*	*	H	α-helix	trans	-75.5	-32.1	177.1	-162.5	165.9	-173.8	171.5	0	112.2	R344 T345 L350 A352	R344-K348 WeakPolarHBondContact O-CB 3.31Å; R344-K348 PolarHBondContact O-N 2.79Å; R344-K348 VanDerWaalsContact O-N 3.15Å; T345-K348 PolarHBondContact O-N 3.24Å; T345-K348 VanDerWaalsContact O-N 3.16Å; K348-L350 VanDerWaalsContact C-N 3.33Å; K348-A352 WeakPolarHBondContact O-CB 3.38Å; K348-A352 PolarHBondContact O-N 3.06Å
349	D	59.9	Low	58.2	Low	75 Å²	75	119 Å²	119	40%	0.401	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-36	172.3	-65.4	-21.5	0	0	0	109.9	T345 R346 E351 A352 N353	T345-D349 VanDerWaalsContact O-CB 3.27Å; T345-D349 WeakPolarHBondContact O-CB 3.43Å; T345-D349 PolarHBondContact O-N 3.21Å; T345-D349 VanDerWaalsContact O-OD2 3.07Å; R346-D349 PolarHBondContact O-N 3.11Å; D349-E351 PolarHBondContact O-N 3.39Å; D349-A352 CarbonylContact O-C 3.49Å; D349-A352 PolarHBondContact O-N 2.7Å; D349-N353 WeakPolarHBondContact O-CA 3.46Å; D349-N353 WeakPolarHBondContact O-CB 3.21Å; D349-N353 PolarHBondContact O-N 2.88Å; D349-N353 PolarHBondContact O-ND2 3.28Å; D349-N353 PolarHBondContact O-OD1 3.44Å
350	L	60.2	Low	58	Low	112 Å²	112	123.2 Å²	123.2	59%	0.586	60%	0.598	S	S	*	*	H	α-helix	trans	-62.4	-40.3	176.4	-79.8	154.7	0	0	0	113.9	R346 M347 K348	R346-L350 WeakPolarHBondContact O-CD1 3.4Å; R346-L350 WeakPolarHBondContact O-CG 3.4Å; R346-L350 PolarHBondContact O-N 3.49Å; M347-L350 PolarHBondContact O-N 2.77Å; K348-L350 VanDerWaalsContact C-N 3.33Å
351	E	61.7	Low	58.2	Low	175 Å²	175	123.8 Å²	123.8	82%	0.818	60%	0.604	S	S	*	*	H	α-helix	trans	-73.6	-30.2	176	-166.8	177.9	-163.9	0	0	112.1	D349	D349-E351 PolarHBondContact O-N 3.39Å
352	A	60.6	Low	58.7	Low	70 Å²	70	121.4 Å²	121.4	58%	0.579	60%	0.598	S	S	*	*	H	α-helix	trans	-85.8	-26.7	179.3	0	0	0	0	0	114	K348 D349	K348-A352 WeakPolarHBondContact O-CB 3.38Å; K348-A352 PolarHBondContact O-N 3.06Å; D349-A352 CarbonylContact O-C 3.49Å; D349-A352 PolarHBondContact O-N 2.7Å
353	N	57.4	Low	59.1	Low	79 Å²	79	126.4 Å²	126.4	42%	0.422	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.1	-4.9	-173.4	-65.8	-8.4	0	0	0	113.4	D349 Y355	D349-N353 WeakPolarHBondContact O-CA 3.46Å; D349-N353 WeakPolarHBondContact O-CB 3.21Å; D349-N353 PolarHBondContact O-N 2.88Å; D349-N353 PolarHBondContact O-ND2 3.28Å; D349-N353 PolarHBondContact O-OD1 3.44Å; N353-Y355 PolarHBondContact O-N 3.34Å; N353-Y355 VanDerWaalsContact O-N 3.11Å
354	D	60.7	Low	59.5	Low	61 Å²	61	128.7 Å²	128.7	33%	0.326	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	6.1	178.9	-151.7	24.3	0	0	0	113.4	R377	D354-R377 IonicContact OD1-CZ 3.93Å; D354-R377 IonicContact OD1-NE 3.53Å; D354-R377 PolarHBondContact OD1-NE 2.79Å; D354-R377 IonicContact OD1-NH2 3.95Å; D354-R377 PolarHBondContact OD1-NH2 2.82Å; D354-R377 IonicContact OD2-NE 2.69Å
355	Y	54.6	Low	60	Low	167 Å²	167	121.7 Å²	121.7	66%	0.655	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-36.8	-178.5	-140	-119.3	0	0	0	116.2	N353	N353-Y355 PolarHBondContact O-N 3.34Å; N353-Y355 VanDerWaalsContact O-N 3.11Å
356	Y	55	Low	60.5	Low	189 Å²	189	130.4 Å²	130.4	74%	0.741	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.4	56.3	-178.9	-69.8	-67.1	0	0	0	114.7	S358	Y356-S358 PolarHBondContact O-N 2.79Å; Y356-S358 VanDerWaalsContact O-N 3.13Å
357	D	54	Low	61.2	Low	115 Å²	115	127.1 Å²	127.1	62%	0.615	62%	0.621	S	S	*	*			trans	-72.2	107.2	160.3	-102.1	-18.9	0	0	0	108.1	D359 E360	D357-D359 PolarHBondContact O-N 3.17Å; D357-E360 PolarHBondContact O-N 2.85Å
358	S	55.1	Low	62.1	Low	109 Å²	109	123.4 Å²	123.4	76%	0.762	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	5.7	-156	61.4	0	0	0	0	117.1	Y356	Y356-S358 PolarHBondContact O-N 2.79Å; Y356-S358 VanDerWaalsContact O-N 3.13Å
359	D	53.7	Low	62.9	Low	157 Å²	157	120.4 Å²	120.4	84%	0.84	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	-1.6	-176	-80	-7.5	0	0	0	114.1	D357	D357-D359 PolarHBondContact O-N 3.17Å
360	E	56.7	Low	63.4	Low	137 Å²	137	119.1 Å²	119.1	64%	0.64	59%	0.593	S	S	*	*			trans	-113.2	46.8	174	-66.1	-163.8	169	0	0	112.9	D357 L370	D357-E360 PolarHBondContact O-N 2.85Å; E360-L370 HydrophobicContact CB-CD1 4.49Å
361	D	64.8	Low	64	Low	107 Å²	107	117 Å²	117	57%	0.572	58%	0.58	S	S	*	*			trans	-72.4	135.5	174.4	-165.1	-1.1	0	0	0	111.4	F363 Y364	D361-F363 PolarHBondContact O-N 3.31Å; D361-Y364 PolarHBondContact O-N 3.15Å
362	T	65.9	Low	64.9	Low	80 Å²	80	114.5 Å²	114.5	49%	0.491	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48	-16	172.6	42.9	0	0	0	0	115.4	Y364 D365	T362-Y364 PolarHBondContact O-N 3.34Å; T362-D365 PolarHBondContact O-N 3.05Å
363	F	65.9	Low	65.7	Low	161 Å²	161	117.1 Å²	117.1	71%	0.706	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-33.8	-176.5	-172.1	-103.2	0	0	0	114.5	D361	D361-F363 PolarHBondContact O-N 3.31Å
364	Y	68.1	Low	66.6	Low	204 Å²	204	118.2 Å²	118.2	80%	0.8	56%	0.56	S	S	*	*	S	Bend	trans	-96.7	-10.2	-178.5	-75.1	-74.9	0	0	0	114.6	D361 T362 R366	D361-Y364 PolarHBondContact O-N 3.15Å; T362-Y364 PolarHBondContact O-N 3.34Å; Y364-R366 PolarHBondContact O-N 3.12Å
365	D	69.3	Low	67.3	Low	35 Å²	35	120.6 Å²	120.6	19%	0.187	57%	0.569	C	S	.	*			trans	-84.4	96	-178.9	-175.3	8.8	0	0	0	111.7	T362 T367 G368 E369 L370	T362-D365 PolarHBondContact O-N 3.05Å; D365-T367 VanDerWaalsContact C-N 3.28Å; D365-T367 VanDerWaalsContact OD1-CA 3.31Å; D365-T367 WeakPolarHBondContact OD1-CA 3.16Å; D365-T367 WeakPolarHBondContact OD1-CB 3.06Å; D365-T367 PolarHBondContact OD1-N 3.07Å; D365-T367 PolarHBondContact OD1-OG1 3.33Å; D365-G368 PolarHBondContact OD1-N 3Å; D365-G368 WeakPolarHBondContact OD2-CA 3.38Å; D365-G368 PolarHBondContact OD2-N 3.09Å; D365-E369 PolarHBondContact OD2-N 3.16Å; D365-L370 HydrophobicContact CB-CB 4.48Å; D365-L370 HydrophobicContact CB-CD1 3.93Å; D365-L370 HydrophobicContact CB-CG 4.28Å; D365-L370 WeakPolarHBondContact OD2-CB 3.49Å; D365-L370 PolarHBondContact OD2-N 3.4Å
366	R	68.9	Low	68.3	Low	251 Å²	251	117.8 Å²	117.8	95%	0.947	56%	0.56	S	S	*	*	S	Bend	trans	-77	-13.2	170.9	-68.8	-177.1	175.7	174.6	-0.3	113.4	Y364	Y364-R366 PolarHBondContact O-N 3.12Å
367	T	74.4	Confident	69.1	Low	115 Å²	115	114.9 Å²	114.9	71%	0.706	55%	0.548	S	S	*	.	S	Bend	trans	-91.8	-15.9	-176.7	27.9	0	0	0	0	113.3	D365 E369	D365-T367 VanDerWaalsContact C-N 3.28Å; D365-T367 VanDerWaalsContact OD1-CA 3.31Å; D365-T367 WeakPolarHBondContact OD1-CA 3.16Å; D365-T367 WeakPolarHBondContact OD1-CB 3.06Å; D365-T367 PolarHBondContact OD1-N 3.07Å; D365-T367 PolarHBondContact OD1-OG1 3.33Å; T367-E369 PolarHBondContact O-N 3.04Å
368	G	77.9	Confident	70	Confident	36 Å²	36	112.4 Å²	112.4	37%	0.371	53%	0.534	S	S	.	.			trans	67.6	18.9	179.3	0	0	0	0	0	113.5	D365 R372	D365-G368 PolarHBondContact OD1-N 3Å; D365-G368 WeakPolarHBondContact OD2-CA 3.38Å; D365-G368 PolarHBondContact OD2-N 3.09Å; G368-R372 WeakPolarHBondContact O-CB 3.47Å; G368-R372 PolarHBondContact O-N 2.97Å; G368-R372 VanDerWaalsContact O-N 3.09Å
369	E	77.1	Confident	70.7	Confident	93 Å²	93	113.6 Å²	113.6	44%	0.435	53%	0.527	S	S	.	.	H	α-helix	trans	-74	-38.9	-179.4	-72.3	-155	131.6	0	0	112.6	D365 T367 R372 K373	D365-E369 PolarHBondContact OD2-N 3.16Å; T367-E369 PolarHBondContact O-N 3.04Å; E369-R372 PolarHBondContact O-N 3.02Å; E369-R372 IonicContact OE1-NH2 2.78Å; E369-R372 PolarHBondContact OE1-NH2 3.02Å; E369-R372 VanDerWaalsContact OE1-NH2 3.07Å; E369-K373 WeakPolarHBondContact O-CB 3.38Å; E369-K373 WeakPolarHBondContact O-CG 3.41Å; E369-K373 PolarHBondContact O-N 3.14Å
370	L	69	Low	71.4	Confident	49 Å²	49	112.6 Å²	112.6	26%	0.257	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176.1	-70.4	178.1	0	0	0	110.1	E360 D365 R372 K373 R374	E360-L370 HydrophobicContact CB-CD1 4.49Å; D365-L370 HydrophobicContact CB-CB 4.48Å; D365-L370 HydrophobicContact CB-CD1 3.93Å; D365-L370 HydrophobicContact CB-CG 4.28Å; D365-L370 WeakPolarHBondContact OD2-CB 3.49Å; D365-L370 PolarHBondContact OD2-N 3.4Å; L370-R372 VanDerWaalsContact C-N 3.35Å; L370-R372 PolarHBondContact O-N 3.15Å; L370-K373 PolarHBondContact O-N 3.31Å; L370-R374 VanDerWaalsContact O-CB 3.32Å; L370-R374 WeakPolarHBondContact O-CB 3.44Å; L370-R374 PolarHBondContact O-N 3.29Å
371	E	74.7	Confident	71.8	Confident	66 Å²	66	110.5 Å²	110.5	31%	0.308	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-39.2	177.6	-171.8	57	-147.2	0	0	111.5	R374 Q375	E371-R374 PolarHBondContact O-N 3.44Å; E371-R374 IonicContact OE1-NH1 3.4Å; E371-Q375 WeakPolarHBondContact O-CB 3.16Å; E371-Q375 VanDerWaalsContact O-CG 3.28Å; E371-Q375 WeakPolarHBondContact O-CG 3.03Å; E371-Q375 PolarHBondContact O-N 3.25Å; E371-Q375 PolarHBondContact OE1-NE2 2.79Å
372	R	78.7	Confident	72.1	Confident	123 Å²	123	110 Å²	110	46%	0.464	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-41.8	175.4	-174.8	-178.7	63	160.1	-5.5	112.2	G368 E369 L370 Q375 K376	G368-R372 WeakPolarHBondContact O-CB 3.47Å; G368-R372 PolarHBondContact O-N 2.97Å; G368-R372 VanDerWaalsContact O-N 3.09Å; E369-R372 PolarHBondContact O-N 3.02Å; E369-R372 IonicContact OE1-NH2 2.78Å; E369-R372 PolarHBondContact OE1-NH2 3.02Å; E369-R372 VanDerWaalsContact OE1-NH2 3.07Å; L370-R372 VanDerWaalsContact C-N 3.35Å; L370-R372 PolarHBondContact O-N 3.15Å; R372-Q375 PolarHBondContact O-N 2.97Å; R372-K376 WeakPolarHBondContact O-CG 3.28Å; R372-K376 PolarHBondContact O-N 3.21Å
373	K	79	Confident	71.9	Confident	126 Å²	126	110.5 Å²	110.5	55%	0.548	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-44.1	176	-78	-178.6	178.3	179.1	0	110.6	E369 L370 Q375 K376 R377	E369-K373 WeakPolarHBondContact O-CB 3.38Å; E369-K373 WeakPolarHBondContact O-CG 3.41Å; E369-K373 PolarHBondContact O-N 3.14Å; L370-K373 PolarHBondContact O-N 3.31Å; K373-Q375 PolarHBondContact O-N 3.01Å; K373-K376 WeakPolarHBondContact O-CB 3.37Å; K373-K376 PolarHBondContact O-N 3.25Å; K373-R377 PolarHBondContact O-N 2.88Å
374	R	75.3	Confident	71.7	Confident	102 Å²	102	108.7 Å²	108.7	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-59	-46.3	174.5	-174.4	175.1	179.8	-92.5	-5.3	112.1	L370 E371 K376 R377 I378	L370-R374 VanDerWaalsContact O-CB 3.32Å; L370-R374 WeakPolarHBondContact O-CB 3.44Å; L370-R374 PolarHBondContact O-N 3.29Å; E371-R374 PolarHBondContact O-N 3.44Å; E371-R374 IonicContact OE1-NH1 3.4Å; R374-K376 VanDerWaalsContact C-N 3.32Å; R374-K376 PolarHBondContact O-N 3.11Å; R374-R377 PolarHBondContact O-N 3.46Å; R374-I378 HydrophobicContact CG-CD1 4.01Å; R374-I378 VanDerWaalsContact O-CG1 3.31Å; R374-I378 WeakPolarHBondContact O-CG1 3.32Å; R374-I378 PolarHBondContact O-N 3.26Å
375	Q	76.4	Confident	71.2	Confident	110 Å²	110	101.6 Å²	101.6	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-38.9	175.5	-75.9	176.2	9.4	0	0	112.5	E371 R372 K373 I378 Q379	E371-Q375 WeakPolarHBondContact O-CB 3.16Å; E371-Q375 VanDerWaalsContact O-CG 3.28Å; E371-Q375 WeakPolarHBondContact O-CG 3.03Å; E371-Q375 PolarHBondContact O-N 3.25Å; E371-Q375 PolarHBondContact OE1-NE2 2.79Å; R372-Q375 PolarHBondContact O-N 2.97Å; K373-Q375 PolarHBondContact O-N 3.01Å; Q375-I378 PolarHBondContact O-N 3.28Å; Q375-Q379 VanDerWaalsContact O-CB 3.27Å; Q375-Q379 WeakPolarHBondContact O-CB 3.44Å; Q375-Q379 PolarHBondContact O-N 2.84Å
376	K	74.6	Confident	70.7	Confident	109 Å²	109	102.9 Å²	102.9	47%	0.474	54%	0.535	S	S	.	.	H	α-helix	trans	-63.5	-43.4	173.4	-75.3	179.2	178.6	-176.1	0	111.8	R372 K373 R374 Q379 M380	R372-K376 WeakPolarHBondContact O-CG 3.28Å; R372-K376 PolarHBondContact O-N 3.21Å; K373-K376 WeakPolarHBondContact O-CB 3.37Å; K373-K376 PolarHBondContact O-N 3.25Å; R374-K376 VanDerWaalsContact C-N 3.32Å; R374-K376 PolarHBondContact O-N 3.11Å; K376-Q379 PolarHBondContact O-N 3.18Å; K376-M380 WeakPolarHBondContact O-CB 3.39Å; K376-M380 WeakPolarHBondContact O-CG 3.33Å; K376-M380 PolarHBondContact O-N 2.79Å
377	R	71.1	Confident	70.4	Confident	127 Å²	127	99.8 Å²	99.8	48%	0.479	53%	0.529	S	S	.	.	H	α-helix	trans	-59.9	-45.4	174.9	-69.6	-163.9	-66	-133.5	0.1	111.5	D354 K373 R374 Q379 M380 S381	D354-R377 IonicContact OD1-CZ 3.93Å; D354-R377 IonicContact OD1-NE 3.53Å; D354-R377 PolarHBondContact OD1-NE 2.79Å; D354-R377 IonicContact OD1-NH2 3.95Å; D354-R377 PolarHBondContact OD1-NH2 2.82Å; D354-R377 IonicContact OD2-NE 2.69Å; K373-R377 PolarHBondContact O-N 2.88Å; R374-R377 PolarHBondContact O-N 3.46Å; R377-Q379 PolarHBondContact O-N 2.84Å; R377-M380 PolarHBondContact O-N 2.79Å; R377-S381 PolarHBondContact O-N 3.12Å; R377-S381 PolarHBondContact O-OG 3.49Å
378	I	73.8	Confident	70	Confident	63 Å²	63	99.1 Å²	99.1	32%	0.323	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-42.2	175.8	-64.1	164.4	0	0	0	111.2	R374 Q375 S381 T382	R374-I378 HydrophobicContact CG-CD1 4.01Å; R374-I378 VanDerWaalsContact O-CG1 3.31Å; R374-I378 WeakPolarHBondContact O-CG1 3.32Å; R374-I378 PolarHBondContact O-N 3.26Å; Q375-I378 PolarHBondContact O-N 3.28Å; I378-S381 PolarHBondContact O-N 3.28Å; I378-S381 PolarHBondContact O-OG 3.01Å; I378-T382 HydrophobicContact CG2-CG2 4.45Å; I378-T382 WeakPolarHBondContact O-CB 3.24Å; I378-T382 PolarHBondContact O-N 3.45Å; I378-T382 PolarHBondContact O-OG1 3.13Å
379	Q	70.5	Confident	70	Confident	134 Å²	134	103.4 Å²	103.4	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-66.7	-37.9	179.2	-171.6	174	38	0	0	111.7	Q375 K376 R377 N383	Q375-Q379 VanDerWaalsContact O-CB 3.27Å; Q375-Q379 WeakPolarHBondContact O-CB 3.44Å; Q375-Q379 PolarHBondContact O-N 2.84Å; K376-Q379 PolarHBondContact O-N 3.18Å; R377-Q379 PolarHBondContact O-N 2.84Å; Q379-N383 CarbonylContact O-C 3.54Å; Q379-N383 PolarHBondContact O-N 2.79Å
380	M	68	Low	70.3	Confident	137 Å²	137	102 Å²	102	68%	0.675	54%	0.539	S	S	*	.	H	α-helix	trans	-66.4	-39.4	174.2	-73.6	-173.9	-168.5	0	0	111.9	K376 R377 P384	K376-M380 WeakPolarHBondContact O-CB 3.39Å; K376-M380 WeakPolarHBondContact O-CG 3.33Å; K376-M380 PolarHBondContact O-N 2.79Å; R377-M380 PolarHBondContact O-N 2.79Å; M380-P384 WeakPolarHBondContact O-CA 3.49Å
381	S	65.5	Low	71.2	Confident	93 Å²	93	104.5 Å²	104.5	65%	0.65	55%	0.553	S	S	*	*	H	α-helix	trans	-74.2	-38.7	177.7	71.5	0	0	0	0	113.1	R377 I378	R377-S381 PolarHBondContact O-N 3.12Å; R377-S381 PolarHBondContact O-OG 3.49Å; I378-S381 PolarHBondContact O-N 3.28Å; I378-S381 PolarHBondContact O-OG 3.01Å
382	T	69.5	Low	72	Confident	96 Å²	96	104.2 Å²	104.2	59%	0.589	55%	0.549	S	S	*	.	H	α-helix	trans	-77.8	-30.2	179.5	42	0	0	0	0	113.7	I378	I378-T382 HydrophobicContact CG2-CG2 4.45Å; I378-T382 WeakPolarHBondContact O-CB 3.24Å; I378-T382 PolarHBondContact O-N 3.45Å; I378-T382 PolarHBondContact O-OG1 3.13Å
383	N	62.5	Low	72.6	Confident	90 Å²	90	103.8 Å²	103.8	48%	0.481	56%	0.556	S	S	.	*			trans	-143.6	78.9	179.2	-99.3	-18.4	0	0	0	110.6	Q379 G385 G386	Q379-N383 CarbonylContact O-C 3.54Å; Q379-N383 PolarHBondContact O-N 2.79Å; N383-G385 PolarHBondContact O-N 3.43Å; N383-G386 PolarHBondContact O-N 3.24Å; N383-G386 VanDerWaalsContact O-N 3.13Å
384	P	60.8	Low	73.3	Confident	124 Å²	124	100 Å²	100	81%	0.805	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-9.7	179.3	21.6	-32.2	0	0	0	113.9	M380	M380-P384 WeakPolarHBondContact O-CA 3.49Å
385	G	58.9	Low	74.1	Confident	54 Å²	54	95.5 Å²	95.5	56%	0.557	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-5.7	178.6	0	0	0	0	0	116.8	N383 K387	N383-G385 PolarHBondContact O-N 3.43Å; G385-K387 WeakPolarHBondContact O-CG 3.47Å; G385-K387 PolarHBondContact O-N 3.23Å
386	G	58.5	Low	74.9	Confident	63 Å²	63	94.2 Å²	94.2	65%	0.649	52%	0.521	S	S	*	.			trans	54	-0.2	178.8	0	0	0	0	0	118	N383 T388	N383-G386 PolarHBondContact O-N 3.24Å; N383-G386 VanDerWaalsContact O-N 3.13Å; G386-T388 PolarHBondContact O-N 2.73Å
387	K	61.9	Low	75.9	Confident	185 Å²	185	95.9 Å²	95.9	80%	0.804	53%	0.53	S	S	*	.			trans	-92.4	95	-174.6	-72.2	166.4	-172.6	179.1	0	109	G385	G385-K387 WeakPolarHBondContact O-CG 3.47Å; G385-K387 PolarHBondContact O-N 3.23Å
388	T	67.4	Low	77	Confident	101 Å²	101	93.6 Å²	93.6	62%	0.62	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-67.3	133.3	160.2	48.1	0	0	0	0	108.4	G386 D390	G386-T388 PolarHBondContact O-N 2.73Å; T388-D390 PolarHBondContact O-N 3.43Å
389	V	77.3	Confident	78	Confident	127 Å²	127	92 Å²	92	77%	0.77	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-77.1	119.7	178.1	178.8	0	0	0	0	108.3
390	D	82.7	Confident	79.2	Confident	64 Å²	64	88.2 Å²	88.2	34%	0.342	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-89.8	117.7	-178.7	-70.9	-18.5	0	0	0	111.4	T388 T394 L395 K398	T388-D390 PolarHBondContact O-N 3.43Å; D390-T394 WeakPolarHBondContact CA-OG1 3.43Å; D390-L395 HydrophobicContact CB-CD2 3.78Å; D390-L395 HydrophobicContact CB-CG 3.99Å; D390-K398 WeakPolarHBondContact OD1-CE 3.44Å; D390-K398 IonicContact OD1-NZ 2.78Å; D390-K398 PolarHBondContact OD1-NZ 3.34Å; D390-K398 IonicContact OD2-NZ 2.87Å; D390-K398 PolarHBondContact OD2-NZ 2.85Å
391	N	88	Confident	80.5	Confident	101 Å²	101	86 Å²	86	54%	0.54	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-85.8	163.4	170.3	-62.9	-18.3	0	0	0	111.2	D393 T394 L395	N391-D393 VanDerWaalsContact C-N 3.27Å; N391-D393 PolarHBondContact O-N 3.44Å; N391-T394 HydrophobicContact CB-CG2 4.4Å; N391-T394 PolarHBondContact N-OG1 3.5Å; N391-T394 PolarHBondContact O-N 2.87Å; N391-T394 PolarHBondContact O-OG1 3.16Å; N391-L395 PolarHBondContact O-N 3.15Å
392	Y	91.8	Very high	82	Confident	60 Å²	60	82.8 Å²	82.8	24%	0.235	47%	0.471	C	S	.	.	H	α-helix	trans	-49.1	-46.4	176.7	-179.9	-100.6	0	0	0	112.8	L395 Q396 I477 A480 R481	Y392-L395 PolarHBondContact O-N 2.94Å; Y392-Q396 HydrophobicContact CD1-CG 4.43Å; Y392-Q396 VanDerWaalsContact CE1-CD 3.47Å; Y392-Q396 HydrophobicContact CE1-CG 4.09Å; Y392-Q396 WeakPolarHBondContact O-CG 3.48Å; Y392-Q396 PolarHBondContact O-N 2.99Å; Y392-Q396 PolarHBondContact OH-NE2 3.21Å; Y392-I477 HydrophobicContact CD2-CG2 4.31Å; Y392-I477 HydrophobicContact CE2-CG2 3.57Å; Y392-A480 HydrophobicContact CD2-CB 4.28Å; Y392-R481 HydrophobicContact CD2-CB 4.46Å; Y392-R481 HydrophobicContact CE2-CB 3.98Å; Y392-R481 HydrophobicContact CE2-CG 4.21Å
393	D	91.8	Very high	83.2	Confident	114 Å²	114	82.3 Å²	82.3	61%	0.61	46%	0.461	S	S	*	.	H	α-helix	trans	-65.5	-41.5	179.8	-57.6	-28.9	0	0	0	112	N391 L395 Q396 E397	N391-D393 VanDerWaalsContact C-N 3.27Å; N391-D393 PolarHBondContact O-N 3.44Å; D393-L395 VanDerWaalsContact C-N 3.31Å; D393-L395 PolarHBondContact O-N 3.3Å; D393-Q396 WeakPolarHBondContact O-CB 3.36Å; D393-Q396 PolarHBondContact O-N 2.99Å; D393-E397 PolarHBondContact O-N 3.4Å
394	T	92.5	Very high	84.9	Confident	46 Å²	46	84 Å²	84	28%	0.282	46%	0.461	S	S	.	.	H	α-helix	trans	-66.9	-32.9	176.3	62.9	0	0	0	0	112.2	D390 N391 E397 K398	D390-T394 WeakPolarHBondContact CA-OG1 3.43Å; N391-T394 HydrophobicContact CB-CG2 4.4Å; N391-T394 PolarHBondContact N-OG1 3.5Å; N391-T394 PolarHBondContact O-N 2.87Å; N391-T394 PolarHBondContact O-OG1 3.16Å; T394-E397 PolarHBondContact O-N 2.97Å; T394-K398 WeakPolarHBondContact O-CB 3.28Å; T394-K398 VanDerWaalsContact O-CG 3.28Å; T394-K398 WeakPolarHBondContact O-CG 3.38Å; T394-K398 PolarHBondContact O-N 2.59Å
395	L	92.4	Very high	86.5	Confident	7 Å²	7	80.7 Å²	80.7	4%	0.037	43%	0.434	C	S	.	.	H	α-helix	trans	-69.5	-37.3	174.2	-69.9	173.3	0	0	0	111.5	D390 N391 Y392 D393 K398 L399 L476 I477 A480	D390-L395 HydrophobicContact CB-CD2 3.78Å; D390-L395 HydrophobicContact CB-CG 3.99Å; N391-L395 PolarHBondContact O-N 3.15Å; Y392-L395 PolarHBondContact O-N 2.94Å; D393-L395 VanDerWaalsContact C-N 3.31Å; D393-L395 PolarHBondContact O-N 3.3Å; L395-K398 PolarHBondContact O-N 2.84Å; L395-L399 WeakPolarHBondContact O-CB 3.33Å; L395-L399 PolarHBondContact O-N 3.2Å; L395-L476 HydrophobicContact CD1-CB 3.92Å; L395-L476 HydrophobicContact CD2-CB 4.27Å; L395-L476 HydrophobicContact CD2-CD1 4.22Å; L395-I477 HydrophobicContact CB-CD1 4.32Å; L395-I477 HydrophobicContact CB-CG1 3.65Å; L395-A480 HydrophobicContact CD1-CB 3.84Å
396	Q	94.3	Very high	88.3	Confident	84 Å²	84	78.6 Å²	78.6	39%	0.393	41%	0.411	S	S	.	.	H	α-helix	trans	-62.7	-42.8	173.2	-72.4	-170.6	-25.7	0	0	111.9	Y392 D393 L399 A400 I477	Y392-Q396 HydrophobicContact CD1-CG 4.43Å; Y392-Q396 VanDerWaalsContact CE1-CD 3.47Å; Y392-Q396 HydrophobicContact CE1-CG 4.09Å; Y392-Q396 WeakPolarHBondContact O-CG 3.48Å; Y392-Q396 PolarHBondContact O-N 2.99Å; Y392-Q396 PolarHBondContact OH-NE2 3.21Å; D393-Q396 WeakPolarHBondContact O-CB 3.36Å; D393-Q396 PolarHBondContact O-N 2.99Å; Q396-L399 PolarHBondContact O-N 3.44Å; Q396-A400 PolarHBondContact O-N 2.87Å; Q396-I477 HydrophobicContact CG-CD1 4.45Å
397	E	94.6	Very high	90.1	Very high	143 Å²	143	82 Å²	82	67%	0.668	41%	0.409	S	S	*	.	H	α-helix	trans	-63.2	-45.8	175.6	-173.1	175.7	-170.3	0	0	111.5	D393 T394 L399 A400 E401	D393-E397 PolarHBondContact O-N 3.4Å; T394-E397 PolarHBondContact O-N 2.97Å; E397-L399 VanDerWaalsContact C-N 3.3Å; E397-L399 PolarHBondContact O-N 3.07Å; E397-A400 WeakPolarHBondContact O-CB 3.47Å; E397-A400 PolarHBondContact O-N 3.41Å; E397-A400 VanDerWaalsContact O-N 3.15Å; E397-E401 PolarHBondContact O-N 3.08Å
398	K	93.7	Very high	91.8	Very high	80 Å²	80	79.9 Å²	79.9	35%	0.348	40%	0.396	S	S	.	.	H	α-helix	trans	-59.5	-39.5	174.2	-73.5	179.9	-172	-168.4	0	112.5	D390 T394 L395 E401 L402	D390-K398 WeakPolarHBondContact OD1-CE 3.44Å; D390-K398 IonicContact OD1-NZ 2.78Å; D390-K398 PolarHBondContact OD1-NZ 3.34Å; D390-K398 IonicContact OD2-NZ 2.87Å; D390-K398 PolarHBondContact OD2-NZ 2.85Å; T394-K398 WeakPolarHBondContact O-CB 3.28Å; T394-K398 VanDerWaalsContact O-CG 3.28Å; T394-K398 WeakPolarHBondContact O-CG 3.38Å; T394-K398 PolarHBondContact O-N 2.59Å; L395-K398 PolarHBondContact O-N 2.84Å; K398-E401 PolarHBondContact O-N 2.92Å; K398-L402 WeakPolarHBondContact O-CB 3.47Å; K398-L402 WeakPolarHBondContact O-CG 3.37Å; K398-L402 PolarHBondContact O-N 2.92Å
399	L	94.8	Very high	93	Very high	28 Å²	28	75.1 Å²	75.1	15%	0.147	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-42.4	175.7	175.2	160	0	0	0	111.3	L395 Q396 E397 E401 L402 K403 E474 I477	L395-L399 WeakPolarHBondContact O-CB 3.33Å; L395-L399 PolarHBondContact O-N 3.2Å; Q396-L399 PolarHBondContact O-N 3.44Å; E397-L399 VanDerWaalsContact C-N 3.3Å; E397-L399 PolarHBondContact O-N 3.07Å; L399-E401 VanDerWaalsContact C-N 3.32Å; L399-E401 PolarHBondContact O-N 3.43Å; L399-L402 PolarHBondContact O-N 2.92Å; L399-K403 HydrophobicContact CD2-CD 3.71Å; L399-K403 HydrophobicContact CD2-CG 4.25Å; L399-K403 WeakPolarHBondContact O-CG 3.4Å; L399-K403 PolarHBondContact O-N 3Å; L399-E474 HydrophobicContact CD1-CB 4.49Å; L399-E474 HydrophobicContact CD1-CG 3.44Å; L399-E474 VanDerWaalsContact CD1-CG 3.44Å; L399-E474 HydrophobicContact CG-CG 4.46Å; L399-I477 HydrophobicContact CB-CD1 3.81Å; L399-I477 HydrophobicContact CD1-CD1 3.38Å; L399-I477 HydrophobicContact CG-CD1 4.23Å
400	A	96	Very high	93.9	Very high	56 Å²	56	72.7 Å²	72.7	46%	0.463	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-41.7	176.7	0	0	0	0	0	111.5	Q396 E397 K403 R404	Q396-A400 PolarHBondContact O-N 2.87Å; E397-A400 WeakPolarHBondContact O-CB 3.47Å; E397-A400 PolarHBondContact O-N 3.41Å; E397-A400 VanDerWaalsContact O-N 3.15Å; A400-K403 PolarHBondContact O-N 2.98Å; A400-R404 PolarHBondContact O-N 3.1Å; A400-R404 VanDerWaalsContact O-N 3.1Å
401	E	95.9	Very high	94.5	Very high	89 Å²	89	72.2 Å²	72.2	42%	0.416	35%	0.352	S	S	.	.	H	α-helix	trans	-64.4	-44.1	175.8	-177.3	60.4	-166.5	0	0	112.2	E397 K398 L399 K403 R404 E405	E397-E401 PolarHBondContact O-N 3.08Å; K398-E401 PolarHBondContact O-N 2.92Å; L399-E401 VanDerWaalsContact C-N 3.32Å; L399-E401 PolarHBondContact O-N 3.43Å; E401-K403 PolarHBondContact O-N 3.15Å; E401-R404 PolarHBondContact O-N 3.32Å; E401-R404 IonicContact OE1-CZ 3.23Å; E401-R404 IonicContact OE1-NE 2.97Å; E401-R404 IonicContact OE1-NH2 2.6Å; E401-R404 PolarHBondContact OE1-NH2 2.89Å; E401-R404 IonicContact OE2-CZ 2.68Å; E401-R404 VanDerWaalsContact OE2-CZ 3.23Å; E401-R404 IonicContact OE2-NE 3.34Å; E401-R404 PolarHBondContact OE2-NE 2.88Å; E401-R404 IonicContact OE2-NH2 3.76Å; E401-R404 PolarHBondContact OE2-NH2 2.98Å; E401-E405 PolarHBondContact O-N 3.32Å
402	L	95.9	Very high	94.7	Very high	27 Å²	27	71 Å²	71	14%	0.141	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-41.6	175.7	-77.4	170.7	0	0	0	112.1	K398 L399 E405 V406 L466 L469 T473	K398-L402 WeakPolarHBondContact O-CB 3.47Å; K398-L402 WeakPolarHBondContact O-CG 3.37Å; K398-L402 PolarHBondContact O-N 2.92Å; L399-L402 PolarHBondContact O-N 2.92Å; L402-E405 PolarHBondContact O-N 3.5Å; L402-V406 VanDerWaalsContact O-CG2 3.32Å; L402-V406 WeakPolarHBondContact O-CG2 3.46Å; L402-V406 PolarHBondContact O-N 3.06Å; L402-L466 HydrophobicContact CD2-CD2 3.97Å; L402-L469 HydrophobicContact CD1-CB 4.13Å; L402-L469 HydrophobicContact CD2-CB 4.05Å; L402-L469 HydrophobicContact CD2-CD1 4.42Å; L402-T473 HydrophobicContact CD1-CG2 3.67Å; L402-T473 WeakPolarHBondContact CD1-OG1 3.36Å
403	K	96.4	Very high	94.7	Very high	86 Å²	86	69 Å²	69	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-61.3	-44.8	176	-75.8	-177	178.6	179.7	0	111.9	L399 A400 E401 E405 V406 E407	L399-K403 HydrophobicContact CD2-CD 3.71Å; L399-K403 HydrophobicContact CD2-CG 4.25Å; L399-K403 WeakPolarHBondContact O-CG 3.4Å; L399-K403 PolarHBondContact O-N 3Å; A400-K403 PolarHBondContact O-N 2.98Å; E401-K403 PolarHBondContact O-N 3.15Å; K403-E405 VanDerWaalsContact C-N 3.3Å; K403-E405 PolarHBondContact O-N 3.05Å; K403-V406 PolarHBondContact O-N 3.49Å; K403-E407 WeakPolarHBondContact O-CG 3.25Å; K403-E407 PolarHBondContact O-N 3.43Å
404	R	97.1	Very high	94.6	Very high	125 Å²	125	67.4 Å²	67.4	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-39.9	176.3	-174	177	68	96.8	-9.4	112	A400 E401 R408	A400-R404 PolarHBondContact O-N 3.1Å; A400-R404 VanDerWaalsContact O-N 3.1Å; E401-R404 PolarHBondContact O-N 3.32Å; E401-R404 IonicContact OE1-CZ 3.23Å; E401-R404 IonicContact OE1-NE 2.97Å; E401-R404 IonicContact OE1-NH2 2.6Å; E401-R404 PolarHBondContact OE1-NH2 2.89Å; E401-R404 IonicContact OE2-CZ 2.68Å; E401-R404 VanDerWaalsContact OE2-CZ 3.23Å; E401-R404 IonicContact OE2-NE 3.34Å; E401-R404 PolarHBondContact OE2-NE 2.88Å; E401-R404 IonicContact OE2-NH2 3.76Å; E401-R404 PolarHBondContact OE2-NH2 2.98Å; R404-R408 WeakPolarHBondContact O-CB 3.47Å; R404-R408 PolarHBondContact O-N 3.29Å
405	E	95.8	Very high	94.5	Very high	55 Å²	55	70.6 Å²	70.6	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-72.5	-35.6	178.6	-166.5	62.7	-167.2	0	0	112.4	E401 L402 K403 R408 T409 L466	E401-E405 PolarHBondContact O-N 3.32Å; L402-E405 PolarHBondContact O-N 3.5Å; K403-E405 VanDerWaalsContact C-N 3.3Å; K403-E405 PolarHBondContact O-N 3.05Å; E405-R408 PolarHBondContact O-N 3Å; E405-T409 WeakPolarHBondContact O-CG2 3.47Å; E405-T409 PolarHBondContact O-N 3.44Å; E405-T409 PolarHBondContact O-OG1 3.01Å; E405-L466 HydrophobicContact CB-CD1 4.36Å; E405-L466 HydrophobicContact CB-CD2 4.45Å; E405-L466 HydrophobicContact CG-CD1 3.74Å; E405-L466 HydrophobicContact CG-CD2 4.03Å
406	V	96.1	Very high	94.2	Very high	9 Å²	9	71.7 Å²	71.7	6%	0.055	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-50.1	170.9	171.2	0	0	0	0	110.4	L402 K403 R408 T409 E410 L466	L402-V406 VanDerWaalsContact O-CG2 3.32Å; L402-V406 WeakPolarHBondContact O-CG2 3.46Å; L402-V406 PolarHBondContact O-N 3.06Å; K403-V406 PolarHBondContact O-N 3.49Å; V406-R408 VanDerWaalsContact C-N 3.3Å; V406-R408 PolarHBondContact O-N 3.25Å; V406-T409 PolarHBondContact O-N 3.45Å; V406-T409 PolarHBondContact O-OG1 3.29Å; V406-E410 HydrophobicContact CG1-CG 4.35Å; V406-E410 WeakPolarHBondContact O-CB 3.34Å; V406-E410 WeakPolarHBondContact O-CG 3.09Å; V406-E410 PolarHBondContact O-N 3.35Å; V406-L466 HydrophobicContact CG2-CB 3.72Å
407	E	96.2	Very high	93.9	Very high	134 Å²	134	69.1 Å²	69.1	63%	0.626	35%	0.346	S	S	*	.	H	α-helix	trans	-59.1	-41.3	177.4	-71.4	172.8	-172.5	0	0	111.9	K403 A411	K403-E407 WeakPolarHBondContact O-CG 3.25Å; K403-E407 PolarHBondContact O-N 3.43Å; E407-A411 WeakPolarHBondContact O-CB 3.41Å; E407-A411 PolarHBondContact O-N 3Å
408	R	96.5	Very high	93.5	Very high	141 Å²	141	64.8 Å²	64.8	53%	0.532	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-45.8	177.1	-172.5	-175.7	-177	111.9	0.2	112.1	R404 E405 V406 A411 Q412	R404-R408 WeakPolarHBondContact O-CB 3.47Å; R404-R408 PolarHBondContact O-N 3.29Å; E405-R408 PolarHBondContact O-N 3Å; V406-R408 VanDerWaalsContact C-N 3.3Å; V406-R408 PolarHBondContact O-N 3.25Å; R408-A411 PolarHBondContact O-N 3.03Å; R408-Q412 WeakPolarHBondContact O-CG 3.44Å; R408-Q412 PolarHBondContact O-N 3.04Å
409	T	94	Very high	92.9	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.012	34%	0.344	C	S	.	.	H	α-helix	trans	-71	-36.2	-179.6	52.7	0	0	0	0	112.2	E405 V406 Q412 L413 R462 L466	E405-T409 WeakPolarHBondContact O-CG2 3.47Å; E405-T409 PolarHBondContact O-N 3.44Å; E405-T409 PolarHBondContact O-OG1 3.01Å; V406-T409 PolarHBondContact O-N 3.45Å; V406-T409 PolarHBondContact O-OG1 3.29Å; T409-Q412 PolarHBondContact O-N 3.08Å; T409-L413 PolarHBondContact O-N 2.89Å; T409-R462 HydrophobicContact CG2-CG 4.27Å; T409-L466 HydrophobicContact CG2-CD1 3.79Å
410	E	95.2	Very high	92.1	Very high	76 Å²	76	66.2 Å²	66.2	36%	0.355	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-42.3	171.6	-75.5	-178.9	168.1	0	0	111.6	V406 L413 S414 L463 K467	V406-E410 HydrophobicContact CG1-CG 4.35Å; V406-E410 WeakPolarHBondContact O-CB 3.34Å; V406-E410 WeakPolarHBondContact O-CG 3.09Å; V406-E410 PolarHBondContact O-N 3.35Å; E410-L413 PolarHBondContact O-N 2.81Å; E410-S414 PolarHBondContact O-N 2.79Å; E410-L463 HydrophobicContact CG-CD1 3.51Å; E410-L463 HydrophobicContact CG-CG 4.27Å; E410-K467 WeakPolarHBondContact OE1-CE 3.32Å; E410-K467 IonicContact OE1-NZ 2.8Å; E410-K467 PolarHBondContact OE1-NZ 3.47Å
411	A	94.9	Very high	91	Very high	53 Å²	53	69.6 Å²	69.6	44%	0.438	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-41.2	174.8	0	0	0	0	0	112.6	E407 R408 S414 L415	E407-A411 WeakPolarHBondContact O-CB 3.41Å; E407-A411 PolarHBondContact O-N 3Å; R408-A411 PolarHBondContact O-N 3.03Å; A411-S414 WeakPolarHBondContact O-CB 3.27Å; A411-S414 PolarHBondContact O-N 3.05Å; A411-L415 WeakPolarHBondContact O-CG 3.47Å; A411-L415 PolarHBondContact O-N 3.24Å
412	Q	92.9	Very high	89.9	Confident	76 Å²	76	69.4 Å²	69.4	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-39.9	175	-74.5	177.2	-21.4	0	0	112.3	R408 T409 L415 L416 L459	R408-Q412 WeakPolarHBondContact O-CG 3.44Å; R408-Q412 PolarHBondContact O-N 3.04Å; T409-Q412 PolarHBondContact O-N 3.08Å; Q412-L415 PolarHBondContact O-N 3.05Å; Q412-L416 PolarHBondContact O-N 3.34Å; Q412-L459 HydrophobicContact CB-CD1 3.95Å
413	L	91.4	Very high	88.5	Confident	17 Å²	17	69.7 Å²	69.7	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-63.2	-43.5	173	-84.3	170.7	0	0	0	111.8	T409 E410 L415 L416 C417 Q456 L459 R460 L463	T409-L413 PolarHBondContact O-N 2.89Å; E410-L413 PolarHBondContact O-N 2.81Å; L413-L415 PolarHBondContact O-N 3.41Å; L413-L416 PolarHBondContact O-N 2.93Å; L413-C417 VanDerWaalsContact O-CB 3.3Å; L413-C417 WeakPolarHBondContact O-CB 3.38Å; L413-C417 PolarHBondContact O-N 3.33Å; L413-C417 PolarHBondContact O-SG 3.06Å; L413-Q456 HydrophobicContact CD2-CB 4.36Å; L413-Q456 WeakPolarHBondContact CD2-O 3.15Å; L413-L459 HydrophobicContact CD1-CB 4.16Å; L413-L459 HydrophobicContact CD2-CB 3.51Å; L413-L459 HydrophobicContact CD2-CD1 4.13Å; L413-L459 HydrophobicContact CG-CB 3.63Å; L413-L459 HydrophobicContact CG-CD1 4.16Å; L413-R460 HydrophobicContact CD1-CG 4.13Å; L413-R460 HydrophobicContact CD2-CG 4.06Å; L413-L463 HydrophobicContact CD1-CB 4.49Å; L413-L463 HydrophobicContact CD1-CD1 3.68Å
414	S	91.1	Very high	86.9	Confident	81 Å²	81	68.5 Å²	68.5	57%	0.566	36%	0.362	S	S	*	.	H	α-helix	trans	-59.5	-45.3	177.5	-175.7	0	0	0	0	111.8	E410 A411 C417 A418	E410-S414 PolarHBondContact O-N 2.79Å; A411-S414 WeakPolarHBondContact O-CB 3.27Å; A411-S414 PolarHBondContact O-N 3.05Å; S414-C417 PolarHBondContact O-N 3.29Å; S414-A418 WeakPolarHBondContact O-CB 3.26Å; S414-A418 PolarHBondContact O-N 3.43Å
415	L	90.4	Very high	85.1	Confident	114 Å²	114	67.3 Å²	67.3	60%	0.597	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-49.5	176.3	-73.1	171.9	0	0	0	112	A411 Q412 L413 C417 A418 E419	A411-L415 WeakPolarHBondContact O-CG 3.47Å; A411-L415 PolarHBondContact O-N 3.24Å; Q412-L415 PolarHBondContact O-N 3.05Å; L413-L415 PolarHBondContact O-N 3.41Å; L415-C417 VanDerWaalsContact C-N 3.32Å; L415-C417 PolarHBondContact O-N 2.79Å; L415-A418 WeakPolarHBondContact O-CB 3.35Å; L415-A418 PolarHBondContact O-N 3.28Å; L415-E419 WeakPolarHBondContact O-CG 3.2Å; L415-E419 PolarHBondContact O-N 2.69Å
416	L	86.2	Confident	83.3	Confident	29 Å²	29	68.8 Å²	68.8	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-65.1	-35.7	178.9	-76.5	168.2	0	0	0	112.4	Q412 L413 T420 K455 Q456 L459	Q412-L416 PolarHBondContact O-N 3.34Å; L413-L416 PolarHBondContact O-N 2.93Å; L416-T420 WeakPolarHBondContact O-CG2 3.4Å; L416-T420 PolarHBondContact O-N 3.21Å; L416-T420 VanDerWaalsContact O-N 3.1Å; L416-T420 PolarHBondContact O-OG1 3.26Å; L416-K455 HydrophobicContact CD1-CB 4.1Å; L416-Q456 VanDerWaalsContact C-NE2 3.29Å; L416-Q456 HydrophobicContact CB-CG 3.86Å; L416-Q456 PolarHBondContact O-NE2 3.32Å; L416-L459 HydrophobicContact CD1-CD1 3.43Å; L416-L459 VanDerWaalsContact CD1-CD1 3.43Å
417	C	86.4	Confident	81.3	Confident	31 Å²	31	71.6 Å²	71.6	21%	0.209	40%	0.397	C	S	.	.	H	α-helix	trans	-65.5	-43.1	174.2	-74.5	0	0	0	0	111	L413 S414 L415 T420 H421	L413-C417 VanDerWaalsContact O-CB 3.3Å; L413-C417 WeakPolarHBondContact O-CB 3.38Å; L413-C417 PolarHBondContact O-N 3.33Å; L413-C417 PolarHBondContact O-SG 3.06Å; S414-C417 PolarHBondContact O-N 3.29Å; L415-C417 VanDerWaalsContact C-N 3.32Å; L415-C417 PolarHBondContact O-N 2.79Å; C417-T420 WeakPolarHBondContact CA-OG1 3.12Å; C417-T420 PolarHBondContact O-N 3.38Å; C417-T420 PolarHBondContact O-OG1 2.91Å; C417-H421 PolarHBondContact O-CD2 3.17Å; C417-H421 PolarHBondContact O-N 3.12Å
418	A	86.1	Confident	79.3	Confident	51 Å²	51	74.2 Å²	74.2	42%	0.421	41%	0.407	S	S	.	.	H	α-helix	trans	-60.1	-45.1	175.2	0	0	0	0	0	112	S414 L415 T420 H421 S422	S414-A418 WeakPolarHBondContact O-CB 3.26Å; S414-A418 PolarHBondContact O-N 3.43Å; L415-A418 WeakPolarHBondContact O-CB 3.35Å; L415-A418 PolarHBondContact O-N 3.28Å; A418-T420 VanDerWaalsContact C-N 3.35Å; A418-T420 PolarHBondContact O-N 3.21Å; A418-H421 PolarHBondContact O-N 3.3Å; A418-S422 PolarHBondContact O-N 3.29Å; A418-S422 PolarHBondContact O-OG 3.28Å
419	E	82.5	Confident	77.2	Confident	118 Å²	118	75.8 Å²	75.8	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-57.9	-44.4	175.4	-74	173.3	-173.1	0	0	112	L415 S422 A423	L415-E419 WeakPolarHBondContact O-CG 3.2Å; L415-E419 PolarHBondContact O-N 2.69Å; E419-S422 PolarHBondContact O-N 3.48Å; E419-A423 PolarHBondContact O-N 3.11Å; E419-A423 VanDerWaalsContact O-N 3.12Å
420	T	77.1	Confident	75.2	Confident	21 Å²	21	77.9 Å²	77.9	13%	0.129	44%	0.437	C	S	.	.	H	α-helix	trans	-67.6	-36.8	177.9	53.4	0	0	0	0	113.2	L416 C417 A418 A423 D424 S452 Q456	L416-T420 WeakPolarHBondContact O-CG2 3.4Å; L416-T420 PolarHBondContact O-N 3.21Å; L416-T420 VanDerWaalsContact O-N 3.1Å; L416-T420 PolarHBondContact O-OG1 3.26Å; C417-T420 WeakPolarHBondContact CA-OG1 3.12Å; C417-T420 PolarHBondContact O-N 3.38Å; C417-T420 PolarHBondContact O-OG1 2.91Å; A418-T420 VanDerWaalsContact C-N 3.35Å; A418-T420 PolarHBondContact O-N 3.21Å; T420-A423 PolarHBondContact O-N 2.82Å; T420-D424 PolarHBondContact O-N 3.06Å; T420-D424 VanDerWaalsContact O-N 3.12Å; T420-S452 WeakPolarHBondContact CG2-OG 3.48Å; T420-Q456 PolarHBondContact OG1-NE2 3.17Å
421	H	72.8	Confident	73.1	Confident	127 Å²	127	79.6 Å²	79.6	59%	0.588	46%	0.455	S	S	*	.	H	α-helix	trans	-69.9	-36.5	177	-74.1	-55.5	0	0	0	112.6	C417 A418 T425	C417-H421 PolarHBondContact O-CD2 3.17Å; C417-H421 PolarHBondContact O-N 3.12Å; A418-H421 PolarHBondContact O-N 3.3Å; H421-T425 PolarHBondContact O-N 3.02Å; H421-T425 PolarHBondContact O-OG1 2.85Å
422	S	74	Confident	70.9	Confident	84 Å²	84	84.4 Å²	84.4	59%	0.587	48%	0.479	S	S	*	.	H	α-helix	trans	-64.4	-40.7	173.5	-63.9	0	0	0	0	111.8	A418 E419 T425 S426	A418-S422 PolarHBondContact O-N 3.29Å; A418-S422 PolarHBondContact O-OG 3.28Å; E419-S422 PolarHBondContact O-N 3.48Å; S422-T425 PolarHBondContact O-N 3.48Å; S422-S426 PolarHBondContact O-OG 3.36Å
423	A	65	Low	69.3	Low	33 Å²	33	84.3 Å²	84.3	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-70.8	-29.8	179.4	0	0	0	0	0	114.3	E419 T420 S426	E419-A423 PolarHBondContact O-N 3.11Å; E419-A423 VanDerWaalsContact O-N 3.12Å; T420-A423 PolarHBondContact O-N 2.82Å; A423-S426 PolarHBondContact O-OG 3.21Å; A423-S426 VanDerWaalsContact O-OG 3.13Å
424	D	63	Low	67.7	Low	61 Å²	61	88.5 Å²	88.5	33%	0.326	51%	0.513	S	S	.	.	H	α-helix	trans	-79.1	-21.2	176.6	-76	-9	0	0	0	112.5	T420 K449	T420-D424 PolarHBondContact O-N 3.06Å; T420-D424 VanDerWaalsContact O-N 3.12Å; D424-K449 IonicContact OD1-NZ 3.07Å; D424-K449 PolarHBondContact OD1-NZ 3.13Å
425	T	60	Low	66.9	Low	101 Å²	101	90.3 Å²	90.3	62%	0.62	52%	0.517	S	S	*	.	H	α-helix	trans	-75	-35.1	176.9	-54.1	0	0	0	0	111.5	H421 S422	H421-T425 PolarHBondContact O-N 3.02Å; H421-T425 PolarHBondContact O-OG1 2.85Å; S422-T425 PolarHBondContact O-N 3.48Å
426	S	57.3	Low	66.3	Low	85 Å²	85	90 Å²	90	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-75.3	-26	177.3	30.6	0	0	0	0	113.8	S422 A423 K428	S422-S426 PolarHBondContact O-OG 3.36Å; A423-S426 PolarHBondContact O-OG 3.21Å; A423-S426 VanDerWaalsContact O-OG 3.13Å; S426-K428 VanDerWaalsContact C-N 3.3Å; S426-K428 PolarHBondContact O-N 3.34Å
427	E	54.9	Low	65.9	Low	68 Å²	68	94.2 Å²	94.2	32%	0.318	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-69.4	-22.3	178.8	-105.4	-177.8	-177.5	0	0	114.2	Q429 M442 K449	E427-Q429 VanDerWaalsContact C-N 3.3Å; E427-Q429 PolarHBondContact O-N 2.92Å; E427-M442 HydrophobicContact CG-CE 4.16Å; E427-K449 IonicContact OE1-NZ 3.31Å; E427-K449 PolarHBondContact OE1-NZ 3.05Å; E427-K449 IonicContact OE2-NZ 2.63Å; E427-K449 PolarHBondContact OE2-NZ 3.5Å
428	K	54.8	Low	65.3	Low	190 Å²	190	95.5 Å²	95.5	83%	0.826	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-80	-2.3	-176.8	-75.2	-179.4	179	174.9	0	114.8	S426	S426-K428 VanDerWaalsContact C-N 3.3Å; S426-K428 PolarHBondContact O-N 3.34Å
429	Q	51.9	Low	64.8	Low	174 Å²	174	97.7 Å²	97.7	81%	0.813	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-116	24.1	-177	-70	-171.7	-2.5	0	0	114.9	E427 P431	E427-Q429 VanDerWaalsContact C-N 3.3Å; E427-Q429 PolarHBondContact O-N 2.92Å; Q429-P431 WeakPolarHBondContact O-CD 3.46Å
430	A	51.2	Low	64.7	Low	45 Å²	45	99.3 Å²	99.3	37%	0.372	56%	0.558	S	S	.	*			trans	-85.7	122.9	179.2	0	0	0	0	0	112.9
431	P	51.8	Low	64.8	Low	113 Å²	113	102.6 Å²	102.6	73%	0.734	57%	0.573	S	S	*	*			trans	-70.6	148.5	179.4	28.8	-33.2	0	0	0	112.4	Q429 G433	Q429-P431 WeakPolarHBondContact O-CD 3.46Å; P431-G433 PolarHBondContact O-N 2.86Å
432	T	47.5	Very low	64.8	Low	154 Å²	154	97.7 Å²	97.7	95%	0.945	55%	0.55	S	S	*	*	S	Bend	trans	-69.7	104.2	-179.2	51	0	0	0	0	111.3
433	G	60.9	Low	64.8	Low	74 Å²	74	102.4 Å²	102.4	76%	0.763	56%	0.555	S	S	*	*			trans	158.6	46.3	173.5	0	0	0	0	0	115.1	P431	P431-G433 PolarHBondContact O-N 2.86Å
434	R	56.4	Low	65.2	Low	104 Å²	104	104.9 Å²	104.9	39%	0.392	56%	0.562	S	S	.	*			trans	-84.2	138	-172.4	-79	-177.4	173.1	170.1	-8.8	113.7	D438 M442	R434-D438 HydrophobicContact CB-CB 4.07Å; R434-D438 HydrophobicContact CG-CB 4.03Å; R434-M442 PolarHBondContact NH1-SD 3.18Å; R434-M442 PolarHBondContact NH2-SD 3.06Å
435	D	74.9	Confident	65.6	Low	120 Å²	120	106.9 Å²	106.9	64%	0.642	57%	0.569	S	S	*	*			trans	-81	156.8	171.3	-78.7	-28.4	0	0	0	111.1	L437 D438 D439	D435-L437 PolarHBondContact O-N 3.47Å; D435-D438 WeakPolarHBondContact O-CB 3.42Å; D435-D438 PolarHBondContact O-N 3.4Å; D435-D439 PolarHBondContact O-N 2.98Å
436	S	77.9	Confident	65.9	Low	107 Å²	107	109.1 Å²	109.1	75%	0.748	57%	0.566	S	S	*	*	H	α-helix	trans	-51.5	-27.3	179	-178.2	0	0	0	0	114.1	Y440	S436-Y440 PolarHBondContact O-N 3.06Å
437	L	76.8	Confident	66	Low	117 Å²	117	107.8 Å²	107.8	61%	0.613	56%	0.556	S	S	*	*	H	α-helix	trans	-72.4	-39.8	175.5	-175.9	64.1	0	0	0	112.5	D435 D439 Y440 M441	D435-L437 PolarHBondContact O-N 3.47Å; L437-D439 VanDerWaalsContact C-N 3.27Å; L437-D439 PolarHBondContact O-N 3.05Å; L437-Y440 WeakPolarHBondContact O-CB 3.47Å; L437-Y440 PolarHBondContact O-N 3.34Å; L437-Y440 VanDerWaalsContact O-N 3.15Å; L437-M441 HydrophobicContact CG-CE 4.47Å; L437-M441 WeakPolarHBondContact O-CG 3.37Å; L437-M441 PolarHBondContact O-N 3.3Å
438	D	75.4	Confident	66.8	Low	59 Å²	59	109.2 Å²	109.2	32%	0.316	57%	0.567	S	S	.	*	H	α-helix	trans	-64.9	-35.8	177.7	-67.1	-26.4	0	0	0	111	R434 D435 Y440 M441 M442	R434-D438 HydrophobicContact CB-CB 4.07Å; R434-D438 HydrophobicContact CG-CB 4.03Å; D435-D438 WeakPolarHBondContact O-CB 3.42Å; D435-D438 PolarHBondContact O-N 3.4Å; D438-Y440 VanDerWaalsContact C-N 3.34Å; D438-M441 PolarHBondContact O-N 3.19Å; D438-M441 WeakPolarHBondContact OD1-CE 3.3Å; D438-M442 WeakPolarHBondContact O-CB 3.45Å; D438-M442 VanDerWaalsContact O-CG 3.27Å; D438-M442 WeakPolarHBondContact O-CG 3.31Å; D438-M442 PolarHBondContact O-N 3.28Å
439	D	75.4	Confident	67.4	Low	97 Å²	97	101.8 Å²	101.8	52%	0.519	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-36.8	174	-74.7	-20.1	0	0	0	112.2	D435 L437 R443	D435-D439 PolarHBondContact O-N 2.98Å; L437-D439 VanDerWaalsContact C-N 3.27Å; L437-D439 PolarHBondContact O-N 3.05Å; D439-R443 WeakPolarHBondContact O-CB 3.17Å; D439-R443 PolarHBondContact O-N 2.8Å; D439-R443 VanDerWaalsContact O-N 3.11Å
440	Y	79.6	Confident	68.3	Low	151 Å²	151	99.6 Å²	99.6	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-68.1	-44	174	177.8	-97.2	0	0	0	112	S436 L437 D438 R443 M444	S436-Y440 PolarHBondContact O-N 3.06Å; L437-Y440 WeakPolarHBondContact O-CB 3.47Å; L437-Y440 PolarHBondContact O-N 3.34Å; L437-Y440 VanDerWaalsContact O-N 3.15Å; D438-Y440 VanDerWaalsContact C-N 3.34Å; Y440-R443 WeakPolarHBondContact O-CB 3.41Å; Y440-R443 PolarHBondContact O-N 2.71Å; Y440-R443 VanDerWaalsContact O-N 3.1Å; Y440-M444 HydrophobicContact CE1-CG 4.09Å; Y440-M444 PolarHBondContact O-N 2.82Å
441	M	80.1	Confident	69.7	Low	90 Å²	90	101.9 Å²	101.9	44%	0.443	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-44.9	178	-68.4	-170.3	-63.5	0	0	111.8	L437 D438 R443 M444 E445	L437-M441 HydrophobicContact CG-CE 4.47Å; L437-M441 WeakPolarHBondContact O-CG 3.37Å; L437-M441 PolarHBondContact O-N 3.3Å; D438-M441 PolarHBondContact O-N 3.19Å; D438-M441 WeakPolarHBondContact OD1-CE 3.3Å; M441-R443 PolarHBondContact O-N 3.37Å; M441-M444 WeakPolarHBondContact O-CB 2.8Å; M441-M444 PolarHBondContact O-N 2.94Å; M441-M444 VanDerWaalsContact O-N 3.14Å; M441-E445 PolarHBondContact O-N 3.43Å
442	M	72.7	Confident	71.2	Confident	24 Å²	24	97.4 Å²	97.4	12%	0.118	50%	0.501	C	S	.	.	H	α-helix	trans	-61.6	-32.1	173.8	-72	-86.4	-58.4	0	0	112.1	E427 R434 D438 R446	E427-M442 HydrophobicContact CG-CE 4.16Å; R434-M442 PolarHBondContact NH1-SD 3.18Å; R434-M442 PolarHBondContact NH2-SD 3.06Å; D438-M442 WeakPolarHBondContact O-CB 3.45Å; D438-M442 VanDerWaalsContact O-CG 3.27Å; D438-M442 WeakPolarHBondContact O-CG 3.31Å; D438-M442 PolarHBondContact O-N 3.28Å; M442-R446 WeakPolarHBondContact O-CB 3.16Å; M442-R446 WeakPolarHBondContact O-CG 3.16Å; M442-R446 PolarHBondContact O-N 2.97Å
443	R	72.4	Confident	72.9	Confident	184 Å²	184	97.5 Å²	97.5	69%	0.694	48%	0.484	S	S	*	.	H	α-helix	trans	-70.5	-35.9	176.7	-160.1	173.6	-171.2	170.5	1.4	111.8	D439 Y440 M441 R446 C447	D439-R443 WeakPolarHBondContact O-CB 3.17Å; D439-R443 PolarHBondContact O-N 2.8Å; D439-R443 VanDerWaalsContact O-N 3.11Å; Y440-R443 WeakPolarHBondContact O-CB 3.41Å; Y440-R443 PolarHBondContact O-N 2.71Å; Y440-R443 VanDerWaalsContact O-N 3.1Å; M441-R443 PolarHBondContact O-N 3.37Å; R443-R446 PolarHBondContact O-N 3.28Å; R443-C447 PolarHBondContact O-N 3.35Å; R443-C447 VanDerWaalsContact O-N 3.15Å; R443-C447 PolarHBondContact O-SG 3.5Å; R443-C447 VanDerWaalsContact O-SG 3.4Å
444	M	74.1	Confident	74.2	Confident	84 Å²	84	96.9 Å²	96.9	41%	0.414	47%	0.466	S	S	.	.	H	α-helix	trans	-65.1	-47.5	172.1	-83.5	-96.1	36.6	0	0	111.7	Y440 M441 R446 C447 D448	Y440-M444 HydrophobicContact CE1-CG 4.09Å; Y440-M444 PolarHBondContact O-N 2.82Å; M441-M444 WeakPolarHBondContact O-CB 2.8Å; M441-M444 PolarHBondContact O-N 2.94Å; M441-M444 VanDerWaalsContact O-N 3.14Å; M444-R446 VanDerWaalsContact C-N 3.26Å; M444-R446 PolarHBondContact O-N 3.32Å; M444-C447 WeakPolarHBondContact O-CB 3.43Å; M444-C447 PolarHBondContact O-N 3.03Å; M444-D448 PolarHBondContact O-N 2.85Å; M444-D448 VanDerWaalsContact O-N 3.12Å
445	E	70.9	Confident	75.8	Confident	103 Å²	103	97.4 Å²	97.4	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-33.6	175.4	-67.7	178.2	171.7	0	0	112.3	M441 D448 K449	M441-E445 PolarHBondContact O-N 3.43Å; E445-D448 PolarHBondContact O-N 3.06Å; E445-K449 VanDerWaalsContact O-CG 3.31Å; E445-K449 WeakPolarHBondContact O-CG 3.42Å; E445-K449 PolarHBondContact O-N 3.23Å
446	R	65.9	Low	76.5	Confident	148 Å²	148	92.5 Å²	92.5	56%	0.558	44%	0.444	S	S	*	.	H	α-helix	trans	-65.6	-35.5	172.7	-78.2	173.8	-175.5	-174	4.6	112.8	M442 R443 M444 K449 Q450	M442-R446 WeakPolarHBondContact O-CB 3.16Å; M442-R446 WeakPolarHBondContact O-CG 3.16Å; M442-R446 PolarHBondContact O-N 2.97Å; R443-R446 PolarHBondContact O-N 3.28Å; M444-R446 VanDerWaalsContact C-N 3.26Å; M444-R446 PolarHBondContact O-N 3.32Å; R446-K449 PolarHBondContact O-N 2.97Å; R446-Q450 WeakPolarHBondContact O-CG 3.35Å; R446-Q450 PolarHBondContact O-N 2.92Å
447	C	61.4	Low	77.1	Confident	57 Å²	57	90.1 Å²	90.1	39%	0.385	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-44.4	172.8	-68.9	0	0	0	0	110.5	R443 M444 K449 Q450 D451	R443-C447 PolarHBondContact O-N 3.35Å; R443-C447 VanDerWaalsContact O-N 3.15Å; R443-C447 PolarHBondContact O-SG 3.5Å; R443-C447 VanDerWaalsContact O-SG 3.4Å; M444-C447 WeakPolarHBondContact O-CB 3.43Å; M444-C447 PolarHBondContact O-N 3.03Å; C447-K449 VanDerWaalsContact C-N 3.27Å; C447-K449 PolarHBondContact O-N 3.28Å; C447-Q450 WeakPolarHBondContact O-CA 3.29Å; C447-Q450 WeakPolarHBondContact O-CB 3.39Å; C447-Q450 PolarHBondContact O-N 3.47Å; C447-D451 PolarHBondContact O-N 3.23Å
448	D	70.7	Confident	77.8	Confident	99 Å²	99	93 Å²	93	53%	0.529	43%	0.43	S	S	.	.	H	α-helix	trans	-62.9	-34.2	175.9	-65.2	-28	0	0	0	112.2	M444 E445 D451 S452	M444-D448 PolarHBondContact O-N 2.85Å; M444-D448 VanDerWaalsContact O-N 3.12Å; E445-D448 PolarHBondContact O-N 3.06Å; D448-D451 PolarHBondContact O-N 2.98Å; D448-S452 PolarHBondContact O-N 3.45Å
449	K	67.7	Low	78.7	Confident	34 Å²	34	91.6 Å²	91.6	15%	0.148	42%	0.423	C	S	.	.	H	α-helix	trans	-66.9	-34.3	171.4	-72.8	178.3	-179.4	-159.3	0	113	D424 E427 E445 R446 C447 D451 S452 R453	D424-K449 IonicContact OD1-NZ 3.07Å; D424-K449 PolarHBondContact OD1-NZ 3.13Å; E427-K449 IonicContact OE1-NZ 3.31Å; E427-K449 PolarHBondContact OE1-NZ 3.05Å; E427-K449 IonicContact OE2-NZ 2.63Å; E427-K449 PolarHBondContact OE2-NZ 3.5Å; E445-K449 VanDerWaalsContact O-CG 3.31Å; E445-K449 WeakPolarHBondContact O-CG 3.42Å; E445-K449 PolarHBondContact O-N 3.23Å; R446-K449 PolarHBondContact O-N 2.97Å; C447-K449 VanDerWaalsContact C-N 3.27Å; C447-K449 PolarHBondContact O-N 3.28Å; K449-D451 VanDerWaalsContact C-N 3.35Å; K449-S452 WeakPolarHBondContact CA-OG 3.38Å; K449-S452 PolarHBondContact O-OG 3.25Å; K449-R453 WeakPolarHBondContact O-CB 3.18Å; K449-R453 WeakPolarHBondContact O-CG 3.46Å; K449-R453 PolarHBondContact O-N 3.02Å; K449-R453 VanDerWaalsContact O-N 3.09Å
450	Q	70.6	Confident	79.5	Confident	128 Å²	128	94 Å²	94	60%	0.598	42%	0.424	S	S	*	.	H	α-helix	trans	-66.5	-42.1	173.1	-73.6	179.8	-19.5	0	0	110.1	R446 C447 S452 R453 V454	R446-Q450 WeakPolarHBondContact O-CG 3.35Å; R446-Q450 PolarHBondContact O-N 2.92Å; C447-Q450 WeakPolarHBondContact O-CA 3.29Å; C447-Q450 WeakPolarHBondContact O-CB 3.39Å; C447-Q450 PolarHBondContact O-N 3.47Å; Q450-S452 PolarHBondContact O-N 2.85Å; Q450-R453 PolarHBondContact O-N 3.12Å; Q450-V454 VanDerWaalsContact O-CG2 3.27Å; Q450-V454 WeakPolarHBondContact O-CG2 3.4Å; Q450-V454 PolarHBondContact O-N 2.94Å
451	D	80.5	Confident	80.3	Confident	92 Å²	92	90.6 Å²	90.6	49%	0.492	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-40.6	176.3	-77	-8.3	0	0	0	112.6	C447 D448 K449 V454 K455	C447-D451 PolarHBondContact O-N 3.23Å; D448-D451 PolarHBondContact O-N 2.98Å; K449-D451 VanDerWaalsContact C-N 3.35Å; D451-V454 PolarHBondContact O-N 3.05Å; D451-K455 WeakPolarHBondContact O-CB 3.28Å; D451-K455 VanDerWaalsContact O-CG 3.26Å; D451-K455 WeakPolarHBondContact O-CG 3.1Å; D451-K455 PolarHBondContact O-N 2.68Å
452	S	82.4	Confident	80.9	Confident	20 Å²	20	91.3 Å²	91.3	14%	0.14	42%	0.417	C	S	.	.	H	α-helix	trans	-65.6	-39.8	175.8	70.6	0	0	0	0	112	T420 D448 K449 Q450 K455 Q456	T420-S452 WeakPolarHBondContact CG2-OG 3.48Å; D448-S452 PolarHBondContact O-N 3.45Å; K449-S452 WeakPolarHBondContact CA-OG 3.38Å; K449-S452 PolarHBondContact O-OG 3.25Å; Q450-S452 PolarHBondContact O-N 2.85Å; S452-K455 PolarHBondContact O-N 3.34Å; S452-Q456 WeakPolarHBondContact O-CG 3.4Å; S452-Q456 PolarHBondContact O-N 3Å
453	R	85	Confident	82	Confident	155 Å²	155	91.5 Å²	91.5	59%	0.585	42%	0.418	S	S	*	.	H	α-helix	trans	-65.6	-39.1	173.6	-73.7	179.9	-179.7	-172.8	2.3	112.7	K449 Q450 Q456 S457	K449-R453 WeakPolarHBondContact O-CB 3.18Å; K449-R453 WeakPolarHBondContact O-CG 3.46Å; K449-R453 PolarHBondContact O-N 3.02Å; K449-R453 VanDerWaalsContact O-N 3.09Å; Q450-R453 PolarHBondContact O-N 3.12Å; R453-Q456 PolarHBondContact O-N 3.37Å; R453-S457 PolarHBondContact O-N 3.18Å
454	V	88.2	Confident	83.1	Confident	62 Å²	62	85.2 Å²	85.2	38%	0.376	40%	0.402	S	S	.	.	H	α-helix	trans	-67	-38.2	174.5	173.1	0	0	0	0	110.9	Q450 D451 S457 R458	Q450-V454 VanDerWaalsContact O-CG2 3.27Å; Q450-V454 WeakPolarHBondContact O-CG2 3.4Å; Q450-V454 PolarHBondContact O-N 2.94Å; D451-V454 PolarHBondContact O-N 3.05Å; V454-S457 PolarHBondContact O-N 3.41Å; V454-S457 PolarHBondContact O-OG 3.38Å; V454-R458 WeakPolarHBondContact O-CB 3.45Å; V454-R458 VanDerWaalsContact O-CG 3.28Å; V454-R458 WeakPolarHBondContact O-CG 3.24Å; V454-R458 PolarHBondContact O-N 3.42Å
455	K	88.3	Confident	84.2	Confident	115 Å²	115	85.4 Å²	85.4	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-43.6	172	-72.8	169	-174.9	171.5	0	111.4	L416 D451 S452 S457 R458 L459	L416-K455 HydrophobicContact CD1-CB 4.1Å; D451-K455 WeakPolarHBondContact O-CB 3.28Å; D451-K455 VanDerWaalsContact O-CG 3.26Å; D451-K455 WeakPolarHBondContact O-CG 3.1Å; D451-K455 PolarHBondContact O-N 2.68Å; S452-K455 PolarHBondContact O-N 3.34Å; K455-S457 PolarHBondContact O-N 3.5Å; K455-R458 PolarHBondContact O-N 3.48Å; K455-L459 WeakPolarHBondContact O-CB 3.13Å; K455-L459 WeakPolarHBondContact O-CG 3.12Å; K455-L459 PolarHBondContact O-N 2.78Å
456	Q	90	Very high	85.4	Confident	16 Å²	16	80.7 Å²	80.7	8%	0.075	38%	0.38	C	S	.	.	H	α-helix	trans	-60.6	-42.7	174.6	-73.3	178	7.6	0	0	111.9	L413 L416 T420 S452 R453 L459 R460	L413-Q456 HydrophobicContact CD2-CB 4.36Å; L413-Q456 WeakPolarHBondContact CD2-O 3.15Å; L416-Q456 VanDerWaalsContact C-NE2 3.29Å; L416-Q456 HydrophobicContact CB-CG 3.86Å; L416-Q456 PolarHBondContact O-NE2 3.32Å; T420-Q456 PolarHBondContact OG1-NE2 3.17Å; S452-Q456 WeakPolarHBondContact O-CG 3.4Å; S452-Q456 PolarHBondContact O-N 3Å; R453-Q456 PolarHBondContact O-N 3.37Å; Q456-L459 PolarHBondContact O-N 2.79Å; Q456-R460 WeakPolarHBondContact O-CG 3.37Å; Q456-R460 PolarHBondContact O-N 2.76Å
457	S	90.5	Very high	86.8	Confident	58 Å²	58	77.2 Å²	77.2	41%	0.406	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-42.9	177.9	70.7	0	0	0	0	112.1	R453 V454 K455 L459 R460 V461	R453-S457 PolarHBondContact O-N 3.18Å; V454-S457 PolarHBondContact O-N 3.41Å; V454-S457 PolarHBondContact O-OG 3.38Å; K455-S457 PolarHBondContact O-N 3.5Å; S457-L459 VanDerWaalsContact C-N 3.35Å; S457-L459 PolarHBondContact O-N 3.06Å; S457-R460 PolarHBondContact O-N 2.85Å; S457-V461 WeakPolarHBondContact O-CG2 3.38Å; S457-V461 PolarHBondContact O-N 3.22Å
458	R	92.9	Very high	88.5	Confident	177 Å²	177	81.6 Å²	81.6	67%	0.668	38%	0.382	S	S	*	.	H	α-helix	trans	-59.3	-43.8	174.7	-73.5	176.8	-176.3	-176.2	3.4	112	V454 K455 V461 R462	V454-R458 WeakPolarHBondContact O-CB 3.45Å; V454-R458 VanDerWaalsContact O-CG 3.28Å; V454-R458 WeakPolarHBondContact O-CG 3.24Å; V454-R458 PolarHBondContact O-N 3.42Å; K455-R458 PolarHBondContact O-N 3.48Å; R458-V461 PolarHBondContact O-N 3.17Å; R458-R462 WeakPolarHBondContact O-CB 3.39Å; R458-R462 PolarHBondContact O-N 3.35Å
459	L	92.5	Very high	89.6	Confident	29 Å²	29	80.7 Å²	80.7	15%	0.152	38%	0.377	C	S	.	.	H	α-helix	trans	-67.8	-34.5	177.2	-72.9	174	0	0	0	112.7	Q412 L413 L416 K455 Q456 S457 R462 L463	Q412-L459 HydrophobicContact CB-CD1 3.95Å; L413-L459 HydrophobicContact CD1-CB 4.16Å; L413-L459 HydrophobicContact CD2-CB 3.51Å; L413-L459 HydrophobicContact CD2-CD1 4.13Å; L413-L459 HydrophobicContact CG-CB 3.63Å; L413-L459 HydrophobicContact CG-CD1 4.16Å; L416-L459 HydrophobicContact CD1-CD1 3.43Å; L416-L459 VanDerWaalsContact CD1-CD1 3.43Å; K455-L459 WeakPolarHBondContact O-CB 3.13Å; K455-L459 WeakPolarHBondContact O-CG 3.12Å; K455-L459 PolarHBondContact O-N 2.78Å; Q456-L459 PolarHBondContact O-N 2.79Å; S457-L459 VanDerWaalsContact C-N 3.35Å; S457-L459 PolarHBondContact O-N 3.06Å; L459-R462 PolarHBondContact O-N 3.45Å; L459-L463 VanDerWaalsContact O-CB 3.29Å; L459-L463 WeakPolarHBondContact O-CB 3.32Å; L459-L463 PolarHBondContact O-N 3.37Å
460	R	94.2	Very high	91	Very high	148 Å²	148	81 Å²	81	56%	0.558	38%	0.378	S	S	*	.	H	α-helix	trans	-64.4	-41.5	173.2	-74.6	176.5	-174.4	165.3	3.9	112.2	L413 Q456 S457 L463 S464	L413-R460 HydrophobicContact CD1-CG 4.13Å; L413-R460 HydrophobicContact CD2-CG 4.06Å; Q456-R460 WeakPolarHBondContact O-CG 3.37Å; Q456-R460 PolarHBondContact O-N 2.76Å; S457-R460 PolarHBondContact O-N 2.85Å; R460-L463 PolarHBondContact O-N 3.15Å; R460-S464 PolarHBondContact O-N 2.85Å
461	V	94.8	Very high	92.2	Very high	79 Å²	79	81.8 Å²	81.8	48%	0.479	38%	0.376	S	S	.	.	H	α-helix	trans	-63.3	-46.3	173.5	175.1	0	0	0	0	110.2	S457 R458 L463 S464 E465	S457-V461 WeakPolarHBondContact O-CG2 3.38Å; S457-V461 PolarHBondContact O-N 3.22Å; R458-V461 PolarHBondContact O-N 3.17Å; V461-L463 VanDerWaalsContact C-N 3.31Å; V461-L463 PolarHBondContact O-N 3.22Å; V461-S464 PolarHBondContact O-N 2.98Å; V461-S464 PolarHBondContact O-OG 2.96Å; V461-E465 WeakPolarHBondContact O-CG 3.44Å; V461-E465 PolarHBondContact O-N 3.15Å
462	R	94	Very high	92.9	Very high	105 Å²	105	85.6 Å²	85.6	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-59.8	-41.6	177.3	-177.5	56.5	177	173.3	0.3	112.4	T409 R458 L459 E465 L466	T409-R462 HydrophobicContact CG2-CG 4.27Å; R458-R462 WeakPolarHBondContact O-CB 3.39Å; R458-R462 PolarHBondContact O-N 3.35Å; L459-R462 PolarHBondContact O-N 3.45Å; R462-E465 IonicContact NH1-OE2 2.68Å; R462-E465 PolarHBondContact O-N 3.44Å; R462-L466 HydrophobicContact CG-CD1 4.03Å; R462-L466 HydrophobicContact CG-CG 4.42Å; R462-L466 WeakPolarHBondContact O-CB 3.29Å; R462-L466 VanDerWaalsContact O-CG 3.28Å; R462-L466 WeakPolarHBondContact O-CG 3.47Å; R462-L466 PolarHBondContact O-N 2.97Å
463	L	95.7	Very high	93.4	Very high	29 Å²	29	85.4 Å²	85.4	15%	0.152	38%	0.381	C	S	.	.	H	α-helix	trans	-62.1	-44.2	176.9	-179.2	169.3	0	0	0	110.8	E410 L413 L459 R460 V461 E465 L466 K467	E410-L463 HydrophobicContact CG-CD1 3.51Å; E410-L463 HydrophobicContact CG-CG 4.27Å; L413-L463 HydrophobicContact CD1-CB 4.49Å; L413-L463 HydrophobicContact CD1-CD1 3.68Å; L459-L463 VanDerWaalsContact O-CB 3.29Å; L459-L463 WeakPolarHBondContact O-CB 3.32Å; L459-L463 PolarHBondContact O-N 3.37Å; R460-L463 PolarHBondContact O-N 3.15Å; V461-L463 VanDerWaalsContact C-N 3.31Å; V461-L463 PolarHBondContact O-N 3.22Å; L463-E465 PolarHBondContact O-N 2.84Å; L463-L466 PolarHBondContact O-N 3.34Å; L463-K467 HydrophobicContact CD2-CD 3.53Å; L463-K467 HydrophobicContact CD2-CG 4.02Å; L463-K467 WeakPolarHBondContact O-CG 3.4Å; L463-K467 PolarHBondContact O-N 3.5Å
464	S	95.3	Very high	93.9	Very high	51 Å²	51	81 Å²	81	36%	0.357	37%	0.368	S	S	.	.	H	α-helix	trans	-65.8	-38.9	179	75.3	0	0	0	0	112	R460 V461 K467 K468	R460-S464 PolarHBondContact O-N 2.85Å; V461-S464 PolarHBondContact O-N 2.98Å; V461-S464 PolarHBondContact O-OG 2.96Å; S464-K467 PolarHBondContact O-N 2.93Å; S464-K468 VanDerWaalsContact O-CG 3.3Å; S464-K468 WeakPolarHBondContact O-CG 3.3Å; S464-K468 PolarHBondContact O-N 3.45Å
465	E	96.2	Very high	94.1	Very high	89 Å²	89	83 Å²	83	42%	0.416	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-47.8	171.8	-70.8	173.9	-178.2	0	0	112.2	V461 R462 L463 K467 K468 L469	V461-E465 WeakPolarHBondContact O-CG 3.44Å; V461-E465 PolarHBondContact O-N 3.15Å; R462-E465 IonicContact NH1-OE2 2.68Å; R462-E465 PolarHBondContact O-N 3.44Å; L463-E465 PolarHBondContact O-N 2.84Å; E465-K467 PolarHBondContact O-N 3.43Å; E465-K468 WeakPolarHBondContact O-CB 3.33Å; E465-K468 PolarHBondContact O-N 2.95Å; E465-L469 WeakPolarHBondContact O-CG 3.27Å; E465-L469 PolarHBondContact O-N 3.4Å
466	L	96.2	Very high	94.3	Very high	3 Å²	3	81 Å²	81	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-63.1	-41.5	178.7	-72.9	171.2	0	0	0	111.9	L402 E405 V406 T409 R462 L463 K468 L469 Q470	L402-L466 HydrophobicContact CD2-CD2 3.97Å; E405-L466 HydrophobicContact CB-CD1 4.36Å; E405-L466 HydrophobicContact CB-CD2 4.45Å; E405-L466 HydrophobicContact CG-CD1 3.74Å; E405-L466 HydrophobicContact CG-CD2 4.03Å; V406-L466 HydrophobicContact CG2-CB 3.72Å; T409-L466 HydrophobicContact CG2-CD1 3.79Å; R462-L466 HydrophobicContact CG-CD1 4.03Å; R462-L466 HydrophobicContact CG-CG 4.42Å; R462-L466 WeakPolarHBondContact O-CB 3.29Å; R462-L466 VanDerWaalsContact O-CG 3.28Å; R462-L466 WeakPolarHBondContact O-CG 3.47Å; R462-L466 PolarHBondContact O-N 2.97Å; L463-L466 PolarHBondContact O-N 3.34Å; L466-K468 VanDerWaalsContact C-N 3.35Å; L466-K468 PolarHBondContact O-N 3.17Å; L466-L469 PolarHBondContact O-N 3.47Å; L466-Q470 WeakPolarHBondContact O-CB 3.39Å; L466-Q470 PolarHBondContact O-N 3.48Å
467	K	96.1	Very high	94.5	Very high	75 Å²	75	81.2 Å²	81.2	33%	0.326	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-38	174.3	-74.3	-171.9	-177.8	176.2	0	112.1	E410 L463 S464 E465 Q470 R471	E410-K467 WeakPolarHBondContact OE1-CE 3.32Å; E410-K467 IonicContact OE1-NZ 2.8Å; E410-K467 PolarHBondContact OE1-NZ 3.47Å; L463-K467 HydrophobicContact CD2-CD 3.53Å; L463-K467 HydrophobicContact CD2-CG 4.02Å; L463-K467 WeakPolarHBondContact O-CG 3.4Å; L463-K467 PolarHBondContact O-N 3.5Å; S464-K467 PolarHBondContact O-N 2.93Å; E465-K467 PolarHBondContact O-N 3.43Å; K467-Q470 PolarHBondContact O-N 2.95Å; K467-R471 WeakPolarHBondContact O-CG 3.45Å; K467-R471 PolarHBondContact O-N 3.45Å
468	K	96.3	Very high	94.5	Very high	149 Å²	149	85.8 Å²	85.8	65%	0.648	38%	0.384	S	S	*	.	H	α-helix	trans	-63.6	-44.7	173.1	-74.1	174.7	-178.1	-176.4	0	111.8	S464 E465 L466 Q470 R471 R472	S464-K468 VanDerWaalsContact O-CG 3.3Å; S464-K468 WeakPolarHBondContact O-CG 3.3Å; S464-K468 PolarHBondContact O-N 3.45Å; E465-K468 WeakPolarHBondContact O-CB 3.33Å; E465-K468 PolarHBondContact O-N 2.95Å; L466-K468 VanDerWaalsContact C-N 3.35Å; L466-K468 PolarHBondContact O-N 3.17Å; K468-Q470 VanDerWaalsContact C-N 3.34Å; K468-R471 PolarHBondContact O-N 3.42Å; K468-R472 WeakPolarHBondContact O-CB 3.47Å; K468-R472 PolarHBondContact O-N 3.48Å
469	L	94.8	Very high	94.4	Very high	81 Å²	81	83.5 Å²	83.5	42%	0.424	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-38.4	175	-68.7	176.6	0	0	0	112	L402 E465 L466 R472 T473	L402-L469 HydrophobicContact CD1-CB 4.13Å; L402-L469 HydrophobicContact CD2-CB 4.05Å; L402-L469 HydrophobicContact CD2-CD1 4.42Å; E465-L469 WeakPolarHBondContact O-CG 3.27Å; E465-L469 PolarHBondContact O-N 3.4Å; L466-L469 PolarHBondContact O-N 3.47Å; L469-R472 PolarHBondContact O-N 3.42Å; L469-T473 WeakPolarHBondContact O-CG2 3.21Å; L469-T473 PolarHBondContact O-N 3.43Å; L469-T473 PolarHBondContact O-OG1 3.1Å
470	Q	95.8	Very high	94.2	Very high	39 Å²	39	84 Å²	84	18%	0.182	40%	0.397	C	S	.	.	H	α-helix	trans	-61.3	-51.3	174.1	-173.9	-169.6	-15.1	0	0	111.1	L466 K467 K468 R472 T473 E474	L466-Q470 WeakPolarHBondContact O-CB 3.39Å; L466-Q470 PolarHBondContact O-N 3.48Å; K467-Q470 PolarHBondContact O-N 2.95Å; K468-Q470 VanDerWaalsContact C-N 3.34Å; Q470-R472 VanDerWaalsContact C-N 3.3Å; Q470-R472 PolarHBondContact O-N 3.02Å; Q470-T473 PolarHBondContact O-N 3.17Å; Q470-T473 PolarHBondContact O-OG1 2.78Å; Q470-E474 PolarHBondContact NE2-OE1 3.41Å; Q470-E474 WeakPolarHBondContact O-CB 3.34Å; Q470-E474 WeakPolarHBondContact O-CG 3.49Å; Q470-E474 PolarHBondContact O-N 2.66Å
471	R	95.7	Very high	93.8	Very high	145 Å²	145	85.2 Å²	85.2	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-56.8	-44.3	176.1	-69.8	179.2	-168.8	-178.5	1.2	111.3	K467 K468 E474 L475 E534	K467-R471 WeakPolarHBondContact O-CG 3.45Å; K467-R471 PolarHBondContact O-N 3.45Å; K468-R471 PolarHBondContact O-N 3.42Å; R471-E474 PolarHBondContact O-N 2.83Å; R471-L475 WeakPolarHBondContact O-CG 3.48Å; R471-L475 PolarHBondContact O-N 2.94Å; R471-E534 IonicContact NH1-OE2 2.7Å
472	R	95.2	Very high	93.3	Very high	172 Å²	172	85.9 Å²	85.9	65%	0.649	41%	0.408	S	S	*	.	H	α-helix	trans	-61.9	-45.8	177.9	-176.5	-179.3	176	124.2	0.1	112.4	K468 L469 Q470 L475 L476	K468-R472 WeakPolarHBondContact O-CB 3.47Å; K468-R472 PolarHBondContact O-N 3.48Å; L469-R472 PolarHBondContact O-N 3.42Å; Q470-R472 VanDerWaalsContact C-N 3.3Å; Q470-R472 PolarHBondContact O-N 3.02Å; R472-L475 WeakPolarHBondContact O-CB 3.35Å; R472-L475 PolarHBondContact O-N 3.13Å; R472-L476 HydrophobicContact CG-CD1 4.49Å; R472-L476 WeakPolarHBondContact O-CG 3.24Å; R472-L476 PolarHBondContact O-N 2.99Å
473	T	93.9	Very high	92.5	Very high	16 Å²	16	84.8 Å²	84.8	10%	0.098	42%	0.422	C	S	.	.	H	α-helix	trans	-68.2	-36.9	178.8	51.2	0	0	0	0	112	L402 L469 Q470 L475 L476 I477	L402-T473 HydrophobicContact CD1-CG2 3.67Å; L402-T473 WeakPolarHBondContact CD1-OG1 3.36Å; L469-T473 WeakPolarHBondContact O-CG2 3.21Å; L469-T473 PolarHBondContact O-N 3.43Å; L469-T473 PolarHBondContact O-OG1 3.1Å; Q470-T473 PolarHBondContact O-N 3.17Å; Q470-T473 PolarHBondContact O-OG1 2.78Å; T473-L475 VanDerWaalsContact C-N 3.32Å; T473-L475 PolarHBondContact O-N 3.07Å; T473-L476 PolarHBondContact O-N 3.35Å; T473-I477 VanDerWaalsContact O-CG1 3.29Å; T473-I477 WeakPolarHBondContact O-CG1 3.49Å; T473-I477 PolarHBondContact O-N 3.09Å
474	E	94.8	Very high	91.6	Very high	64 Å²	64	89.1 Å²	89.1	30%	0.299	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-40.5	171.5	-75.8	173.8	-175.4	0	0	112.2	L399 Q470 R471 I477 K478	L399-E474 HydrophobicContact CD1-CB 4.49Å; L399-E474 HydrophobicContact CD1-CG 3.44Å; L399-E474 VanDerWaalsContact CD1-CG 3.44Å; L399-E474 HydrophobicContact CG-CG 4.46Å; Q470-E474 PolarHBondContact NE2-OE1 3.41Å; Q470-E474 WeakPolarHBondContact O-CB 3.34Å; Q470-E474 WeakPolarHBondContact O-CG 3.49Å; Q470-E474 PolarHBondContact O-N 2.66Å; R471-E474 PolarHBondContact O-N 2.83Å; E474-I477 PolarHBondContact O-N 3.05Å; E474-K478 WeakPolarHBondContact O-CG 3.4Å; E474-K478 PolarHBondContact O-N 3Å; E474-K478 VanDerWaalsContact O-N 3.16Å
475	L	93.9	Very high	90.4	Very high	103 Å²	103	94.6 Å²	94.6	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-44.9	172.9	-69.4	170.8	0	0	0	111.8	R471 R472 T473 I477 K478 V479	R471-L475 WeakPolarHBondContact O-CG 3.48Å; R471-L475 PolarHBondContact O-N 2.94Å; R472-L475 WeakPolarHBondContact O-CB 3.35Å; R472-L475 PolarHBondContact O-N 3.13Å; T473-L475 VanDerWaalsContact C-N 3.32Å; T473-L475 PolarHBondContact O-N 3.07Å; L475-I477 VanDerWaalsContact C-N 3.27Å; L475-I477 PolarHBondContact O-N 3.31Å; L475-K478 WeakPolarHBondContact O-CB 3.37Å; L475-K478 PolarHBondContact O-N 3.21Å; L475-K478 VanDerWaalsContact O-N 3.12Å; L475-V479 WeakPolarHBondContact O-CG2 3.4Å; L475-V479 PolarHBondContact O-N 2.9Å; L475-V479 VanDerWaalsContact O-N 3.13Å
476	L	92.2	Very high	89.3	Confident	72 Å²	72	95.7 Å²	95.7	38%	0.377	49%	0.488	S	S	.	.	H	α-helix	trans	-60	-37.4	176.2	-70.7	172.2	0	0	0	112	L395 R472 T473 V479 A480	L395-L476 HydrophobicContact CD1-CB 3.92Å; L395-L476 HydrophobicContact CD2-CB 4.27Å; L395-L476 HydrophobicContact CD2-CD1 4.22Å; R472-L476 HydrophobicContact CG-CD1 4.49Å; R472-L476 WeakPolarHBondContact O-CG 3.24Å; R472-L476 PolarHBondContact O-N 2.99Å; T473-L476 PolarHBondContact O-N 3.35Å; L476-V479 PolarHBondContact O-N 3.18Å; L476-A480 VanDerWaalsContact O-CB 3.22Å; L476-A480 WeakPolarHBondContact O-CB 3.32Å; L476-A480 PolarHBondContact O-N 3.44Å
477	I	92.9	Very high	88.1	Confident	22 Å²	22	105.5 Å²	105.5	11%	0.113	53%	0.531	C	S	.	.	H	α-helix	trans	-65.9	-38.6	175.8	-71.5	167.9	0	0	0	111.5	Y392 L395 Q396 L399 T473 E474 L475 V479 A480 R481	Y392-I477 HydrophobicContact CD2-CG2 4.31Å; Y392-I477 HydrophobicContact CE2-CG2 3.57Å; L395-I477 HydrophobicContact CB-CD1 4.32Å; L395-I477 HydrophobicContact CB-CG1 3.65Å; Q396-I477 HydrophobicContact CG-CD1 4.45Å; L399-I477 HydrophobicContact CB-CD1 3.81Å; L399-I477 HydrophobicContact CD1-CD1 3.38Å; L399-I477 HydrophobicContact CG-CD1 4.23Å; T473-I477 VanDerWaalsContact O-CG1 3.29Å; T473-I477 WeakPolarHBondContact O-CG1 3.49Å; T473-I477 PolarHBondContact O-N 3.09Å; E474-I477 PolarHBondContact O-N 3.05Å; L475-I477 VanDerWaalsContact C-N 3.27Å; L475-I477 PolarHBondContact O-N 3.31Å; I477-V479 VanDerWaalsContact C-N 3.3Å; I477-V479 PolarHBondContact O-N 3.34Å; I477-A480 PolarHBondContact O-N 3.03Å; I477-R481 WeakPolarHBondContact O-CB 3.4Å; I477-R481 PolarHBondContact O-N 3.46Å
478	K	90.5	Very high	86.5	Confident	154 Å²	154	110.2 Å²	110.2	67%	0.67	56%	0.559	S	S	*	*	H	α-helix	trans	-62.3	-40	175.4	-70.2	173.7	-174.9	176.9	0	111.2	E474 L475	E474-K478 WeakPolarHBondContact O-CG 3.4Å; E474-K478 PolarHBondContact O-N 3Å; E474-K478 VanDerWaalsContact O-N 3.16Å; L475-K478 WeakPolarHBondContact O-CB 3.37Å; L475-K478 PolarHBondContact O-N 3.21Å; L475-K478 VanDerWaalsContact O-N 3.12Å
479	V	90.4	Very high	85.1	Confident	128 Å²	128	112.7 Å²	112.7	78%	0.776	57%	0.57	S	S	*	*	H	α-helix	trans	-73.1	-42.5	178.1	178.2	0	0	0	0	111.9	L475 L476 I477 R481	L475-V479 WeakPolarHBondContact O-CG2 3.4Å; L475-V479 PolarHBondContact O-N 2.9Å; L475-V479 VanDerWaalsContact O-N 3.13Å; L476-V479 PolarHBondContact O-N 3.18Å; I477-V479 VanDerWaalsContact C-N 3.3Å; I477-V479 PolarHBondContact O-N 3.34Å; V479-R481 VanDerWaalsContact C-N 3.26Å; V479-R481 PolarHBondContact O-N 2.94Å
480	A	88.9	Confident	83.9	Confident	39 Å²	39	118 Å²	118	32%	0.322	59%	0.589	S	S	.	*	H	α-helix	trans	-79.2	-4.3	-178.1	0	0	0	0	0	113.8	Y392 L395 L476 I477 P482	Y392-A480 HydrophobicContact CD2-CB 4.28Å; L395-A480 HydrophobicContact CD1-CB 3.84Å; L476-A480 VanDerWaalsContact O-CB 3.22Å; L476-A480 WeakPolarHBondContact O-CB 3.32Å; L476-A480 PolarHBondContact O-N 3.44Å; I477-A480 PolarHBondContact O-N 3.03Å; A480-P482 WeakPolarHBondContact O-CD 3.5Å
481	R	86.8	Confident	82.3	Confident	175 Å²	175	121.7 Å²	121.7	66%	0.66	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-63.2	119.6	-178.2	-172.6	178.3	-177.8	177.6	1.2	109.6	Y392 I477 V479 A483	Y392-R481 HydrophobicContact CD2-CB 4.46Å; Y392-R481 HydrophobicContact CE2-CB 3.98Å; Y392-R481 HydrophobicContact CE2-CG 4.21Å; I477-R481 WeakPolarHBondContact O-CB 3.4Å; I477-R481 PolarHBondContact O-N 3.46Å; V479-R481 VanDerWaalsContact C-N 3.26Å; V479-R481 PolarHBondContact O-N 2.94Å; R481-A483 PolarHBondContact O-N 3.46Å
482	P	83.5	Confident	80.9	Confident	92 Å²	92	120.4 Å²	120.4	60%	0.597	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-61.8	133.2	177.2	24.3	-32.3	0	0	0	110.1	A480	A480-P482 WeakPolarHBondContact O-CD 3.5Å
483	A	76.6	Confident	79.5	Confident	83 Å²	83	118 Å²	118	69%	0.686	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-59.2	131.2	179.8	0	0	0	0	0	110.4	R481 M485	R481-A483 PolarHBondContact O-N 3.46Å; A483-M485 PolarHBondContact O-N 3.47Å
484	P	77.4	Confident	77.3	Confident	120 Å²	120	122.2 Å²	122.2	78%	0.779	67%	0.67	S	S	*	*			trans	-67.1	108.1	178.2	27	-32.5	0	0	0	109.4
485	M	70.1	Confident	75.5	Confident	166 Å²	166	125.7 Å²	125.7	82%	0.818	70%	0.695	S	S	*	*			trans	-66.6	130	174.8	-73.4	-70.9	-76.5	0	0	109.9	A483 F487	A483-M485 PolarHBondContact O-N 3.47Å; M485-F487 PolarHBondContact O-N 2.93Å
486	P	73.4	Confident	73.5	Confident	112 Å²	112	127.5 Å²	127.5	73%	0.727	71%	0.706	S	S	*	*			trans	-65.3	132.3	175.4	26.3	-32.7	0	0	0	110	L488	P486-L488 PolarHBondContact O-N 3.43Å; P486-L488 VanDerWaalsContact O-N 3.09Å
487	F	70.3	Confident	71.6	Confident	209 Å²	209	130.6 Å²	130.6	92%	0.917	73%	0.728	S	S	*	*			trans	-58.8	114.4	174.8	-72.8	-83.2	0	0	0	110.5	M485 K489	M485-F487 PolarHBondContact O-N 2.93Å; F487-K489 PolarHBondContact O-N 2.85Å
488	L	62.2	Low	69.6	Low	174 Å²	174	138 Å²	138	91%	0.911	76%	0.759	S	S	*	*			trans	-61.8	104.6	169	-80.3	162.2	0	0	0	109.3	P486 K490	P486-L488 PolarHBondContact O-N 3.43Å; P486-L488 VanDerWaalsContact O-N 3.09Å; L488-K490 PolarHBondContact O-N 2.91Å
489	K	68.8	Low	67.6	Low	201 Å²	201	135.6 Å²	135.6	87%	0.874	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-63.5	117.8	168.1	-73.3	-180	179.9	175.4	0	108.3	F487	F487-K489 PolarHBondContact O-N 2.85Å
490	K	68.4	Low	65.6	Low	192 Å²	192	136.8 Å²	136.8	84%	0.835	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-55.5	135.2	170.1	-67	178.6	-179.8	177.8	0	109	L488	L488-K490 PolarHBondContact O-N 2.91Å
491	P	62.1	Low	63.6	Low	116 Å²	116	138.1 Å²	138.1	75%	0.753	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63.2	139.6	177.2	26.1	-33	0	0	0	110.2
492	P	66.3	Low	61.7	Low	118 Å²	118	135.8 Å²	135.8	77%	0.766	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.5	146.1	176.2	27.4	-33.2	0	0	0	110.8
493	P	65.9	Low	59.9	Low	121 Å²	121	140.7 Å²	140.7	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64.2	136.7	179.6	26.7	-33.6	0	0	0	111.4	V495	P493-V495 PolarHBondContact O-N 3.29Å
494	A	49	Very low	58.3	Low	105 Å²	105	140.5 Å²	140.5	87%	0.868	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-55.7	126.8	-179.4	0	0	0	0	0	112.3
495	V	56.2	Low	56.7	Low	137 Å²	137	138.3 Å²	138.3	83%	0.83	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82	122.7	175	-162.7	0	0	0	0	109	P493 V497	P493-V495 PolarHBondContact O-N 3.29Å; V495-V497 PolarHBondContact O-N 2.9Å
496	N	52.2	Low	55.8	Low	142 Å²	142	141.8 Å²	141.8	76%	0.759	82%	0.822	S	S	*	*			trans	-67.5	109.9	-175.6	-168	4.2	0	0	0	111.5
497	V	51.6	Low	54.7	Low	137 Å²	137	139.5 Å²	139.5	83%	0.83	82%	0.819	S	S	*	*			trans	-98.2	118.4	169.8	-170.4	0	0	0	0	108.8	V495	V495-V497 PolarHBondContact O-N 2.9Å
498	K	50.4	Low	53.8	Low	178 Å²	178	138.1 Å²	138.1	77%	0.774	82%	0.82	S	S	*	*			trans	-72	129.4	-176.5	-67.1	175.4	177.6	176.3	0	112
499	S	49.1	Very low	53.2	Low	103 Å²	103	141.4 Å²	141.4	72%	0.72	82%	0.82	S	S	*	*			trans	24.7	122.5	141.8	62.6	0	0	0	0	120.1
500	V	48.8	Very low	52	Low	152 Å²	152	136.5 Å²	136.5	92%	0.921	82%	0.817	S	S	*	*				-165	109.1	115.7	-162.4	0	0	0	0	105.9
501	G	47	Very low	51	Low	67 Å²	67	138.9 Å²	138.9	69%	0.691	82%	0.821	S	S	*	*				114.5	127.3	95	0	0	0	0	0	110.4
502	P	46	Very low	50.4	Low	127 Å²	127	138 Å²	138	83%	0.825	82%	0.824	S	S	*	*			trans	-100.8	142.3	-157	36.9	-30.7	0	0	0	113.8
503	M	45.6	Very low	49.6	Very low	194 Å²	194	138.7 Å²	138.7	96%	0.956	83%	0.825	S	S	*	*			trans	-150.1	120.4	153	-100.5	-133.5	-83.5	0	0	112.2
504	G	44.1	Very low	49.2	Very low	80 Å²	80	138.6 Å²	138.6	83%	0.825	82%	0.822	S	S	*	*			trans	32.8	125	147.6	0	0	0	0	0	121
505	G	44	Very low	49.7	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	81%	0.814	S	S	*	*			trans	161.5	87	157.5	0	0	0	0	0	114.2
506	Y	50.4	Low	49.7	Very low	239 Å²	239	138.8 Å²	138.8	94%	0.937	81%	0.814	S	S	*	*			trans	-56.2	135.3	167.8	-42.7	-92	0	0	0	110.6
507	G	50.1	Low	50.1	Low	64 Å²	64	137.6 Å²	137.6	66%	0.66	81%	0.812	S	S	*	*			trans	159.6	95.7	165.7	0	0	0	0	0	117.1
508	L	52	Low	50.8	Low	181 Å²	181	136 Å²	136	95%	0.948	81%	0.805	S	S	*	*			trans	66.4	119.1	140.2	-73.3	142.5	0	0	0	120.3
509	R	48.6	Very low	51.6	Low	243 Å²	243	133.5 Å²	133.5	92%	0.917	81%	0.806	S	S	*	*			trans	-62.4	125.7	173	-71.6	167.5	142	175.7	-8	112.7
510	A	44.1	Very low	51.9	Low	98 Å²	98	132.7 Å²	132.7	81%	0.81	81%	0.806	S	S	*	*				36.2	109.1	123.6	0	0	0	0	0	119.2
511	R	47.5	Very low	52.3	Low	241 Å²	241	131.3 Å²	131.3	91%	0.909	80%	0.801	S	S	*	*				-162.5	88.4	123.7	-146.9	167.8	168.8	167.5	-5.3	109.2
512	A	49.3	Very low	52.1	Low	98 Å²	98	136.3 Å²	136.3	81%	0.81	81%	0.806	S	S	*	*			trans	-85.5	112	171.3	0	0	0	0	0	108.8
513	V	49.1	Very low	52.1	Low	133 Å²	133	137.6 Å²	137.6	81%	0.806	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.7	116.7	168.6	174.8	0	0	0	0	107
514	V	57.6	Low	52	Low	118 Å²	118	135.7 Å²	135.7	72%	0.715	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.6	127.5	170.7	-178.8	0	0	0	0	107.5	V516	V514-V516 PolarHBondContact O-N 3.33Å
515	P	60.3	Low	51.5	Low	106 Å²	106	137.9 Å²	137.9	69%	0.688	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.7	122.9	171.3	29.2	-30.4	0	0	0	108.7	V517	P515-V517 PolarHBondContact O-N 3.48Å
516	V	54.9	Low	51.6	Low	140 Å²	140	141.9 Å²	141.9	85%	0.848	79%	0.793	S	S	*	*			trans	-72.5	107.1	170.4	175.1	0	0	0	0	107.4	V514	V514-V516 PolarHBondContact O-N 3.33Å
517	V	62.4	Low	51.4	Low	118 Å²	118	138.6 Å²	138.6	72%	0.715	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-78.9	123.2	165.7	177.3	0	0	0	0	106.9	P515	P515-V517 PolarHBondContact O-N 3.48Å
518	P	66.2	Low	51.1	Low	104 Å²	104	140.7 Å²	140.7	68%	0.675	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67.6	133	174.9	27.2	-31.7	0	0	0	109.5
519	P	66.1	Low	50.4	Low	124 Å²	124	140.4 Å²	140.4	81%	0.805	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.4	141.1	168.1	27.8	-31.1	0	0	0	109.6
520	A	56.7	Low	49.8	Very low	87 Å²	87	134.4 Å²	134.4	72%	0.719	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-54	150.2	179.2	0	0	0	0	0	112.1	E522	A520-E522 PolarHBondContact O-N 3.14Å
521	P	56.8	Low	49.7	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	76%	0.76	S	S	*	*			trans	-66.5	110.4	176	28	-32.7	0	0	0	109.4	I523	P521-I523 PolarHBondContact O-N 3.49Å; P521-I523 VanDerWaalsContact O-N 3.16Å
522	E	43.1	Very low	49.3	Very low	171 Å²	171	132.3 Å²	132.3	80%	0.799	75%	0.754	S	S	*	*			trans	-64.4	111	158.5	-103.9	176.4	173.5	0	0	107	A520 Q524	A520-E522 PolarHBondContact O-N 3.14Å; E522-Q524 PolarHBondContact O-N 3.03Å
523	I	45	Very low	48.9	Very low	154 Å²	154	135.4 Å²	135.4	79%	0.79	75%	0.749	S	S	*	*			trans	-64.3	90.6	167.6	-60.2	168.2	0	0	0	105.9	P521 T525	P521-I523 PolarHBondContact O-N 3.49Å; P521-I523 VanDerWaalsContact O-N 3.16Å; I523-T525 PolarHBondContact O-N 3.1Å
524	Q	43.1	Very low	48.6	Very low	155 Å²	155	135.6 Å²	135.6	72%	0.724	74%	0.741	S	S	*	*			trans	-77.9	104.6	157.4	-68.1	-175.5	15.6	0	0	105.4	E522 I526	E522-Q524 PolarHBondContact O-N 3.03Å; Q524-I526 VanDerWaalsContact C-N 3.3Å; Q524-I526 PolarHBondContact O-N 2.9Å
525	T	35.2	Very low	47.9	Very low	125 Å²	125	137.1 Å²	137.1	77%	0.767	75%	0.745	S	S	*	*			trans	-50.8	102	161.8	-0.9	0	0	0	0	106.7	I523 E527	I523-T525 PolarHBondContact O-N 3.1Å; T525-E527 VanDerWaalsContact C-N 3.33Å; T525-E527 PolarHBondContact O-N 2.71Å
526	I	44.4	Very low	47.1	Very low	157 Å²	157	141.2 Å²	141.2	81%	0.805	76%	0.755	S	S	*	*			trans	-65.5	103	166.1	-62.4	164.1	0	0	0	103.6	Q524	Q524-I526 VanDerWaalsContact C-N 3.3Å; Q524-I526 PolarHBondContact O-N 2.9Å
527	E	46.7	Very low	46.4	Very low	171 Å²	171	141.1 Å²	141.1	80%	0.799	75%	0.75	S	S	*	*			trans	-59.2	131.1	164.7	-66	-142.4	158.6	0	0	107.1	T525 F529	T525-E527 VanDerWaalsContact C-N 3.33Å; T525-E527 PolarHBondContact O-N 2.71Å; E527-F529 PolarHBondContact O-N 3.25Å; E527-F529 VanDerWaalsContact O-N 3.15Å
528	P	44.1	Very low	45.2	Very low	108 Å²	108	142.9 Å²	142.9	70%	0.701	76%	0.755	S	S	*	*			trans	-56.7	126.4	-179	23.5	-31.6	0	0	0	108.3	T530	P528-T530 PolarHBondContact O-N 3.2Å; P528-T530 PolarHBondContact O-OG1 3.09Å
529	F	37.7	Very low	43.8	Very low	174 Å²	174	145.4 Å²	145.4	76%	0.763	76%	0.763	S	S	*	*			trans	-62.3	90	166.8	179.5	-103.9	0	0	0	106.9	E527 E531	E527-F529 PolarHBondContact O-N 3.25Å; E527-F529 VanDerWaalsContact O-N 3.15Å; F529-E531 HydrophobicContact CD1-CG 4.4Å; F529-E531 HydrophobicContact CE1-CB 4.41Å; F529-E531 HydrophobicContact CE1-CG 3.68Å; F529-E531 HydrophobicContact CZ-CG 4.29Å; F529-E531 PolarHBondContact O-N 2.65Å; F529-E531 VanDerWaalsContact O-N 3.15Å
530	T	36.2	Very low	42.6	Very low	117 Å²	117	147.8 Å²	147.8	72%	0.718	76%	0.764	S	S	*	*			trans	-72.5	100	168	-10.4	0	0	0	0	106.2	P528 E532	P528-T530 PolarHBondContact O-N 3.2Å; P528-T530 PolarHBondContact O-OG1 3.09Å; T530-E532 VanDerWaalsContact C-N 3.31Å; T530-E532 PolarHBondContact O-N 3.47Å
531	E	41.3	Very low	42	Very low	127 Å²	127	150 Å²	150	59%	0.593	77%	0.768	S	S	*	*			trans	-61.9	100.1	159.8	-119.7	166.7	-164.9	0	0	106.6	F529 F533	F529-E531 HydrophobicContact CD1-CG 4.4Å; F529-E531 HydrophobicContact CE1-CB 4.41Å; F529-E531 HydrophobicContact CE1-CG 3.68Å; F529-E531 HydrophobicContact CZ-CG 4.29Å; F529-E531 PolarHBondContact O-N 2.65Å; F529-E531 VanDerWaalsContact O-N 3.15Å; E531-F533 HydrophobicContact CB-CD2 4.19Å; E531-F533 HydrophobicContact CB-CE2 4.16Å; E531-F533 PolarHBondContact O-N 2.88Å
532	E	39	Very low	41.1	Very low	169 Å²	169	149.6 Å²	149.6	79%	0.79	77%	0.765	S	S	*	*			trans	-67	88	170.4	-70	-179.1	166.8	0	0	107.8	T530 E534	T530-E532 VanDerWaalsContact C-N 3.31Å; T530-E532 PolarHBondContact O-N 3.47Å; E532-E534 PolarHBondContact O-N 2.93Å; E532-E534 VanDerWaalsContact O-N 3.15Å
533	F	41.9	Very low	40.7	Very low	163 Å²	163	148.3 Å²	148.3	72%	0.715	77%	0.77	S	S	*	*			trans	-66.3	99.6	157.9	-83.5	-96	0	0	0	107.2	E531 D535	E531-F533 HydrophobicContact CB-CD2 4.19Å; E531-F533 HydrophobicContact CB-CE2 4.16Å; E531-F533 PolarHBondContact O-N 2.88Å; F533-D535 VanDerWaalsContact C-N 3.29Å; F533-D535 PolarHBondContact O-N 2.86Å
534	E	41.4	Very low	40.4	Very low	137 Å²	137	146 Å²	146	64%	0.64	77%	0.767	S	S	*	*			trans	-71.7	87.4	167	-70.4	-177.9	151.3	0	0	108.3	R471 E532 E536	R471-E534 IonicContact NH1-OE2 2.7Å; E532-E534 PolarHBondContact O-N 2.93Å; E532-E534 VanDerWaalsContact O-N 3.15Å; E534-E536 PolarHBondContact O-N 2.74Å; E534-E536 VanDerWaalsContact O-N 3.12Å
535	D	43.4	Very low	40	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	77%	0.766	S	S	*	*			trans	-68	95.4	163.8	-80.9	-40	0	0	0	109.3	F533 N537	F533-D535 VanDerWaalsContact C-N 3.29Å; F533-D535 PolarHBondContact O-N 2.86Å; D535-N537 VanDerWaalsContact C-N 3.3Å; D535-N537 PolarHBondContact O-N 2.86Å
536	E	43.7	Very low	40.3	Very low	192 Å²	192	146.6 Å²	146.6	90%	0.897	77%	0.774	S	S	*	*			trans	-75.1	81.9	167.5	-77.7	-171.9	154.3	0	0	109.9	E534	E534-E536 PolarHBondContact O-N 2.74Å; E534-E536 VanDerWaalsContact O-N 3.12Å
537	N	39.1	Very low	39.8	Very low	138 Å²	138	146.3 Å²	146.3	74%	0.738	77%	0.774	S	S	*	*			trans	-147.9	78	162.7	-162.9	26.3	0	0	0	110.8	D535	D535-N537 VanDerWaalsContact C-N 3.3Å; D535-N537 PolarHBondContact O-N 2.86Å
538	D	38.4	Very low	39.4	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	77%	0.772	S	S	*	*			trans	-151.6	94.9	157.1	-94.5	-34.3	0	0	0	111.7	Q540	D538-Q540 PolarHBondContact O-N 2.91Å
539	N	36.5	Very low	39.1	Very low	158 Å²	158	143.7 Å²	143.7	85%	0.845	78%	0.777	S	S	*	*			trans	-88.5	82	162.9	-153.8	12.2	0	0	0	106.9
540	Q	41.7	Very low	38.9	Very low	174 Å²	174	139.9 Å²	139.9	81%	0.813	78%	0.778	S	S	*	*			trans	-152	119.2	167.8	-111.5	166.8	88	0	0	111.8	D538	D538-Q540 PolarHBondContact O-N 2.91Å
541	V	44.3	Very low	38.9	Very low	132 Å²	132	143.3 Å²	143.3	80%	0.8	79%	0.785	S	S	*	*			trans	-74.7	138.6	-176.6	-172.6	0	0	0	0	110.1
542	P	36.2	Very low	38.3	Very low	115 Å²	115	143.5 Å²	143.5	75%	0.747	80%	0.795	S	S	*	*			trans	-92	129.7	177.9	34.1	-29	0	0	0	111.6
543	T	35.6	Very low	38.3	Very low	145 Å²	145	142.8 Å²	142.8	89%	0.89	80%	0.802	S	S	*	*			trans	-131.6	117.4	156	55.1	0	0	0	0	110.5
544	S	38.7	Very low	37.9	Very low	105 Å²	105	142.3 Å²	142.3	73%	0.734	81%	0.807	S	S	*	*			trans	-133.1	141.8	174.9	59.4	0	0	0	0	105.2
545	T	34	Very low	37.7	Very low	115 Å²	115	139.8 Å²	139.8	71%	0.706	81%	0.81	S	S	*	*			cis	-167.7	139.5	-2.1	-61.3	0	0	0	0	103.7
546	L	41.5	Very low	37.4	Very low	178 Å²	178	139.6 Å²	139.6	93%	0.932	81%	0.809	S	S	*	*			trans	-135.8	117.8	156.2	-82.4	175.1	0	0	0	108.5
547	D	34.1	Very low	37.2	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	80%	0.802	S	S	*	*			trans	-55.2	144.3	171.6	-90.6	-38.8	0	0	0	112.4
548	S	37.9	Very low	37.2	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	80%	0.804	S	S	*	*				168.5	113.5	126.5	-69.7	0	0	0	0	111.8
549	S	39.1	Very low	37.3	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	80%	0.798	S	S	*	*			trans	62.6	105.3	134.3	-48.7	0	0	0	0	121.2
550	A	32.9	Very low	37.1	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	80%	0.795	S	S	*	*				38.6	117.3	128.9	0	0	0	0	0	119.9
551	E	35.6	Very low	36.9	Very low	189 Å²	189	130.5 Å²	130.5	88%	0.883	80%	0.8	S	S	*	*				-178.2	137.5	97.8	-102.8	-179.2	159.5	0	0	112
552	T	30	Very low	36.3	Very low	131 Å²	131	133 Å²	133	80%	0.804	80%	0.802	S	S	*	*			trans	-57.8	129.3	174.8	-6.4	0	0	0	0	113.2
553	V	38.5	Very low	36.4	Very low	154 Å²	154	137.2 Å²	137.2	93%	0.933	81%	0.809	S	S	*	*			trans	-152.2	137.1	135.4	-120.8	0	0	0	0	112.7
554	N	33.2	Very low	36.2	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	81%	0.807	S	S	*	*			trans	-96.3	138.2	-169.7	-170.2	11.8	0	0	0	109.2
555	A	37	Very low	36.1	Very low	84 Å²	84	135 Å²	135	69%	0.694	81%	0.812	S	S	*	*			trans	-173.9	115.3	151.7	0	0	0	0	0	114.2
556	N	38.1	Very low	35.9	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	82%	0.822	S	S	*	*			trans	76.2	91.7	136.2	-62.7	-11.3	0	0	0	121.6
557	S	39.3	Very low	35.9	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	82%	0.818	S	S	*	*				34.4	158	94.5	-48.9	0	0	0	0	120.3
558	P	39	Very low	35.9	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	82%	0.819	S	S	*	*				-134.5	-125.5	-76.6	28.1	-1	0	0	0	112.2
559	P	40.9	Very low	36.1	Very low	111 Å²	111	137.6 Å²	137.6	72%	0.721	83%	0.827	S	S	*	*				-121.8	-177.9	-105.3	39.2	-19.8	0	0	0	116.3
560	A	31.3	Very low	35.9	Very low	93 Å²	93	138 Å²	138	77%	0.769	83%	0.826	S	S	*	*			trans	63.3	122	151.3	0	0	0	0	0	120.6
561	E	37.3	Very low	36.2	Very low	195 Å²	195	138.4 Å²	138.4	91%	0.911	83%	0.83	S	S	*	*			trans	-162.6	129.8	132.3	-114.2	177.4	-168.7	0	0	112.2
562	E	32.3	Very low	36.7	Very low	184 Å²	184	134 Å²	134	86%	0.86	83%	0.826	S	S	*	*			trans	-61.6	142.3	168.4	-59.4	171.3	134	0	0	111
563	K	38.9	Very low	36.8	Very low	204 Å²	204	133.8 Å²	133.8	89%	0.887	83%	0.827	S	S	*	*			trans	-155.4	119.9	135.1	-75.3	-151.9	177.7	169.6	0	111.8
564	A	30.6	Very low	37	Very low	103 Å²	103	132.8 Å²	132.8	85%	0.851	83%	0.826	S	S	*	*			trans	-66.6	139.4	161	0	0	0	0	0	111.2
565	A	36.9	Very low	37.2	Very low	101 Å²	101	129.2 Å²	129.2	84%	0.835	82%	0.818	S	S	*	*			trans	-169.4	127.2	143.3	0	0	0	0	0	110.7
566	N	30.4	Very low	37	Very low	170 Å²	170	136.5 Å²	136.5	91%	0.909	83%	0.828	S	S	*	*			trans	-51.9	139.6	175	-65.9	-39.5	0	0	0	114
567	S	40.4	Very low	37.1	Very low	121 Å²	121	139.1 Å²	139.1	85%	0.846	83%	0.833	S	S	*	*			trans	-148.9	120.4	137.4	55.8	0	0	0	0	110.9
568	S	34	Very low	36.7	Very low	119 Å²	119	143 Å²	143	83%	0.832	84%	0.836	S	S	*	*			trans	-62.6	139.3	174.7	48.4	0	0	0	0	113.2
569	E	41.9	Very low	36.7	Very low	196 Å²	196	142.3 Å²	142.3	92%	0.916	84%	0.841	S	S	*	*			trans	-140.9	126.7	153.3	-132.7	177.1	-171.2	0	0	109.7
570	P	35.2	Very low	36.7	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	85%	0.849	S	S	*	*			trans	-100.3	141.8	-171.8	36.6	-29.5	0	0	0	111.8
571	A	40	Very low	36.7	Very low	103 Å²	103	147.6 Å²	147.6	85%	0.851	85%	0.849	S	S	*	*			trans	-133.5	105.7	169.6	0	0	0	0	0	112.3
572	A	44.6	Very low	36.9	Very low	96 Å²	96	150.1 Å²	150.1	79%	0.793	85%	0.85	S	S	*	*			trans	63.6	112.6	148	0	0	0	0	0	120.9
573	P	33.1	Very low	37.1	Very low	127 Å²	127	149.3 Å²	149.3	83%	0.825	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-91.8	126.4	166	34.2	-25.3	0	0	0	110.6
574	S	42	Very low	37.1	Very low	132 Å²	132	144.2 Å²	144.2	92%	0.923	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-81	131.2	168.1	-152.3	0	0	0	0	110.4
575	A	37.8	Very low	37.3	Very low	80 Å²	80	151.4 Å²	151.4	66%	0.661	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-72.7	135.8	-159	0	0	0	0	0	114.2
576	R	32.2	Very low	37.4	Very low	236 Å²	236	151.6 Å²	151.6	89%	0.891	85%	0.848	S	S	*	*			trans	-94	100.1	172.7	-168.8	177.1	-178.5	-176.8	2.3	108.9	K578	R576-K578 PolarHBondContact O-N 3.31Å
577	F	40.6	Very low	37.5	Very low	200 Å²	200	149.7 Å²	149.7	88%	0.877	84%	0.842	S	S	*	*			trans	-79.2	116.1	170	-88.5	-81.1	0	0	0	110.7
578	K	32.3	Very low	37.3	Very low	187 Å²	187	150.4 Å²	150.4	81%	0.813	84%	0.841	S	S	*	*			trans	-80.9	126.5	166.5	-74.7	173.2	174.4	172.3	0	108.5	R576	R576-K578 PolarHBondContact O-N 3.31Å
579	A	38.4	Very low	37.4	Very low	106 Å²	106	153 Å²	153	88%	0.876	84%	0.84	S	S	*	*			trans	-116.1	122.9	160.9	0	0	0	0	0	109.8
580	K	40	Very low	37	Very low	206 Å²	206	153.6 Å²	153.6	90%	0.896	84%	0.839	S	S	*	*			trans	-80.4	146.1	-177.9	-76.5	170.8	171.6	173.5	0	110.1
581	S	32.5	Very low	37.1	Very low	109 Å²	109	157.2 Å²	157.2	76%	0.762	84%	0.843	S	S	*	*			trans	-55.9	143.5	169.1	62.3	0	0	0	0	112.4
582	R	41.1	Very low	36.9	Very low	249 Å²	249	160.1 Å²	160.1	94%	0.94	84%	0.844	S	S	*	*			trans	-160.6	95.7	149.7	-111.8	171.3	175.8	-179.3	-3.1	110.7
583	D	35.7	Very low	36.4	Very low	166 Å²	166	159 Å²	159	89%	0.888	84%	0.841	S	S	*	*			trans	-65.9	125.2	157.6	-76.6	-60.1	0	0	0	109.9
584	A	39.1	Very low	36.8	Very low	97 Å²	97	162.2 Å²	162.2	80%	0.802	85%	0.845	S	S	*	*			trans	-167.3	93.3	152.1	0	0	0	0	0	109.2	S586	A584-S586 PolarHBondContact O-N 3.33Å
585	R	34.2	Very low	36.6	Very low	254 Å²	254	160.2 Å²	160.2	96%	0.958	84%	0.837	S	S	*	*			trans	-81.6	97.5	172.2	-166.2	173.1	-177	171.3	0.8	108.3
586	S	40.1	Very low	37	Very low	105 Å²	105	164.4 Å²	164.4	73%	0.734	85%	0.848	S	S	*	*			trans	-89.6	119.2	164.9	54.8	0	0	0	0	109.7	A584	A584-S586 PolarHBondContact O-N 3.33Å
587	V	33.1	Very low	37.6	Very low	131 Å²	131	163 Å²	163	79%	0.794	84%	0.844	S	S	*	*			trans	-56.1	125.4	165.6	171.8	0	0	0	0	109.3
588	V	36.2	Very low	38.1	Very low	135 Å²	135	159.1 Å²	159.1	82%	0.818	84%	0.842	S	S	*	*			trans	-138.5	127	159.3	-177.8	0	0	0	0	109.2
589	E	36.4	Very low	39.7	Very low	173 Å²	173	156 Å²	156	81%	0.808	83%	0.834	S	S	*	*			trans	-64.4	152.8	-179.9	-66.7	169.4	129.9	0	0	112.8	K591	E589-K591 PolarHBondContact O-N 2.84Å
590	K	32.1	Very low	41.2	Very low	210 Å²	210	160.6 Å²	160.6	91%	0.913	83%	0.829	S	S	*	*			trans	-54.4	128.1	169.3	-73	176.6	173.1	178.9	0	110.4
591	K	38.2	Very low	42.4	Very low	200 Å²	200	158 Å²	158	87%	0.87	82%	0.824	S	S	*	*			trans	-139.3	122.9	159	-141.8	174	-174.7	173.7	0	108.8	E589	E589-K591 PolarHBondContact O-N 2.84Å
592	D	35.3	Very low	44.3	Very low	164 Å²	164	156.2 Å²	156.2	88%	0.877	81%	0.81	S	S	*	*			trans	-61	145.6	-179.8	-50.9	-70	0	0	0	112
593	G	34.7	Very low	45.9	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	79%	0.79	S	S	*	*			trans	134.2	122.2	159.6	0	0	0	0	0	116.1
594	E	41.3	Very low	47.4	Very low	194 Å²	194	149.9 Å²	149.9	91%	0.907	79%	0.793	S	S	*	*			trans	80	92.7	154.9	-74.7	172.2	155.6	0	0	120.3
595	A	37.1	Very low	48.5	Very low	91 Å²	91	150.8 Å²	150.8	75%	0.752	78%	0.784	S	S	*	*				57.9	92.6	116.3	0	0	0	0	0	119.3
596	D	46.4	Very low	49.7	Very low	167 Å²	167	144.1 Å²	144.1	89%	0.893	76%	0.764	S	S	*	*			trans	-162.1	84.1	132.7	-110.2	-13.7	0	0	0	108.4
597	Y	45.6	Very low	50.6	Low	206 Å²	206	143.5 Å²	143.5	81%	0.808	76%	0.756	S	S	*	*			trans	-107	107.9	173.9	-134.2	-94.5	0	0	0	107.6	D599	Y597-D599 VanDerWaalsContact C-N 3.3Å; Y597-D599 WeakPolarHBondContact CD1-OD1 3.32Å; Y597-D599 PolarHBondContact O-N 3Å; Y597-D599 VanDerWaalsContact O-N 3.12Å
598	S	50.6	Low	52.2	Low	120 Å²	120	141.8 Å²	141.8	84%	0.839	77%	0.765	S	S	*	*			trans	-82.7	76.5	174.6	-43.6	0	0	0	0	109.1
599	D	65.8	Low	53.8	Low	121 Å²	121	139.8 Å²	139.8	65%	0.647	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.1	169	-87	-19.9	0	0	0	109.5	Y597 L601	Y597-D599 VanDerWaalsContact C-N 3.3Å; Y597-D599 WeakPolarHBondContact CD1-OD1 3.32Å; Y597-D599 PolarHBondContact O-N 3Å; Y597-D599 VanDerWaalsContact O-N 3.12Å; D599-L601 PolarHBondContact O-N 3.16Å
600	W	69.5	Low	55.2	Low	202 Å²	202	134.4 Å²	134.4	77%	0.765	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66.2	120	176.8	-176.4	90.6	0	0	0	110	P602	W600-P602 HydrophobicContact CH2-CB 3.78Å; W600-P602 HydrophobicContact CZ3-CB 3.65Å; W600-P602 HydrophobicContact CZ3-CG 4.24Å
601	L	66.2	Low	57.2	Low	151 Å²	151	131.3 Å²	131.3	79%	0.791	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-99.8	126.4	172.5	-72.9	168.6	0	0	0	109.4	D599	D599-L601 PolarHBondContact O-N 3.16Å
602	P	71.4	Confident	58.9	Low	73 Å²	73	124 Å²	124	47%	0.474	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-62.1	146.6	175.9	23.7	-31.1	0	0	0	110.9	W600	W600-P602 HydrophobicContact CH2-CB 3.78Å; W600-P602 HydrophobicContact CZ3-CB 3.65Å; W600-P602 HydrophobicContact CZ3-CG 4.24Å
603	P	74.3	Confident	60.6	Low	78 Å²	78	123.2 Å²	123.2	51%	0.506	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-55.2	142.3	179.3	-24.8	34	0	0	0	112.9	D605 Q606	P603-D605 PolarHBondContact O-N 3.09Å; P603-Q606 PolarHBondContact O-N 3.17Å; P603-Q606 VanDerWaalsContact O-N 3.09Å
604	E	67	Low	62.3	Low	203 Å²	203	125.4 Å²	125.4	95%	0.949	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-15.4	-174.8	-64	-178.6	163.3	0	0	114.9
605	D	62.6	Low	64.1	Low	116 Å²	116	118.5 Å²	118.5	62%	0.62	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	10.4	-176	-83.3	-4.6	0	0	0	113.9	P603 K613	P603-D605 PolarHBondContact O-N 3.09Å; D605-K613 IonicContact OD2-NZ 3.43Å; D605-K613 PolarHBondContact OD2-NZ 3.28Å
606	Q	60.6	Low	66	Low	114 Å²	114	119.4 Å²	119.4	53%	0.533	64%	0.64	S	S	.	*			trans	-114.7	83.5	-178	-152.2	172.8	0.9	0	0	110.5	P603	P603-Q606 PolarHBondContact O-N 3.17Å; P603-Q606 VanDerWaalsContact O-N 3.09Å
607	T	58.8	Low	67.7	Low	92 Å²	92	115.5 Å²	115.5	56%	0.564	63%	0.63	S	S	*	*			trans	-64.3	135.5	167.2	41.7	0	0	0	0	108.7	D609	T607-D609 VanDerWaalsContact CB-OD1 3.24Å; T607-D609 WeakPolarHBondContact CB-OD1 3.45Å; T607-D609 PolarHBondContact O-N 3.02Å; T607-D609 PolarHBondContact OG1-OD1 3.39Å
608	G	65.3	Low	69.2	Low	95 Å²	95	111 Å²	111	98%	0.979	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	25.6	-178.4	0	0	0	0	0	115
609	D	70.2	Confident	70.4	Confident	94 Å²	94	108.8 Å²	108.8	50%	0.503	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	7.5	177.3	66.4	-26.7	0	0	0	112.8	T607 R611	T607-D609 VanDerWaalsContact CB-OD1 3.24Å; T607-D609 WeakPolarHBondContact CB-OD1 3.45Å; T607-D609 PolarHBondContact O-N 3.02Å; T607-D609 PolarHBondContact OG1-OD1 3.39Å; D609-R611 PolarHBondContact O-N 3.35Å; D609-R611 VanDerWaalsContact O-N 3.1Å
610	G	67.3	Low	70.1	Confident	60 Å²	60	113.3 Å²	113.3	62%	0.619	63%	0.625	S	S	*	*	S	Bend	trans	69.5	5	176.4	0	0	0	0	0	114.1	N615	G610-N615 PolarHBondContact O-ND2 3.04Å
611	R	73	Confident	70.1	Confident	145 Å²	145	108.9 Å²	108.9	55%	0.547	62%	0.618	S	S	.	*			trans	-86.8	127.7	170.7	-81.4	-170.2	154.2	89.5	7.4	109.5	D609	D609-R611 PolarHBondContact O-N 3.35Å; D609-R611 VanDerWaalsContact O-N 3.1Å
612	T	73.9	Confident	70.3	Confident	46 Å²	46	106.6 Å²	106.6	28%	0.282	61%	0.609	S	S	.	*			trans	-119.1	156.5	169.9	69.3	0	0	0	0	108.6	L614 N615 D616	T612-L614 PolarHBondContact O-N 3.44Å; T612-L614 WeakPolarHBondContact OG1-CB 3.29Å; T612-L614 PolarHBondContact OG1-N 3.1Å; T612-N615 WeakPolarHBondContact O-CA 3.5Å; T612-N615 WeakPolarHBondContact O-CB 3.33Å; T612-N615 PolarHBondContact O-N 2.91Å; T612-N615 PolarHBondContact OG1-N 2.91Å; T612-N615 PolarHBondContact OG1-OD1 2.9Å; T612-D616 PolarHBondContact O-N 3.33Å
613	K	71.1	Confident	70.3	Confident	148 Å²	148	108.5 Å²	108.5	64%	0.643	62%	0.617	S	S	*	*	H	α-helix	trans	-53.8	-21.4	169.9	-74.8	175.2	177.9	161.3	0	112.4	D605 A617	D605-K613 IonicContact OD2-NZ 3.43Å; D605-K613 PolarHBondContact OD2-NZ 3.28Å; K613-A617 WeakPolarHBondContact O-CB 3.46Å; K613-A617 PolarHBondContact O-N 2.91Å; K613-A617 VanDerWaalsContact O-N 3.15Å
614	L	70.9	Confident	70.1	Confident	117 Å²	117	110.3 Å²	110.3	61%	0.613	62%	0.623	S	S	*	*	H	α-helix	trans	-75.1	-36.1	174.7	-151.5	111.3	0	0	0	112.2	T612 A617 L618	T612-L614 PolarHBondContact O-N 3.44Å; T612-L614 WeakPolarHBondContact OG1-CB 3.29Å; T612-L614 PolarHBondContact OG1-N 3.1Å; L614-A617 PolarHBondContact O-N 3.34Å; L614-L618 HydrophobicContact CD2-CD1 3.74Å; L614-L618 HydrophobicContact CG-CD1 4.18Å; L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 WeakPolarHBondContact O-CG 3.36Å; L614-L618 PolarHBondContact O-N 3.12Å
615	N	77.8	Confident	70.2	Confident	49 Å²	49	104.5 Å²	104.5	26%	0.262	60%	0.603	S	S	.	*	H	α-helix	trans	-66.3	-40.4	173.1	-63.5	22.7	0	0	0	110.6	G610 T612 A617 L618 G619 Y620	G610-N615 PolarHBondContact O-ND2 3.04Å; T612-N615 WeakPolarHBondContact O-CA 3.5Å; T612-N615 WeakPolarHBondContact O-CB 3.33Å; T612-N615 PolarHBondContact O-N 2.91Å; T612-N615 PolarHBondContact OG1-N 2.91Å; T612-N615 PolarHBondContact OG1-OD1 2.9Å; N615-A617 VanDerWaalsContact C-N 3.32Å; N615-A617 PolarHBondContact O-N 3Å; N615-L618 PolarHBondContact O-N 3.08Å; N615-G619 PolarHBondContact O-N 3.32Å; N615-Y620 PolarHBondContact O-N 3.41Å
616	D	77.4	Confident	70.8	Confident	111 Å²	111	103.7 Å²	103.7	59%	0.594	60%	0.602	S	S	*	*	H	α-helix	trans	-65.3	-34.6	175.4	-70	-22.8	0	0	0	112.2	T612	T612-D616 PolarHBondContact O-N 3.33Å
617	A	81.9	Confident	71.5	Confident	84 Å²	84	103 Å²	103	69%	0.694	61%	0.607	S	S	*	*	H	α-helix	trans	-74.6	-27.6	176.5	0	0	0	0	0	113.5	K613 L614 N615	K613-A617 WeakPolarHBondContact O-CB 3.46Å; K613-A617 PolarHBondContact O-N 2.91Å; K613-A617 VanDerWaalsContact O-N 3.15Å; L614-A617 PolarHBondContact O-N 3.34Å; N615-A617 VanDerWaalsContact C-N 3.32Å; N615-A617 PolarHBondContact O-N 3Å
618	L	78.1	Confident	72.5	Confident	111 Å²	111	103.8 Å²	103.8	58%	0.581	61%	0.61	S	S	*	*	H	α-helix	trans	-101.9	-0.1	-176.9	-68.7	170.8	0	0	0	113.8	L614 N615 Y620	L614-L618 HydrophobicContact CD2-CD1 3.74Å; L614-L618 HydrophobicContact CG-CD1 4.18Å; L614-L618 WeakPolarHBondContact O-CB 3.41Å; L614-L618 WeakPolarHBondContact O-CG 3.36Å; L614-L618 PolarHBondContact O-N 3.12Å; N615-L618 PolarHBondContact O-N 3.08Å; L618-Y620 HydrophobicContact CB-CD2 3.62Å; L618-Y620 HydrophobicContact CB-CE2 3.77Å
619	G	74.6	Confident	73.1	Confident	74 Å²	74	104.6 Å²	104.6	76%	0.763	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.2	29.7	174	0	0	0	0	0	115	N615	N615-G619 PolarHBondContact O-N 3.32Å
620	Y	60.4	Low	73.3	Confident	216 Å²	216	105.5 Å²	105.5	85%	0.847	59%	0.586	S	S	*	*			trans	-95.8	0	179.7	-73.4	-75.3	0	0	0	114.1	N615 L618	N615-Y620 PolarHBondContact O-N 3.41Å; L618-Y620 HydrophobicContact CB-CD2 3.62Å; L618-Y620 HydrophobicContact CB-CE2 3.77Å

Retrieved 620 of 620 residues in 88 ms (Link to these results)

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