A0A096MSK6_PAPAN Loading...

procollagen-proline 3-dioxygenase

AlphaFold DB , UniProt , Accession A0A096MSK6, Species PAPAN (Papio anubis, Olive baboon), Gene P3H3, Length 735 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	44.7	Very low	45.7	Very low	206 Å²	206	143.9 Å²	143.9	100%	1.015	70%	0.697	S	S	*	*				0	-34.4	0	-72.2	-156.9	165.5	0	0	114.3	R3 L4	M1-R3 PolarHBondContact O-N 3.4Å; M1-L4 PolarHBondContact O-N 3.37Å
2	L	46.1	Very low	45.5	Very low	154 Å²	154	144 Å²	144	81%	0.806	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-17.9	178.1	-88.3	85.7	0	0	0	116.6
3	R	45.8	Very low	45	Very low	239 Å²	239	144.2 Å²	144.2	90%	0.902	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-13.4	177.8	-74.2	-170.3	178	-173.1	0	114.6	M1	M1-R3 PolarHBondContact O-N 3.4Å
4	L	45.3	Very low	44	Very low	136 Å²	136	142.1 Å²	142.1	71%	0.712	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-7.4	178.8	-71.8	163.6	0	0	0	113.3	M1 P7	M1-L4 PolarHBondContact O-N 3.37Å; L4-P7 WeakPolarHBondContact O-CD 3.15Å
5	L	45.1	Very low	43.1	Very low	98 Å²	98	139.6 Å²	139.6	51%	0.513	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.5	-21.9	179.6	-77.9	158.5	0	0	0	113.6	L8 L9	L5-L8 PolarHBondContact O-N 3.45Å; L5-L9 PolarHBondContact O-N 3.27Å
6	R	42.5	Very low	42.4	Very low	206 Å²	206	138.3 Å²	138.3	78%	0.777	70%	0.702	S	S	*	*	H	α-helix	trans	-60.2	-42.2	176	-93.1	-176.8	169.7	-175.5	-3.7	115	L8	R6-L8 VanDerWaalsContact C-N 3.3Å; R6-L8 PolarHBondContact O-N 3.01Å
7	P	50	Low	42.1	Very low	71 Å²	71	137.2 Å²	137.2	46%	0.461	71%	0.707	S	S	.	*	H	α-helix	trans	-72.7	-24.1	177.5	27.7	-32.8	0	0	0	112.6	L4 L10 L11	L4-P7 WeakPolarHBondContact O-CD 3.15Å; P7-L10 PolarHBondContact O-N 3.36Å; P7-L11 PolarHBondContact O-N 2.59Å
8	L	45.4	Very low	41.8	Very low	110 Å²	110	133.4 Å²	133.4	58%	0.576	71%	0.708	S	S	*	*	H	α-helix	trans	-72.6	-35.1	177.5	-115.1	111.3	0	0	0	112.7	L5 R6 L11	L5-L8 PolarHBondContact O-N 3.45Å; R6-L8 VanDerWaalsContact C-N 3.3Å; R6-L8 PolarHBondContact O-N 3.01Å; L8-L11 PolarHBondContact O-N 3.48Å
9	L	48.2	Very low	41.2	Very low	120 Å²	120	131.1 Å²	131.1	63%	0.628	70%	0.703	S	S	*	*	H	α-helix	trans	-71.2	-28.5	174.2	-103.5	116.6	0	0	0	113	L5	L5-L9 PolarHBondContact O-N 3.27Å
10	L	46.4	Very low	40.8	Very low	126 Å²	126	130.8 Å²	130.8	66%	0.66	71%	0.708	S	S	*	*	H	α-helix	trans	-73.2	-27.2	173.9	-98.9	114.2	0	0	0	113.1	P7 L12 L13	P7-L10 PolarHBondContact O-N 3.36Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L13 PolarHBondContact O-N 3.15Å
11	L	43.1	Very low	40.8	Very low	117 Å²	117	129.3 Å²	129.3	61%	0.613	70%	0.697	S	S	*	*	H	α-helix	trans	-72.5	-22.7	175.1	-88.4	150.7	0	0	0	113.2	P7 L8 L13 L14	P7-L11 PolarHBondContact O-N 2.59Å; L8-L11 PolarHBondContact O-N 3.48Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L14 HydrophobicContact CD2-CD1 4.22Å
12	L	43.3	Very low	40.2	Very low	145 Å²	145	123.1 Å²	123.1	76%	0.759	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-8.2	176.2	-71.6	164.9	0	0	0	113.5	L10	L10-L12 VanDerWaalsContact C-N 3.31Å
13	L	39.2	Very low	39.5	Very low	147 Å²	147	122.3 Å²	122.3	77%	0.77	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-0.2	175.4	-70.5	169.8	0	0	0	113	L10 L11	L10-L13 PolarHBondContact O-N 3.15Å; L11-L13 VanDerWaalsContact C-N 3.34Å
14	L	31.6	Very low	39.4	Very low	115 Å²	115	114 Å²	114	60%	0.602	67%	0.665	S	S	*	*	S	Bend	trans	-79.2	133.8	168.8	-70.9	166.3	0	0	0	108.4	L11	L11-L14 HydrophobicContact CD2-CD1 4.22Å
15	P	30.7	Very low	39.5	Very low	104 Å²	104	108.8 Å²	108.8	68%	0.675	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-54.8	146.1	170.5	25.2	-32.8	0	0	0	108.7
16	P	31.5	Very low	39.6	Very low	118 Å²	118	107.7 Å²	107.7	77%	0.766	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-54.6	131.4	-178.2	22.9	-32.3	0	0	0	108.9	G18	P16-G18 PolarHBondContact O-N 3.32Å
17	P	36.8	Very low	39.9	Very low	120 Å²	120	106.2 Å²	106.2	78%	0.779	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-57.3	130.3	169.4	24.2	-30.4	0	0	0	107.1	S19	P17-S19 PolarHBondContact O-N 3.23Å
18	G	36.6	Very low	40.2	Very low	70 Å²	70	105.1 Å²	105.1	72%	0.722	64%	0.635	S	S	*	*			trans	-45.7	143.9	172.3	0	0	0	0	0	110	P16	P16-G18 PolarHBondContact O-N 3.32Å
19	S	31.3	Very low	40.5	Very low	88 Å²	88	103.6 Å²	103.6	62%	0.615	63%	0.633	S	S	*	*			trans	-43.4	127.3	-172.7	-46	0	0	0	0	111.1	P17 E21	P17-S19 PolarHBondContact O-N 3.23Å; S19-E21 PolarHBondContact O-N 3.28Å
20	P	31.9	Very low	40.5	Very low	125 Å²	125	104.3 Å²	104.3	81%	0.812	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-58.2	127.5	179.8	22.2	-31.1	0	0	0	109.5
21	E	42.3	Very low	41	Very low	101 Å²	101	102.1 Å²	102.1	47%	0.472	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-63.9	143	178.3	-66.2	-158.2	141.3	0	0	110.9	S19 R61	S19-E21 PolarHBondContact O-N 3.28Å; E21-R61 IonicContact OE1-CZ 2.89Å; E21-R61 IonicContact OE1-NH2 3.95Å; E21-R61 PolarHBondContact OE1-NH2 3.08Å; E21-R61 IonicContact OE2-CZ 2.67Å; E21-R61 IonicContact OE2-NH1 3.72Å; E21-R61 IonicContact OE2-NH2 3.22Å; E21-R61 PolarHBondContact OE2-NH2 3.24Å
22	P	31.6	Very low	42.1	Very low	75 Å²	75	98.6 Å²	98.6	49%	0.487	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-63.4	146.3	176.7	25.5	-32.6	0	0	0	111.1
23	P	32.3	Very low	43.4	Very low	137 Å²	137	96.2 Å²	96.2	89%	0.89	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	137.7	-179	23.3	-31.7	0	0	0	111.7
24	G	42.4	Very low	45.2	Very low	65 Å²	65	90.4 Å²	90.4	67%	0.67	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.9	10.7	173.9	0	0	0	0	0	116.4	K169	G24-K169 PolarHBondContact O-NZ 3.19Å
25	L	47.5	Very low	47.6	Very low	26 Å²	26	90.2 Å²	90.2	14%	0.136	60%	0.601	C	S	.	*	S	Bend	trans	-101.6	142.8	157.8	-72	169.1	0	0	0	108.7	Q27 V57 Y164 K169 L172	L25-Q27 PolarHBondContact O-N 2.86Å; L25-Q27 VanDerWaalsContact O-N 3.1Å; L25-V57 HydrophobicContact CD2-CG1 4.1Å; L25-Y164 HydrophobicContact CD1-CE1 4.3Å; L25-Y164 HydrophobicContact CD2-CE1 4.18Å; L25-K169 HydrophobicContact CD2-CD 4.08Å; L25-K169 HydrophobicContact CG-CD 4.34Å; L25-L172 HydrophobicContact CD1-CD1 3.5Å
26	A	46.5	Very low	50.1	Low	76 Å²	76	86 Å²	86	63%	0.628	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-54.8	120.6	169.5	0	0	0	0	0	108.3	L28	A26-L28 PolarHBondContact O-N 3.49Å
27	Q	48.7	Very low	52.6	Low	174 Å²	174	80.3 Å²	80.3	81%	0.813	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-65	123.3	174.9	-76	-178.6	-9.1	0	0	107.9	L25 S29	L25-Q27 PolarHBondContact O-N 2.86Å; L25-Q27 VanDerWaalsContact O-N 3.1Å; Q27-S29 PolarHBondContact O-N 2.87Å; Q27-S29 VanDerWaalsContact O-N 3.15Å
28	L	56.6	Low	54.7	Low	49 Å²	49	77.2 Å²	77.2	26%	0.257	52%	0.515	S	S	.	.			trans	-63.7	112.3	169.2	-73.8	171.7	0	0	0	107.3	A26 P30 R61 E62	A26-L28 PolarHBondContact O-N 3.49Å; L28-P30 WeakPolarHBondContact O-CD 3.33Å; L28-R61 HydrophobicContact CD1-CB 4.27Å; L28-E62 HydrophobicContact CD2-CB 4.44Å; L28-E62 WeakPolarHBondContact CD2-OE2 3.37Å
29	S	52.2	Low	57	Low	78 Å²	78	78.8 Å²	78.8	55%	0.545	51%	0.506	S	S	.	.			trans	-54.9	110.8	-178.7	-64.1	0	0	0	0	110.3	Q27 G31 A32 R65	Q27-S29 PolarHBondContact O-N 2.87Å; Q27-S29 VanDerWaalsContact O-N 3.15Å; S29-G31 PolarHBondContact O-N 3.23Å; S29-A32 PolarHBondContact O-N 2.93Å; S29-R65 PolarHBondContact O-NH1 3.47Å
30	P	48.2	Very low	59.8	Low	134 Å²	134	75 Å²	75	87%	0.87	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	109.9	177.2	-13.9	29	0	0	0	107.6	L28	L28-P30 WeakPolarHBondContact O-CD 3.33Å
31	G	57	Low	62.6	Low	80 Å²	80	70.1 Å²	70.1	83%	0.825	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.4	0.7	179.3	0	0	0	0	0	116.3	S29	S29-G31 PolarHBondContact O-N 3.23Å
32	A	65.7	Low	64.8	Low	43 Å²	43	66.9 Å²	66.9	36%	0.355	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-66.3	140.3	166.1	0	0	0	0	0	110.2	S29	S29-A32 PolarHBondContact O-N 2.93Å
33	P	70.4	Confident	67.5	Low	95 Å²	95	66.4 Å²	66.4	62%	0.617	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-61.2	140.4	176.4	25.2	-32.8	0	0	0	110.3
34	P	77.8	Confident	70.4	Confident	26 Å²	26	59.9 Å²	59.9	17%	0.169	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-62	142.6	178.9	26.5	-33.6	0	0	0	110.6	A69 L133 L141	P34-A69 HydrophobicContact CB-CB 4.08Å; P34-A69 HydrophobicContact CG-CB 4.39Å; P34-L133 HydrophobicContact CG-CD2 3.47Å; P34-L133 VanDerWaalsContact CG-CD2 3.47Å; P34-L141 HydrophobicContact CB-CD1 4.28Å; P34-L141 HydrophobicContact CG-CD1 4.01Å
35	Q	80.8	Confident	72.8	Confident	110 Å²	110	59 Å²	59	51%	0.514	37%	0.366	S	S	.	.			trans	-108	166.3	177.5	-63.4	176.7	57.1	0	0	110.4	P37 L40 S66 L141	Q35-P37 WeakPolarHBondContact O-CD 3.36Å; Q35-L40 HydrophobicContact CB-CD1 3.84Å; Q35-L40 HydrophobicContact CB-CD2 4.44Å; Q35-L40 HydrophobicContact CB-CG 4.25Å; Q35-S66 PolarHBondContact N-OG 2.89Å; Q35-S66 VanDerWaalsContact N-OG 3.12Å; Q35-S66 WeakPolarHBondContact O-CB 3.27Å; Q35-S66 PolarHBondContact O-OG 3.29Å; Q35-L141 WeakPolarHBondContact O-CD2 3.21Å
36	A	83.8	Confident	74.8	Confident	15 Å²	15	64.4 Å²	64.4	12%	0.124	38%	0.384	C	S	.	.			trans	-58.7	109.3	-174.5	0	0	0	0	0	110.9	D38 L39 L40 R140 L141	A36-D38 VanDerWaalsContact C-OD1 3.31Å; A36-D38 WeakPolarHBondContact CB-OD1 3.34Å; A36-D38 PolarHBondContact O-N 2.86Å; A36-L39 HydrophobicContact CB-CB 4.11Å; A36-L39 HydrophobicContact CB-CD1 3.89Å; A36-L39 HydrophobicContact CB-CG 3.92Å; A36-L39 PolarHBondContact O-N 3.45Å; A36-L40 WeakPolarHBondContact O-CG 3.29Å; A36-L40 PolarHBondContact O-N 2.95Å; A36-R140 WeakPolarHBondContact CB-O 3.26Å; A36-L141 VanDerWaalsContact CA-CD2 3.45Å; A36-L141 HydrophobicContact CB-CD2 4.31Å; A36-L141 VanDerWaalsContact N-CD2 3.26Å
37	P	84.3	Confident	77	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-62.2	-29.5	-172.7	-23.1	34.4	0	0	0	112.6	Q35 Y41 Q67 V143	Q35-P37 WeakPolarHBondContact O-CD 3.36Å; P37-Y41 WeakPolarHBondContact O-CB 3.48Å; P37-Y41 PolarHBondContact O-N 3.27Å; P37-Q67 HydrophobicContact CB-CB 4.35Å; P37-Q67 HydrophobicContact CG-CB 4.32Å; P37-V143 HydrophobicContact CB-CG2 4.04Å; P37-V143 HydrophobicContact CG-CG2 3.98Å
38	D	81.5	Confident	79	Confident	54 Å²	54	54.9 Å²	54.9	29%	0.289	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-48	174.3	61.3	-34	0	0	0	113.4	A36 Y41 A42 L147	A36-D38 VanDerWaalsContact C-OD1 3.31Å; A36-D38 WeakPolarHBondContact CB-OD1 3.34Å; A36-D38 PolarHBondContact O-N 2.86Å; D38-Y41 PolarHBondContact O-N 2.9Å; D38-A42 VanDerWaalsContact O-CB 3.3Å; D38-A42 WeakPolarHBondContact O-CB 3.37Å; D38-A42 PolarHBondContact O-N 2.99Å; D38-L147 HydrophobicContact CB-CD2 3.39Å
39	L	84.8	Confident	80.6	Confident	103 Å²	103	56.7 Å²	56.7	54%	0.539	35%	0.349	S	S	.	.	H	α-helix	trans	-64.8	-46.2	175.9	-63	-178	0	0	0	110.9	A36 Y41 A42 D43	A36-L39 HydrophobicContact CB-CB 4.11Å; A36-L39 HydrophobicContact CB-CD1 3.89Å; A36-L39 HydrophobicContact CB-CG 3.92Å; A36-L39 PolarHBondContact O-N 3.45Å; L39-Y41 VanDerWaalsContact C-N 3.34Å; L39-Y41 PolarHBondContact O-N 3.39Å; L39-A42 PolarHBondContact O-N 3.27Å; L39-D43 WeakPolarHBondContact O-CB 3.43Å; L39-D43 PolarHBondContact O-N 3.32Å
40	L	89.4	Confident	82.6	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.052	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-43.2	178	-69.8	166.3	0	0	0	112.3	Q35 A36 G44 L59 E62 A63	Q35-L40 HydrophobicContact CB-CD1 3.84Å; Q35-L40 HydrophobicContact CB-CD2 4.44Å; Q35-L40 HydrophobicContact CB-CG 4.25Å; A36-L40 WeakPolarHBondContact O-CG 3.29Å; A36-L40 PolarHBondContact O-N 2.95Å; L40-G44 PolarHBondContact O-N 2.98Å; L40-L59 HydrophobicContact CD2-CD2 4.02Å; L40-E62 HydrophobicContact CD1-CB 4.21Å; L40-E62 HydrophobicContact CD1-CG 3.62Å; L40-E62 HydrophobicContact CD2-CB 4.22Å; L40-E62 HydrophobicContact CD2-CG 3.79Å; L40-E62 HydrophobicContact CG-CG 4.33Å; L40-A63 HydrophobicContact CB-CB 3.73Å; L40-A63 HydrophobicContact CD1-CB 4.43Å
41	Y	90.2	Very high	84.6	Confident	22 Å²	22	52 Å²	52	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-47.8	176.7	-177.9	-105.9	0	0	0	110.7	P37 D38 L39 D43 G44 L45 L60 L147 F151 E155 P156 Y159	P37-Y41 WeakPolarHBondContact O-CB 3.48Å; P37-Y41 PolarHBondContact O-N 3.27Å; D38-Y41 PolarHBondContact O-N 2.9Å; L39-Y41 VanDerWaalsContact C-N 3.34Å; L39-Y41 PolarHBondContact O-N 3.39Å; Y41-D43 PolarHBondContact O-N 3.11Å; Y41-G44 PolarHBondContact O-N 2.75Å; Y41-G44 VanDerWaalsContact O-N 3.17Å; Y41-L45 HydrophobicContact CD1-CD1 4.1Å; Y41-L45 HydrophobicContact CD1-CG 4.41Å; Y41-L45 HydrophobicContact CE1-CD1 3.53Å; Y41-L45 HydrophobicContact CE1-CG 4.13Å; Y41-L45 HydrophobicContact CE2-CD2 4.33Å; Y41-L45 HydrophobicContact CE2-CG 4.46Å; Y41-L45 WeakPolarHBondContact O-CG 3.46Å; Y41-L45 PolarHBondContact O-N 3.42Å; Y41-L60 HydrophobicContact CD2-CD2 3.6Å; Y41-L60 HydrophobicContact CE2-CD2 3.91Å; Y41-L147 HydrophobicContact CD1-CD1 3.33Å; Y41-L147 HydrophobicContact CE1-CD1 3.62Å; Y41-L147 HydrophobicContact CG-CD1 3.88Å; Y41-F151 HydrophobicContact CD2-CE2 4.29Å; Y41-F151 HydrophobicContact CD2-CZ 4.24Å; Y41-F151 HydrophobicContact CG-CE2 4.3Å; Y41-F151 HydrophobicContact CG-CZ 4.5Å; Y41-E155 WeakPolarHBondContact OH-CG 3.38Å; Y41-P156 HydrophobicContact CD2-CG 4.16Å; Y41-P156 HydrophobicContact CE2-CB 4.32Å; Y41-P156 HydrophobicContact CE2-CG 3.83Å; Y41-Y159 WeakPolarHBondContact OH-CE2 3.47Å
42	A	88.1	Confident	86.3	Confident	32 Å²	32	50 Å²	50	26%	0.264	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-42.8	178.3	0	0	0	0	0	112.7	D38 L39 L45 R46	D38-A42 VanDerWaalsContact O-CB 3.3Å; D38-A42 WeakPolarHBondContact O-CB 3.37Å; D38-A42 PolarHBondContact O-N 2.99Å; L39-A42 PolarHBondContact O-N 3.27Å; A42-L45 PolarHBondContact O-N 3.26Å; A42-R46 WeakPolarHBondContact O-CG 3.41Å; A42-R46 PolarHBondContact O-N 2.95Å
43	D	89.9	Confident	87.6	Confident	66 Å²	66	50.9 Å²	50.9	35%	0.353	30%	0.3	S	S	.	.	H	α-helix	trans	-64.8	-39.6	173.5	-81	-39.6	0	0	0	111.8	L39 Y41 L45 R46 A47 L59	L39-D43 WeakPolarHBondContact O-CB 3.43Å; L39-D43 PolarHBondContact O-N 3.32Å; Y41-D43 PolarHBondContact O-N 3.11Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 2.94Å; D43-R46 PolarHBondContact O-N 3.41Å; D43-R46 IonicContact OD1-CZ 3.7Å; D43-R46 IonicContact OD1-NE 3.46Å; D43-R46 PolarHBondContact OD1-NE 2.99Å; D43-R46 IonicContact OD1-NH2 2.61Å; D43-R46 PolarHBondContact OD1-NH2 3.31Å; D43-R46 IonicContact OD2-NH2 3.75Å; D43-A47 WeakPolarHBondContact O-CB 3.22Å; D43-A47 PolarHBondContact O-N 3.4Å; D43-L59 HydrophobicContact CB-CD1 3.96Å; D43-L59 HydrophobicContact CB-CD2 4.2Å
44	G	93.2	Very high	88.7	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-43.4	174.7	0	0	0	0	0	112.1	L40 Y41 A47 Y48	L40-G44 PolarHBondContact O-N 2.98Å; Y41-G44 PolarHBondContact O-N 2.75Å; Y41-G44 VanDerWaalsContact O-N 3.17Å; G44-A47 PolarHBondContact O-N 3.36Å; G44-Y48 VanDerWaalsContact O-CB 3.31Å; G44-Y48 WeakPolarHBondContact O-CB 3.38Å; G44-Y48 PolarHBondContact O-N 3.21Å
45	L	91.3	Very high	89.5	Confident	46 Å²	46	51 Å²	51	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-67.3	-39	175.1	-65	-170	0	0	0	112.6	Y41 A42 D43 Y48 A49 L60 Y159	Y41-L45 HydrophobicContact CD1-CD1 4.1Å; Y41-L45 HydrophobicContact CD1-CG 4.41Å; Y41-L45 HydrophobicContact CE1-CD1 3.53Å; Y41-L45 HydrophobicContact CE1-CG 4.13Å; Y41-L45 HydrophobicContact CE2-CD2 4.33Å; Y41-L45 HydrophobicContact CE2-CG 4.46Å; Y41-L45 WeakPolarHBondContact O-CG 3.46Å; Y41-L45 PolarHBondContact O-N 3.42Å; A42-L45 PolarHBondContact O-N 3.26Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 2.94Å; L45-Y48 WeakPolarHBondContact O-CB 3.46Å; L45-Y48 PolarHBondContact O-N 3.04Å; L45-A49 WeakPolarHBondContact O-CB 3.4Å; L45-A49 PolarHBondContact O-N 2.98Å; L45-L60 HydrophobicContact CD2-CD2 4.45Å; L45-Y159 HydrophobicContact CD2-CD1 3.72Å; L45-Y159 HydrophobicContact CD2-CD2 3.54Å; L45-Y159 HydrophobicContact CD2-CE1 3.69Å; L45-Y159 HydrophobicContact CD2-CE2 3.5Å; L45-Y159 HydrophobicContact CD2-CG 3.65Å
46	R	91.1	Very high	90	Very high	140 Å²	140	45.8 Å²	45.8	53%	0.528	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-46.7	172.9	-77.4	-174.2	-77.7	-87.6	9.4	111.6	A42 D43 Y48 A49 A50	A42-R46 WeakPolarHBondContact O-CG 3.41Å; A42-R46 PolarHBondContact O-N 2.95Å; D43-R46 PolarHBondContact O-N 3.41Å; D43-R46 IonicContact OD1-CZ 3.7Å; D43-R46 IonicContact OD1-NE 3.46Å; D43-R46 PolarHBondContact OD1-NE 2.99Å; D43-R46 IonicContact OD1-NH2 2.61Å; D43-R46 PolarHBondContact OD1-NH2 3.31Å; D43-R46 IonicContact OD2-NH2 3.75Å; R46-Y48 VanDerWaalsContact C-N 3.32Å; R46-Y48 PolarHBondContact O-N 3.3Å; R46-A49 PolarHBondContact O-N 3.49Å; R46-A50 WeakPolarHBondContact O-CB 3.24Å; R46-A50 PolarHBondContact O-N 3.49Å
47	A	91.2	Very high	90.5	Very high	13 Å²	13	45.2 Å²	45.2	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-40.5	176.8	0	0	0	0	0	111.7	D43 G44 A50 G51 A52 P55 A56 L59	D43-A47 WeakPolarHBondContact O-CB 3.22Å; D43-A47 PolarHBondContact O-N 3.4Å; G44-A47 PolarHBondContact O-N 3.36Å; A47-A50 PolarHBondContact O-N 3.43Å; A47-G51 PolarHBondContact O-N 3.05Å; A47-A52 HydrophobicContact CB-CB 4.35Å; A47-A52 WeakPolarHBondContact O-CB 3.31Å; A47-A52 PolarHBondContact O-N 3.33Å; A47-P55 HydrophobicContact CB-CB 4.19Å; A47-A56 HydrophobicContact CB-CB 3.97Å; A47-L59 HydrophobicContact CB-CD1 4.18Å
48	Y	92.6	Very high	90.9	Very high	37 Å²	37	47.2 Å²	47.2	15%	0.145	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-47.7	175.2	179.5	-87.1	0	0	0	111.6	G44 L45 R46 A50 G51 W53 Y159 R162 A163	G44-Y48 VanDerWaalsContact O-CB 3.31Å; G44-Y48 WeakPolarHBondContact O-CB 3.38Å; G44-Y48 PolarHBondContact O-N 3.21Å; L45-Y48 WeakPolarHBondContact O-CB 3.46Å; L45-Y48 PolarHBondContact O-N 3.04Å; R46-Y48 VanDerWaalsContact C-N 3.32Å; R46-Y48 PolarHBondContact O-N 3.3Å; Y48-A50 VanDerWaalsContact C-N 3.27Å; Y48-A50 PolarHBondContact O-N 3.39Å; Y48-G51 PolarHBondContact O-N 3.25Å; Y48-W53 HydrophobicContact CD2-CE3 4.18Å; Y48-W53 AromaticContact CD2-CZ3 3.78Å; Y48-W53 HydrophobicContact CD2-CZ3 3.78Å; Y48-W53 HydrophobicContact CE2-CE3 4.31Å; Y48-W53 AromaticContact CE2-CZ3 3.65Å; Y48-W53 HydrophobicContact CE2-CZ3 3.65Å; Y48-W53 HydrophobicContact CG-CZ3 4.35Å; Y48-Y159 AromaticContact CD1-CD1 3.86Å; Y48-Y159 HydrophobicContact CD1-CD1 3.86Å; Y48-Y159 HydrophobicContact CD1-CE1 4.38Å; Y48-Y159 HydrophobicContact CD2-CD1 4.25Å; Y48-Y159 AromaticContact CE1-CD1 3.78Å; Y48-Y159 HydrophobicContact CE1-CD1 3.78Å; Y48-Y159 HydrophobicContact CE1-CE1 4.27Å; Y48-Y159 HydrophobicContact CE2-CD1 4.18Å; Y48-Y159 WeakPolarHBondContact CE2-O 3.28Å; Y48-Y159 HydrophobicContact CG-CD1 4.1Å; Y48-Y159 AromaticContact CZ-CD1 3.94Å; Y48-R162 HydrophobicContact CE2-CB 4.13Å; Y48-R162 HydrophobicContact CE2-CG 4.23Å; Y48-R162 WeakPolarHBondContact OH-CD 3.47Å; Y48-R162 WeakPolarHBondContact OH-CG 3.46Å; Y48-R162 PolarHBondContact OH-NE 3.3Å; Y48-A163 HydrophobicContact CD2-CB 4.39Å
49	A	90.1	Very high	91.4	Very high	86 Å²	86	46.8 Å²	46.8	71%	0.711	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-33.2	177.5	0	0	0	0	0	112.5	L45 R46 G51	L45-A49 WeakPolarHBondContact O-CB 3.4Å; L45-A49 PolarHBondContact O-N 2.98Å; R46-A49 PolarHBondContact O-N 3.49Å; A49-G51 PolarHBondContact O-N 2.9Å
50	A	93.1	Very high	91.8	Very high	82 Å²	82	41.9 Å²	41.9	68%	0.678	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-0.8	174.9	0	0	0	0	0	114.2	R46 A47 Y48 A52	R46-A50 WeakPolarHBondContact O-CB 3.24Å; R46-A50 PolarHBondContact O-N 3.49Å; A47-A50 PolarHBondContact O-N 3.43Å; Y48-A50 VanDerWaalsContact C-N 3.27Å; Y48-A50 PolarHBondContact O-N 3.39Å; A50-A52 PolarHBondContact O-N 2.92Å
51	G	90.3	Very high	92	Very high	33 Å²	33	42.8 Å²	42.8	34%	0.34	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	11.5	-175.6	0	0	0	0	0	114.1	A47 Y48 A49 W53	A47-G51 PolarHBondContact O-N 3.05Å; Y48-G51 PolarHBondContact O-N 3.25Å; A49-G51 PolarHBondContact O-N 2.9Å; G51-W53 VanDerWaalsContact C-N 3.3Å; G51-W53 VanDerWaalsContact O-CD1 3.29Å; G51-W53 PolarHBondContact O-N 3.06Å; G51-W53 PolarHBondContact O-NE1 3.27Å
52	A	93.9	Very high	92	Very high	36 Å²	36	42.6 Å²	42.6	30%	0.298	27%	0.267	S	S	.	.			trans	-82.8	73.3	177.1	0	0	0	0	0	110.1	A47 A50 A54 P55 A56	A47-A52 HydrophobicContact CB-CB 4.35Å; A47-A52 WeakPolarHBondContact O-CB 3.31Å; A47-A52 PolarHBondContact O-N 3.33Å; A50-A52 PolarHBondContact O-N 2.92Å; A52-A54 PolarHBondContact O-N 2.93Å; A52-P55 HydrophobicContact CB-CB 4.38Å; A52-P55 HydrophobicContact CB-CG 4.09Å; A52-P55 VanDerWaalsContact O-CD 3.31Å; A52-P55 WeakPolarHBondContact O-CD 3.44Å; A52-A56 WeakPolarHBondContact O-CB 3.18Å; A52-A56 PolarHBondContact O-N 3.44Å
53	W	91.9	Very high	92.1	Very high	62 Å²	62	41 Å²	41	24%	0.235	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-43.9	-170	-49.9	115.5	0	0	0	114.4	Y48 G51 A56 V57 A163 Q166 L167	Y48-W53 HydrophobicContact CD2-CE3 4.18Å; Y48-W53 AromaticContact CD2-CZ3 3.78Å; Y48-W53 HydrophobicContact CD2-CZ3 3.78Å; Y48-W53 HydrophobicContact CE2-CE3 4.31Å; Y48-W53 AromaticContact CE2-CZ3 3.65Å; Y48-W53 HydrophobicContact CE2-CZ3 3.65Å; Y48-W53 HydrophobicContact CG-CZ3 4.35Å; G51-W53 VanDerWaalsContact C-N 3.3Å; G51-W53 VanDerWaalsContact O-CD1 3.29Å; G51-W53 PolarHBondContact O-N 3.06Å; G51-W53 PolarHBondContact O-NE1 3.27Å; W53-A56 PolarHBondContact O-N 2.56Å; W53-V57 WeakPolarHBondContact O-CG2 3.38Å; W53-V57 PolarHBondContact O-N 3Å; W53-A163 HydrophobicContact CE3-CB 4.07Å; W53-Q166 HydrophobicContact CB-CB 4.44Å; W53-Q166 HydrophobicContact CD2-CB 3.61Å; W53-Q166 HydrophobicContact CD2-CG 3.78Å; W53-Q166 HydrophobicContact CE3-CB 4.29Å; W53-Q166 HydrophobicContact CE3-CG 4.14Å; W53-Q166 HydrophobicContact CG-CB 3.64Å; W53-Q166 HydrophobicContact CG-CG 4.35Å; W53-Q166 HydrophobicContact CH2-CG 4.05Å; W53-Q166 HydrophobicContact CZ2-CB 4.31Å; W53-Q166 HydrophobicContact CZ2-CG 3.66Å; W53-Q166 HydrophobicContact CZ3-CG 4.27Å; W53-L167 HydrophobicContact CB-CD1 4.29Å; W53-L167 HydrophobicContact CB-CD2 3.91Å; W53-L167 HydrophobicContact CB-CG 3.86Å
54	A	93.9	Very high	92.2	Very high	57 Å²	57	38.9 Å²	38.9	47%	0.471	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-47.2	-179	0	0	0	0	0	112.6	A52 A56 V57 A58 L167	A52-A54 PolarHBondContact O-N 2.93Å; A54-A56 PolarHBondContact O-N 3.17Å; A54-V57 PolarHBondContact O-N 2.91Å; A54-A58 PolarHBondContact O-N 2.98Å; A54-A58 VanDerWaalsContact O-N 3.07Å; A54-L167 HydrophobicContact CB-CD1 4.49Å; A54-L167 HydrophobicContact CB-CD2 4.28Å
55	P	93.5	Very high	92	Very high	67 Å²	67	41.9 Å²	41.9	44%	0.435	25%	0.254	S	S	.	.	H	α-helix	trans	-57.4	-43.2	169.4	-29	36.4	0	0	0	113.8	A47 A52 V57 A58 L59	A47-P55 HydrophobicContact CB-CB 4.19Å; A52-P55 HydrophobicContact CB-CB 4.38Å; A52-P55 HydrophobicContact CB-CG 4.09Å; A52-P55 VanDerWaalsContact O-CD 3.31Å; A52-P55 WeakPolarHBondContact O-CD 3.44Å; P55-V57 PolarHBondContact O-N 2.98Å; P55-A58 PolarHBondContact O-N 3.25Å; P55-L59 WeakPolarHBondContact O-CB 3.38Å; P55-L59 WeakPolarHBondContact O-CD1 3.49Å; P55-L59 WeakPolarHBondContact O-CG 2.88Å; P55-L59 PolarHBondContact O-N 2.9Å
56	A	92.6	Very high	91.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-46.7	178.1	0	0	0	0	0	111.9	A47 A52 W53 A54 A58 L59 L60	A47-A56 HydrophobicContact CB-CB 3.97Å; A52-A56 WeakPolarHBondContact O-CB 3.18Å; A52-A56 PolarHBondContact O-N 3.44Å; W53-A56 PolarHBondContact O-N 2.56Å; A54-A56 PolarHBondContact O-N 3.17Å; A56-A58 PolarHBondContact O-N 3.29Å; A56-L59 PolarHBondContact O-N 2.86Å; A56-L60 WeakPolarHBondContact O-CB 3.35Å; A56-L60 VanDerWaalsContact O-CG 3.28Å; A56-L60 WeakPolarHBondContact O-CG 3.47Å; A56-L60 PolarHBondContact O-N 3.28Å
57	V	94.3	Very high	91.4	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-44.3	175.7	168.6	0	0	0	0	111.5	L25 W53 A54 P55 R61 L160 A163 Y164 L167	L25-V57 HydrophobicContact CD2-CG1 4.1Å; W53-V57 WeakPolarHBondContact O-CG2 3.38Å; W53-V57 PolarHBondContact O-N 3Å; A54-V57 PolarHBondContact O-N 2.91Å; P55-V57 PolarHBondContact O-N 2.98Å; V57-R61 HydrophobicContact CG1-CG 4.34Å; V57-R61 WeakPolarHBondContact O-CB 3.31Å; V57-R61 WeakPolarHBondContact O-CD 3.41Å; V57-R61 WeakPolarHBondContact O-CG 3.45Å; V57-R61 PolarHBondContact O-N 3.03Å; V57-R61 VanDerWaalsContact O-N 3.09Å; V57-L160 HydrophobicContact CB-CD2 4.31Å; V57-L160 HydrophobicContact CG1-CD2 4.25Å; V57-L160 HydrophobicContact CG2-CD2 4.15Å; V57-A163 HydrophobicContact CG2-CB 3.56Å; V57-Y164 HydrophobicContact CG1-CD1 4.37Å; V57-Y164 HydrophobicContact CG1-CE1 3.55Å; V57-Y164 HydrophobicContact CG2-CD1 4.15Å; V57-Y164 HydrophobicContact CG2-CE1 4.1Å; V57-L167 HydrophobicContact CG2-CD1 3.95Å
58	A	91.7	Very high	91.1	Very high	42 Å²	42	37.5 Å²	37.5	35%	0.347	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-47.1	-179.7	0	0	0	0	0	111.6	A54 P55 A56 E62	A54-A58 PolarHBondContact O-N 2.98Å; A54-A58 VanDerWaalsContact O-N 3.07Å; P55-A58 PolarHBondContact O-N 3.25Å; A56-A58 PolarHBondContact O-N 3.29Å; A58-E62 VanDerWaalsContact O-CB 3.29Å; A58-E62 WeakPolarHBondContact O-CB 3.35Å; A58-E62 PolarHBondContact O-N 3.09Å
59	L	93	Very high	90.7	Very high	45 Å²	45	37.1 Å²	37.1	24%	0.236	25%	0.25	C	S	.	.	H	α-helix	trans	-67.2	-45.2	-178.5	-71.1	162.4	0	0	0	112.5	L40 D43 A47 P55 A56 E62 A63	L40-L59 HydrophobicContact CD2-CD2 4.02Å; D43-L59 HydrophobicContact CB-CD1 3.96Å; D43-L59 HydrophobicContact CB-CD2 4.2Å; A47-L59 HydrophobicContact CB-CD1 4.18Å; P55-L59 WeakPolarHBondContact O-CB 3.38Å; P55-L59 WeakPolarHBondContact O-CD1 3.49Å; P55-L59 WeakPolarHBondContact O-CG 2.88Å; P55-L59 PolarHBondContact O-N 2.9Å; A56-L59 PolarHBondContact O-N 2.86Å; L59-E62 WeakPolarHBondContact O-CB 3.42Å; L59-E62 PolarHBondContact O-N 3.34Å; L59-A63 PolarHBondContact O-N 3.14Å
60	L	93.3	Very high	90.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.3	-39.6	179.6	-70.2	171.6	0	0	0	112.2	Y41 L45 A56 E62 A63 L64 L160	Y41-L60 HydrophobicContact CD2-CD2 3.6Å; Y41-L60 HydrophobicContact CE2-CD2 3.91Å; L45-L60 HydrophobicContact CD2-CD2 4.45Å; A56-L60 WeakPolarHBondContact O-CB 3.35Å; A56-L60 VanDerWaalsContact O-CG 3.28Å; A56-L60 WeakPolarHBondContact O-CG 3.47Å; A56-L60 PolarHBondContact O-N 3.28Å; L60-E62 VanDerWaalsContact C-N 3.35Å; L60-A63 WeakPolarHBondContact O-CB 3.35Å; L60-A63 PolarHBondContact O-N 3.4Å; L60-L64 PolarHBondContact O-N 2.89Å; L60-L64 VanDerWaalsContact O-N 3.12Å; L60-L160 HydrophobicContact CB-CD1 4.47Å; L60-L160 HydrophobicContact CB-CD2 3.86Å; L60-L160 HydrophobicContact CB-CG 4.09Å; L60-L160 HydrophobicContact CD1-CD2 4.18Å; L60-L160 HydrophobicContact CD1-CG 4.16Å
61	R	93.4	Very high	89.8	Confident	28 Å²	28	30 Å²	30	11%	0.106	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-38.6	174	-70.4	174.4	72	-158.4	-4.2	112	E21 L28 V57 A63 L64 R65 L160 Y164	E21-R61 IonicContact OE1-CZ 2.89Å; E21-R61 IonicContact OE1-NH2 3.95Å; E21-R61 PolarHBondContact OE1-NH2 3.08Å; E21-R61 IonicContact OE2-CZ 2.67Å; E21-R61 IonicContact OE2-NH1 3.72Å; E21-R61 IonicContact OE2-NH2 3.22Å; E21-R61 PolarHBondContact OE2-NH2 3.24Å; L28-R61 HydrophobicContact CD1-CB 4.27Å; V57-R61 HydrophobicContact CG1-CG 4.34Å; V57-R61 WeakPolarHBondContact O-CB 3.31Å; V57-R61 WeakPolarHBondContact O-CD 3.41Å; V57-R61 WeakPolarHBondContact O-CG 3.45Å; V57-R61 PolarHBondContact O-N 3.03Å; V57-R61 VanDerWaalsContact O-N 3.09Å; R61-A63 VanDerWaalsContact C-N 3.29Å; R61-A63 PolarHBondContact O-N 3.19Å; R61-L64 PolarHBondContact O-N 2.83Å; R61-R65 WeakPolarHBondContact O-CB 3.5Å; R61-R65 PolarHBondContact O-N 3.39Å; R61-L160 HydrophobicContact CG-CD2 4.17Å; R61-Y164 WeakPolarHBondContact CD-OH 3.5Å
62	E	90.4	Very high	89.6	Confident	18 Å²	18	37.3 Å²	37.3	8%	0.084	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-37.1	175.2	-174.3	55.5	-128.3	0	0	111.6	L28 L40 A58 L59 L60 R65 S66	L28-E62 HydrophobicContact CD2-CB 4.44Å; L28-E62 WeakPolarHBondContact CD2-OE2 3.37Å; L40-E62 HydrophobicContact CD1-CB 4.21Å; L40-E62 HydrophobicContact CD1-CG 3.62Å; L40-E62 HydrophobicContact CD2-CB 4.22Å; L40-E62 HydrophobicContact CD2-CG 3.79Å; L40-E62 HydrophobicContact CG-CG 4.33Å; A58-E62 VanDerWaalsContact O-CB 3.29Å; A58-E62 WeakPolarHBondContact O-CB 3.35Å; A58-E62 PolarHBondContact O-N 3.09Å; L59-E62 WeakPolarHBondContact O-CB 3.42Å; L59-E62 PolarHBondContact O-N 3.34Å; L60-E62 VanDerWaalsContact C-N 3.35Å; E62-R65 VanDerWaalsContact CD-CZ 3.46Å; E62-R65 PolarHBondContact O-N 3.24Å; E62-R65 IonicContact OE1-CZ 2.86Å; E62-R65 IonicContact OE1-NE 2.61Å; E62-R65 PolarHBondContact OE1-NE 2.88Å; E62-R65 IonicContact OE1-NH2 3.01Å; E62-R65 PolarHBondContact OE1-NH2 2.86Å; E62-R65 IonicContact OE2-CZ 3.84Å; E62-R65 IonicContact OE2-NE 2.8Å; E62-R65 PolarHBondContact OE2-NE 3.01Å; E62-R65 IonicContact OE2-NH1 3.13Å; E62-R65 IonicContact OE2-NH2 3.19Å; E62-R65 PolarHBondContact OE2-NH2 3.41Å; E62-S66 VanDerWaalsContact O-CB 3.27Å; E62-S66 WeakPolarHBondContact O-CB 3.27Å; E62-S66 PolarHBondContact O-N 2.89Å; E62-S66 PolarHBondContact O-OG 2.85Å; E62-S66 PolarHBondContact OE1-OG 2.84Å; E62-S66 VanDerWaalsContact OE1-OG 3.09Å
63	A	90.4	Very high	89.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-47.9	176.2	0	0	0	0	0	111.5	L40 L59 L60 R61 R65 S66 Q67 F151	L40-A63 HydrophobicContact CB-CB 3.73Å; L40-A63 HydrophobicContact CD1-CB 4.43Å; L59-A63 PolarHBondContact O-N 3.14Å; L60-A63 WeakPolarHBondContact O-CB 3.35Å; L60-A63 PolarHBondContact O-N 3.4Å; R61-A63 VanDerWaalsContact C-N 3.29Å; R61-A63 PolarHBondContact O-N 3.19Å; A63-R65 PolarHBondContact O-N 3.33Å; A63-S66 PolarHBondContact O-N 2.77Å; A63-Q67 WeakPolarHBondContact O-CB 3.37Å; A63-Q67 PolarHBondContact O-N 3.39Å; A63-F151 HydrophobicContact CB-CE1 4.37Å; A63-F151 HydrophobicContact CB-CZ 3.88Å
64	L	90.6	Very high	88.8	Confident	21 Å²	21	36.6 Å²	36.6	11%	0.11	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-47.8	174.5	-71.8	164.7	0	0	0	111.6	L60 R61 S66 Q67 A68 F151 P156 Y157 L160	L60-L64 PolarHBondContact O-N 2.89Å; L60-L64 VanDerWaalsContact O-N 3.12Å; R61-L64 PolarHBondContact O-N 2.83Å; L64-S66 PolarHBondContact O-N 3.09Å; L64-Q67 PolarHBondContact O-N 2.93Å; L64-A68 PolarHBondContact O-N 3.29Å; L64-F151 HydrophobicContact CD2-CD1 3.74Å; L64-F151 HydrophobicContact CD2-CE1 3.74Å; L64-F151 HydrophobicContact CG-CE1 4.12Å; L64-P156 HydrophobicContact CD1-CB 4.18Å; L64-P156 HydrophobicContact CD2-CB 4.12Å; L64-P156 HydrophobicContact CD2-CG 4.06Å; L64-P156 HydrophobicContact CG-CB 4.18Å; L64-P156 HydrophobicContact CG-CG 4.48Å; L64-Y157 HydrophobicContact CD1-CE1 4.32Å; L64-Y157 HydrophobicContact CD1-CE2 3.94Å; L64-Y157 HydrophobicContact CD2-CE2 3.89Å; L64-L160 HydrophobicContact CD1-CD1 3.83Å
65	R	89.1	Confident	88.5	Confident	63 Å²	63	36.5 Å²	36.5	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-47.3	177.5	-177.1	-176.9	71.7	162.9	5.7	111.9	S29 R61 E62 A63 Q67 A68 A69	S29-R65 PolarHBondContact O-NH1 3.47Å; R61-R65 WeakPolarHBondContact O-CB 3.5Å; R61-R65 PolarHBondContact O-N 3.39Å; E62-R65 VanDerWaalsContact CD-CZ 3.46Å; E62-R65 PolarHBondContact O-N 3.24Å; E62-R65 IonicContact OE1-CZ 2.86Å; E62-R65 IonicContact OE1-NE 2.61Å; E62-R65 PolarHBondContact OE1-NE 2.88Å; E62-R65 IonicContact OE1-NH2 3.01Å; E62-R65 PolarHBondContact OE1-NH2 2.86Å; E62-R65 IonicContact OE2-CZ 3.84Å; E62-R65 IonicContact OE2-NE 2.8Å; E62-R65 PolarHBondContact OE2-NE 3.01Å; E62-R65 IonicContact OE2-NH1 3.13Å; E62-R65 IonicContact OE2-NH2 3.19Å; E62-R65 PolarHBondContact OE2-NH2 3.41Å; A63-R65 PolarHBondContact O-N 3.33Å; R65-Q67 VanDerWaalsContact C-N 3.33Å; R65-Q67 PolarHBondContact O-N 3.04Å; R65-A68 PolarHBondContact O-N 3.48Å; R65-A69 WeakPolarHBondContact O-CB 3.42Å; R65-A69 PolarHBondContact O-N 3.44Å
66	S	85.9	Confident	88.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66	-36.9	-177.7	-70.1	0	0	0	0	111.8	Q35 E62 A63 L64 A69 L70	Q35-S66 PolarHBondContact N-OG 2.89Å; Q35-S66 VanDerWaalsContact N-OG 3.12Å; Q35-S66 WeakPolarHBondContact O-CB 3.27Å; Q35-S66 PolarHBondContact O-OG 3.29Å; E62-S66 VanDerWaalsContact O-CB 3.27Å; E62-S66 WeakPolarHBondContact O-CB 3.27Å; E62-S66 PolarHBondContact O-N 2.89Å; E62-S66 PolarHBondContact O-OG 2.85Å; E62-S66 PolarHBondContact OE1-OG 2.84Å; E62-S66 VanDerWaalsContact OE1-OG 3.09Å; A63-S66 PolarHBondContact O-N 2.77Å; L64-S66 PolarHBondContact O-N 3.09Å; S66-A69 PolarHBondContact O-N 2.89Å; S66-L70 WeakPolarHBondContact O-CB 3.43Å; S66-L70 PolarHBondContact O-N 2.76Å
67	Q	84.9	Confident	88	Confident	51 Å²	51	36.8 Å²	36.8	24%	0.238	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-46.7	174	-168.5	-170.5	29.7	0	0	111.8	P37 A63 L64 R65 A69 L70 G71 F151	P37-Q67 HydrophobicContact CB-CB 4.35Å; P37-Q67 HydrophobicContact CG-CB 4.32Å; A63-Q67 WeakPolarHBondContact O-CB 3.37Å; A63-Q67 PolarHBondContact O-N 3.39Å; L64-Q67 PolarHBondContact O-N 2.93Å; R65-Q67 VanDerWaalsContact C-N 3.33Å; R65-Q67 PolarHBondContact O-N 3.04Å; Q67-A69 VanDerWaalsContact C-N 3.31Å; Q67-A69 PolarHBondContact O-N 3.31Å; Q67-L70 WeakPolarHBondContact O-CB 3.38Å; Q67-L70 PolarHBondContact O-N 2.79Å; Q67-G71 PolarHBondContact O-N 2.86Å; Q67-G71 VanDerWaalsContact O-N 3.12Å; Q67-F151 VanDerWaalsContact NE2-CB 3.28Å; Q67-F151 VanDerWaalsContact OE1-CB 3.3Å
68	A	84.6	Confident	87.5	Confident	55 Å²	55	37 Å²	37	46%	0.455	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-39.2	176.4	0	0	0	0	0	112	L64 R65 G71 R72	L64-A68 PolarHBondContact O-N 3.29Å; R65-A68 PolarHBondContact O-N 3.48Å; A68-G71 PolarHBondContact O-N 3.41Å; A68-R72 WeakPolarHBondContact O-CG 3.44Å; A68-R72 PolarHBondContact O-N 2.97Å; A68-R72 VanDerWaalsContact O-N 3.12Å
69	A	84.1	Confident	87.1	Confident	30 Å²	30	38 Å²	38	25%	0.248	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-39.8	175.8	0	0	0	0	0	112.3	P34 R65 S66 Q67 R72 V73	P34-A69 HydrophobicContact CB-CB 4.08Å; P34-A69 HydrophobicContact CG-CB 4.39Å; R65-A69 WeakPolarHBondContact O-CB 3.42Å; R65-A69 PolarHBondContact O-N 3.44Å; S66-A69 PolarHBondContact O-N 2.89Å; Q67-A69 VanDerWaalsContact C-N 3.31Å; Q67-A69 PolarHBondContact O-N 3.31Å; A69-R72 PolarHBondContact O-N 2.83Å; A69-V73 WeakPolarHBondContact O-CG2 3.35Å; A69-V73 PolarHBondContact O-N 3.45Å
70	L	81.9	Confident	86.8	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-46.8	175.5	178.2	63.9	0	0	0	111.7	S66 Q67 R72 V73 R74 L133 L141	S66-L70 WeakPolarHBondContact O-CB 3.43Å; S66-L70 PolarHBondContact O-N 2.76Å; Q67-L70 WeakPolarHBondContact O-CB 3.38Å; Q67-L70 PolarHBondContact O-N 2.79Å; L70-R72 VanDerWaalsContact C-N 3.35Å; L70-R72 PolarHBondContact O-N 2.7Å; L70-V73 PolarHBondContact O-N 3.08Å; L70-R74 WeakPolarHBondContact O-CG 3.48Å; L70-R74 PolarHBondContact O-N 2.74Å; L70-L133 HydrophobicContact CD1-CD1 3.8Å; L70-L141 HydrophobicContact CD1-CB 4.11Å; L70-L141 HydrophobicContact CD1-CD1 4.13Å; L70-L141 HydrophobicContact CD2-CB 4.05Å; L70-L141 VanDerWaalsContact CD2-O 3.26Å; L70-L141 WeakPolarHBondContact CD2-O 3.26Å
71	G	82	Confident	86.4	Confident	12 Å²	12	38.8 Å²	38.8	12%	0.124	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-44.8	176.8	0	0	0	0	0	112.2	Q67 A68 V73 R74 L75	Q67-G71 PolarHBondContact O-N 2.86Å; Q67-G71 VanDerWaalsContact O-N 3.12Å; A68-G71 PolarHBondContact O-N 3.41Å; G71-V73 PolarHBondContact O-N 3.43Å; G71-R74 PolarHBondContact O-N 2.86Å; G71-L75 PolarHBondContact O-N 2.76Å
72	R	85.5	Confident	85.6	Confident	185 Å²	185	39.9 Å²	39.9	70%	0.698	23%	0.225	S	C	*	.	H	α-helix	trans	-60.2	-43.8	175.5	-70.4	178.5	-173.5	-161.1	1.1	112.8	A68 A69 L70 R74 L75 D76	A68-R72 WeakPolarHBondContact O-CG 3.44Å; A68-R72 PolarHBondContact O-N 2.97Å; A68-R72 VanDerWaalsContact O-N 3.12Å; A69-R72 PolarHBondContact O-N 2.83Å; L70-R72 VanDerWaalsContact C-N 3.35Å; L70-R72 PolarHBondContact O-N 2.7Å; R72-R74 VanDerWaalsContact C-N 3.32Å; R72-R74 PolarHBondContact O-N 2.69Å; R72-L75 PolarHBondContact O-N 3.49Å; R72-D76 WeakPolarHBondContact O-CB 3.42Å; R72-D76 PolarHBondContact O-N 3.3Å
73	V	85.7	Confident	85.1	Confident	19 Å²	19	43 Å²	43	12%	0.115	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-40.2	177.5	167.8	0	0	0	0	111.3	A69 L70 G71 D76 C77 R132 L133	A69-V73 WeakPolarHBondContact O-CG2 3.35Å; A69-V73 PolarHBondContact O-N 3.45Å; L70-V73 PolarHBondContact O-N 3.08Å; G71-V73 PolarHBondContact O-N 3.43Å; V73-D76 PolarHBondContact O-N 3.02Å; V73-C77 VanDerWaalsContact O-CB 3.25Å; V73-C77 WeakPolarHBondContact O-CB 3.35Å; V73-C77 PolarHBondContact O-N 3.15Å; V73-C77 PolarHBondContact O-SG 3.12Å; V73-R132 HydrophobicContact CG1-CB 3.82Å; V73-R132 HydrophobicContact CG2-CB 4.07Å; V73-L133 HydrophobicContact CB-CD1 4.46Å; V73-L133 HydrophobicContact CB-CD2 4.21Å; V73-L133 HydrophobicContact CB-CG 4.43Å; V73-L133 HydrophobicContact CG1-CD1 3.87Å; V73-L133 HydrophobicContact CG1-CD2 4.22Å; V73-L133 HydrophobicContact CG1-CG 3.9Å; V73-L133 HydrophobicContact CG2-CD2 3.85Å; V73-L133 HydrophobicContact CG2-CG 4.39Å
74	R	84.6	Confident	84.5	Confident	64 Å²	64	47.1 Å²	47.1	24%	0.242	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-43	176.3	-74.1	174	171.5	-179.6	-4.5	112.2	L70 G71 R72 G78 D256	L70-R74 WeakPolarHBondContact O-CG 3.48Å; L70-R74 PolarHBondContact O-N 2.74Å; G71-R74 PolarHBondContact O-N 2.86Å; R72-R74 VanDerWaalsContact C-N 3.32Å; R72-R74 PolarHBondContact O-N 2.69Å; R74-G78 WeakPolarHBondContact O-CA 3.3Å; R74-G78 PolarHBondContact O-N 3.07Å; R74-D256 WeakPolarHBondContact CD-OD1 3.27Å; R74-D256 IonicContact CZ-OD1 2.97Å; R74-D256 IonicContact NE-OD1 2.94Å; R74-D256 IonicContact NH1-OD1 3.84Å; R74-D256 PolarHBondContact NH1-OD1 3.47Å
75	L	86.4	Confident	83.4	Confident	56 Å²	56	51.9 Å²	51.9	29%	0.293	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-53.2	174.8	179.7	58.3	0	0	0	111.5	G71 R72 C77 G78 A79 E251 A255	G71-L75 PolarHBondContact O-N 2.76Å; R72-L75 PolarHBondContact O-N 3.49Å; L75-C77 PolarHBondContact O-N 2.9Å; L75-G78 PolarHBondContact O-N 2.89Å; L75-A79 WeakPolarHBondContact O-CB 3.36Å; L75-A79 PolarHBondContact O-N 2.89Å; L75-E251 HydrophobicContact CD1-CB 4.42Å; L75-A255 HydrophobicContact CB-CB 4.22Å; L75-A255 HydrophobicContact CD1-CB 4.03Å
76	D	88.2	Confident	82.2	Confident	70 Å²	70	50.7 Å²	50.7	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-45.3	-179.3	-74.1	-4.2	0	0	0	112.2	R72 V73 S80 R132	R72-D76 WeakPolarHBondContact O-CB 3.42Å; R72-D76 PolarHBondContact O-N 3.3Å; V73-D76 PolarHBondContact O-N 3.02Å; D76-S80 VanDerWaalsContact O-CB 3.31Å; D76-S80 WeakPolarHBondContact O-CB 3.36Å; D76-S80 PolarHBondContact O-N 3.44Å; D76-R132 IonicContact OD2-CZ 3.65Å; D76-R132 IonicContact OD2-NH1 2.76Å; D76-R132 PolarHBondContact OD2-NH1 2.9Å; D76-R132 IonicContact OD2-NH2 3.15Å
77	C	87.4	Confident	80.9	Confident	3 Å²	3	51 Å²	51	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-67	-41.4	177.1	-71.4	0	0	0	0	111.7	V73 L75 A79 S80 C81 L125 C128	V73-C77 VanDerWaalsContact O-CB 3.25Å; V73-C77 WeakPolarHBondContact O-CB 3.35Å; V73-C77 PolarHBondContact O-N 3.15Å; V73-C77 PolarHBondContact O-SG 3.12Å; L75-C77 PolarHBondContact O-N 2.9Å; C77-A79 VanDerWaalsContact C-N 3.35Å; C77-A79 PolarHBondContact O-N 3.17Å; C77-S80 PolarHBondContact O-N 2.77Å; C77-C81 WeakPolarHBondContact O-CB 3.46Å; C77-C81 PolarHBondContact O-N 2.62Å; C77-C81 PolarHBondContact O-SG 3.37Å; C77-L125 HydrophobicContact CB-CD2 4.29Å; C77-C128 WeakPolarHBondContact CA-SG 3.37Å; C77-C128 HydrophobicContact CB-CB 3.7Å; C77-C128 WeakPolarHBondContact CB-SG 3.41Å; C77-C128 WeakPolarHBondContact SG-CB 3.48Å; C77-C128 CovalentContact SG-SG 2.04Å; C77-C128 PolarHBondContact SG-SG 3.16Å
78	G	84.2	Confident	79.6	Confident	7 Å²	7	51.8 Å²	51.8	7%	0.072	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-44.2	177.2	0	0	0	0	0	112.8	R74 L75 A82 R121	R74-G78 WeakPolarHBondContact O-CA 3.3Å; R74-G78 PolarHBondContact O-N 3.07Å; L75-G78 PolarHBondContact O-N 2.89Å; G78-A82 WeakPolarHBondContact O-CB 3.28Å; G78-A82 PolarHBondContact O-N 2.97Å; G78-A82 VanDerWaalsContact O-N 3.14Å; G78-R121 PolarHBondContact O-NH2 3.47Å; G78-R121 VanDerWaalsContact O-NH2 3.09Å
79	A	83.5	Confident	78.2	Confident	63 Å²	63	52.7 Å²	52.7	52%	0.521	33%	0.327	S	S	.	.	H	α-helix	trans	-68.1	-50.7	176.6	0	0	0	0	0	111.7	L75 C77 C81 A82 A83	L75-A79 WeakPolarHBondContact O-CB 3.36Å; L75-A79 PolarHBondContact O-N 2.89Å; C77-A79 VanDerWaalsContact C-N 3.35Å; C77-A79 PolarHBondContact O-N 3.17Å; A79-C81 PolarHBondContact O-N 3.14Å; A79-A82 PolarHBondContact O-N 2.99Å; A79-A83 PolarHBondContact O-N 2.77Å
80	S	86.3	Confident	76.7	Confident	63 Å²	63	52.3 Å²	52.3	44%	0.441	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-45.4	179.6	-172.8	0	0	0	0	112	D76 C77 A82 A83 E84	D76-S80 VanDerWaalsContact O-CB 3.31Å; D76-S80 WeakPolarHBondContact O-CB 3.36Å; D76-S80 PolarHBondContact O-N 3.44Å; C77-S80 PolarHBondContact O-N 2.77Å; S80-A82 VanDerWaalsContact C-N 3.3Å; S80-A82 PolarHBondContact O-N 3.27Å; S80-A83 PolarHBondContact O-N 2.93Å; S80-E84 PolarHBondContact O-N 3.17Å
81	C	85.8	Confident	74.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-73.3	-20	-180	-65.7	0	0	0	0	113.3	C77 A79 A87 C124 L125	C77-C81 WeakPolarHBondContact O-CB 3.46Å; C77-C81 PolarHBondContact O-N 2.62Å; C77-C81 PolarHBondContact O-SG 3.37Å; A79-C81 PolarHBondContact O-N 3.14Å; C81-A87 VanDerWaalsContact O-CB 3.25Å; C81-A87 WeakPolarHBondContact O-CB 3.4Å; C81-C124 WeakPolarHBondContact CA-SG 3.25Å; C81-C124 HydrophobicContact CB-CB 3.78Å; C81-C124 WeakPolarHBondContact CB-SG 3.25Å; C81-C124 WeakPolarHBondContact SG-CB 3.44Å; C81-C124 PolarHBondContact SG-O 2.9Å; C81-C124 CovalentContact SG-SG 2.04Å; C81-C124 PolarHBondContact SG-SG 2.77Å; C81-L125 HydrophobicContact CB-CD2 4.05Å; C81-L125 HydrophobicContact CB-CG 4.27Å; C81-L125 PolarHBondContact SG-N 2.63Å; C81-L125 VanDerWaalsContact SG-N 3.42Å
82	A	77.1	Confident	73	Confident	50 Å²	50	58.5 Å²	58.5	41%	0.413	36%	0.364	S	S	.	.	H	α-helix	trans	-73.9	-29.9	169.9	0	0	0	0	0	112.8	G78 A79 S80 E84 R121	G78-A82 WeakPolarHBondContact O-CB 3.28Å; G78-A82 PolarHBondContact O-N 2.97Å; G78-A82 VanDerWaalsContact O-N 3.14Å; A79-A82 PolarHBondContact O-N 2.99Å; S80-A82 VanDerWaalsContact C-N 3.3Å; S80-A82 PolarHBondContact O-N 3.27Å; A82-E84 VanDerWaalsContact C-N 3.34Å; A82-R121 VanDerWaalsContact CB-NH1 3.32Å
83	A	78.8	Confident	71.1	Confident	83 Å²	83	53.7 Å²	53.7	69%	0.686	35%	0.352	S	S	*	.	S	Bend	trans	-82.6	-8	178.3	0	0	0	0	0	113.7	A79 S80	A79-A83 PolarHBondContact O-N 2.77Å; S80-A83 PolarHBondContact O-N 2.93Å
84	E	78.2	Confident	69	Low	88 Å²	88	59.2 Å²	59.2	41%	0.411	38%	0.38	S	S	.	.	S	Bend	trans	-69.8	135.5	-177.9	-77.6	-158.9	159.9	0	0	113.3	S80 A82 G86 A87 C124	S80-E84 PolarHBondContact O-N 3.17Å; A82-E84 VanDerWaalsContact C-N 3.34Å; E84-G86 PolarHBondContact O-N 3.25Å; E84-A87 HydrophobicContact CB-CB 4.08Å; E84-A87 WeakPolarHBondContact O-CB 3.28Å; E84-A87 PolarHBondContact O-N 2.77Å; E84-C124 VanDerWaalsContact CD-SG 3.51Å; E84-C124 PolarHBondContact OE2-SG 2.95Å
85	P	66.9	Low	66.8	Low	121 Å²	121	59.4 Å²	59.4	79%	0.786	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	119.2	176.8	-25.3	33.9	0	0	0	113.2
86	G	63.8	Low	64.3	Low	38 Å²	38	59.6 Å²	59.6	39%	0.392	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	8.4	-179.4	0	0	0	0	0	115.2	E84 A117	E84-G86 PolarHBondContact O-N 3.25Å; G86-A117 WeakPolarHBondContact O-CA 3.27Å
87	A	58.8	Low	61.7	Low	7 Å²	7	62.2 Å²	62.2	6%	0.058	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-15.7	162.1	0	0	0	0	0	112.3	C81 E84 R121	C81-A87 VanDerWaalsContact O-CB 3.25Å; C81-A87 WeakPolarHBondContact O-CB 3.4Å; E84-A87 HydrophobicContact CB-CB 4.08Å; E84-A87 WeakPolarHBondContact O-CB 3.28Å; E84-A87 PolarHBondContact O-N 2.77Å; A87-R121 HydrophobicContact CB-CB 4.48Å
88	A	58.1	Low	59.3	Low	66 Å²	66	68.3 Å²	68.3	55%	0.545	46%	0.461	S	S	.	.	S	Bend	trans	-68.6	135.2	170.8	0	0	0	0	0	110.8
89	L	55.8	Low	57	Low	75 Å²	75	73.2 Å²	73.2	39%	0.393	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-62.7	139.1	172.9	-67.1	170.4	0	0	0	109.4	A91 L114 W287	L89-A91 PolarHBondContact O-N 2.04Å; L89-L114 HydrophobicContact CD2-CD1 3.26Å; L89-W287 HydrophobicContact CD1-CZ2 4.44Å
90	P	51.7	Low	54.9	Low	21 Å²	21	78.1 Å²	78.1	14%	0.136	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-54	134.7	179.1	-25	32.5	0	0	0	112.3	V92 L93 Q113	P90-V92 PolarHBondContact O-N 3.01Å; P90-L93 PolarHBondContact O-N 3.17Å; P90-Q113 HydrophobicContact CG-CB 3.68Å
91	A	44.1	Very low	52.6	Low	66 Å²	66	80.6 Å²	80.6	55%	0.545	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-57.9	-23.4	-179.6	0	0	0	0	0	113.7	L89 L93 L94	L89-A91 PolarHBondContact O-N 2.04Å; A91-L93 PolarHBondContact O-N 2.75Å; A91-L94 PolarHBondContact O-N 3.35Å
92	V	42.4	Very low	50.5	Low	83 Å²	83	83.6 Å²	83.6	50%	0.503	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-58.2	-26.6	175.2	-178.2	0	0	0	0	112.4	P90	P90-V92 PolarHBondContact O-N 3.01Å
93	L	45.3	Very low	48.9	Very low	85 Å²	85	87.7 Å²	87.7	45%	0.445	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-83.5	-10.3	176.6	-71	166.1	0	0	0	113.7	P90 A91 W110 L114	P90-L93 PolarHBondContact O-N 3.17Å; A91-L93 PolarHBondContact O-N 2.75Å; L93-W110 HydrophobicContact CD2-CE3 4.21Å; L93-W110 HydrophobicContact CD2-CZ3 4.41Å; L93-L114 HydrophobicContact CD1-CB 4.44Å; L93-L114 HydrophobicContact CD1-CD1 3.93Å; L93-L114 HydrophobicContact CD1-CD2 4.37Å; L93-L114 HydrophobicContact CD1-CG 4.49Å
94	L	41.7	Very low	47.3	Very low	135 Å²	135	86.5 Å²	86.5	71%	0.707	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-99.1	8.5	-177.6	-67.3	170.6	0	0	0	113.2	A91 A96	A91-L94 PolarHBondContact O-N 3.35Å; L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 3.08Å
95	G	38	Very low	45.8	Very low	67 Å²	67	86.8 Å²	86.8	69%	0.691	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.4	24.3	175.6	0	0	0	0	0	114.7
96	A	34.3	Very low	45	Very low	61 Å²	61	85.7 Å²	85.7	50%	0.504	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-72.2	134	172.2	0	0	0	0	0	110.1	L94 E98	L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 3.08Å; A96-E98 PolarHBondContact O-N 3.28Å
97	P	33.8	Very low	44.2	Very low	125 Å²	125	93.5 Å²	93.5	81%	0.812	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-64.7	127.6	175	25.1	-30.5	0	0	0	109.9
98	E	36	Very low	44.1	Very low	131 Å²	131	93.8 Å²	93.8	61%	0.612	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-60.7	134.6	176	-74	-98.9	143	0	0	110.5	A96 D100	A96-E98 PolarHBondContact O-N 3.28Å; E98-D100 PolarHBondContact O-N 2.92Å
99	P	37.7	Very low	44.6	Very low	109 Å²	109	91.6 Å²	91.6	71%	0.708	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-70.2	117.1	159.3	27.2	-25.6	0	0	0	108.2	S101	P99-S101 PolarHBondContact O-N 2.79Å
100	D	39.2	Very low	45.3	Very low	166 Å²	166	93.1 Å²	93.1	89%	0.888	59%	0.587	S	S	*	*	S	Bend	trans	-50.3	92.1	-178.3	-148.2	7.1	0	0	0	112.1	E98	E98-D100 PolarHBondContact O-N 2.92Å
101	S	38	Very low	46.2	Very low	115 Å²	115	95.2 Å²	95.2	80%	0.804	60%	0.595	S	S	*	*			trans	-167.5	100.9	163.5	10.3	0	0	0	0	114	P99	P99-S101 PolarHBondContact O-N 2.79Å
102	G	41.2	Very low	47.8	Very low	64 Å²	64	99.5 Å²	99.5	66%	0.66	60%	0.597	S	S	*	*	S	Bend	trans	128.4	154.9	157.8	0	0	0	0	0	115.2	G104	G102-G104 PolarHBondContact O-N 2.85Å
103	P	42.7	Very low	49.4	Very low	135 Å²	135	99.9 Å²	99.9	88%	0.877	59%	0.593	S	S	*	*	S	Bend	trans	-60.3	129.1	-176.4	26.9	-32.2	0	0	0	109.6
104	G	46.5	Very low	50.8	Low	58 Å²	58	98.2 Å²	98.2	60%	0.598	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-51.9	152.4	-164.2	0	0	0	0	0	114.9	G102 T106	G102-G104 PolarHBondContact O-N 2.85Å; G104-T106 PolarHBondContact O-N 3.01Å; G104-T106 VanDerWaalsContact O-N 3.16Å
105	P	46.8	Very low	52.5	Low	94 Å²	94	93.6 Å²	93.6	61%	0.61	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-55.1	124.3	-179.6	20.5	-30.1	0	0	0	110.1	Q107 S109	P105-Q107 PolarHBondContact O-N 2.98Å; P105-S109 WeakPolarHBondContact CB-OG 3.31Å
106	T	49.5	Very low	54.6	Low	98 Å²	98	97.2 Å²	97.2	60%	0.601	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-54.3	136.5	173.7	47.1	0	0	0	0	110	G104 G108 S109	G104-T106 PolarHBondContact O-N 3.01Å; G104-T106 VanDerWaalsContact O-N 3.16Å; T106-G108 PolarHBondContact O-N 3.48Å; T106-G108 VanDerWaalsContact O-N 3.13Å; T106-S109 WeakPolarHBondContact O-CB 3.45Å; T106-S109 PolarHBondContact O-N 2.85Å; T106-S109 PolarHBondContact O-OG 2.97Å
107	Q	47.8	Very low	56.8	Low	203 Å²	203	94.5 Å²	94.5	95%	0.949	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	116.8	174.6	-152.6	168.8	21.3	0	0	108.5	P105	P105-Q107 PolarHBondContact O-N 2.98Å
108	G	56.5	Low	58.8	Low	13 Å²	13	90.7 Å²	90.7	13%	0.134	51%	0.509	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.1	1.5	-175.8	0	0	0	0	0	117	T106 R112	T106-G108 PolarHBondContact O-N 3.48Å; T106-G108 VanDerWaalsContact O-N 3.13Å; G108-R112 WeakPolarHBondContact O-CG 3.38Å; G108-R112 PolarHBondContact O-NE 2.83Å
109	S	67	Low	61	Low	19 Å²	19	90.4 Å²	90.4	13%	0.133	51%	0.511	C	S	.	.	H	α-helix	trans	-73	-40.9	171.1	59.1	0	0	0	0	112.7	P105 T106 Q113	P105-S109 WeakPolarHBondContact CB-OG 3.31Å; T106-S109 WeakPolarHBondContact O-CB 3.45Å; T106-S109 PolarHBondContact O-N 2.85Å; T106-S109 PolarHBondContact O-OG 2.97Å; S109-Q113 WeakPolarHBondContact O-CG 3.49Å; S109-Q113 PolarHBondContact O-N 3.09Å
110	W	70.5	Confident	63.2	Low	108 Å²	108	91.3 Å²	91.3	41%	0.409	50%	0.501	S	S	.	.	H	α-helix	trans	-69.8	-39	179.6	69.7	-94.1	0	0	0	112.5	L93 R112 Q113 L114	L93-W110 HydrophobicContact CD2-CE3 4.21Å; L93-W110 HydrophobicContact CD2-CZ3 4.41Å; W110-R112 VanDerWaalsContact C-N 3.34Å; W110-R112 PolarHBondContact O-N 3.39Å; W110-Q113 PolarHBondContact O-N 2.93Å; W110-Q113 VanDerWaalsContact O-N 3.15Å; W110-L114 HydrophobicContact CE3-CD2 4.36Å; W110-L114 HydrophobicContact CZ3-CD2 3.89Å; W110-L114 WeakPolarHBondContact O-CB 3.35Å; W110-L114 PolarHBondContact O-N 2.88Å
111	E	72	Confident	65.3	Low	65 Å²	65	85.2 Å²	85.2	30%	0.304	47%	0.465	S	S	.	.	H	α-helix	trans	-58.8	-46	177.7	-66.9	174.1	-176.2	0	0	111	Q113 L114 L115 Y280	E111-Q113 VanDerWaalsContact C-N 3.32Å; E111-Q113 PolarHBondContact O-N 2.96Å; E111-L114 PolarHBondContact O-N 3.34Å; E111-L115 WeakPolarHBondContact O-CB 3.44Å; E111-L115 VanDerWaalsContact O-CG 3.3Å; E111-L115 WeakPolarHBondContact O-CG 3.35Å; E111-L115 PolarHBondContact O-N 2.86Å; E111-Y280 PolarHBondContact OE2-OH 3.29Å
112	R	76	Confident	67.3	Low	156 Å²	156	82.1 Å²	82.1	59%	0.589	45%	0.447	S	S	*	.	H	α-helix	trans	-64.6	-36.7	177.5	-71.3	-177.6	-69.7	-175.7	-0.2	112.3	G108 W110 R116	G108-R112 WeakPolarHBondContact O-CG 3.38Å; G108-R112 PolarHBondContact O-NE 2.83Å; W110-R112 VanDerWaalsContact C-N 3.34Å; W110-R112 PolarHBondContact O-N 3.39Å; R112-R116 WeakPolarHBondContact O-CB 3.39Å; R112-R116 PolarHBondContact O-N 3.03Å
113	Q	77.5	Confident	69.4	Low	90 Å²	90	83.3 Å²	83.3	42%	0.421	44%	0.438	S	S	.	.	H	α-helix	trans	-69.4	-43	176.1	-69.3	173	10.1	0	0	111.4	P90 S109 W110 E111 R116 A117	P90-Q113 HydrophobicContact CG-CB 3.68Å; S109-Q113 WeakPolarHBondContact O-CG 3.49Å; S109-Q113 PolarHBondContact O-N 3.09Å; W110-Q113 PolarHBondContact O-N 2.93Å; W110-Q113 VanDerWaalsContact O-N 3.15Å; E111-Q113 VanDerWaalsContact C-N 3.32Å; E111-Q113 PolarHBondContact O-N 2.96Å; Q113-R116 PolarHBondContact O-N 3.15Å; Q113-A117 WeakPolarHBondContact O-CB 3.36Å; Q113-A117 PolarHBondContact O-N 3.46Å
114	L	74.4	Confident	71.6	Confident	51 Å²	51	77.4 Å²	77.4	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-53.7	175.6	174	62.6	0	0	0	111.4	L89 L93 W110 E111 R116 A117 A118	L89-L114 HydrophobicContact CD2-CD1 3.26Å; L93-L114 HydrophobicContact CD1-CB 4.44Å; L93-L114 HydrophobicContact CD1-CD1 3.93Å; L93-L114 HydrophobicContact CD1-CD2 4.37Å; L93-L114 HydrophobicContact CD1-CG 4.49Å; W110-L114 HydrophobicContact CE3-CD2 4.36Å; W110-L114 HydrophobicContact CZ3-CD2 3.89Å; W110-L114 WeakPolarHBondContact O-CB 3.35Å; W110-L114 PolarHBondContact O-N 2.88Å; E111-L114 PolarHBondContact O-N 3.34Å; L114-R116 VanDerWaalsContact C-N 3.3Å; L114-R116 PolarHBondContact O-N 3.35Å; L114-A117 PolarHBondContact O-N 3.21Å; L114-A118 WeakPolarHBondContact O-CB 3.41Å; L114-A118 PolarHBondContact O-N 3.33Å
115	L	77.8	Confident	73.4	Confident	38 Å²	38	76.4 Å²	76.4	20%	0.199	38%	0.38	C	S	.	.	H	α-helix	trans	-59.2	-42	178.1	-72.7	169.8	0	0	0	111.3	E111 A118 L119 Y280 I283	E111-L115 WeakPolarHBondContact O-CB 3.44Å; E111-L115 VanDerWaalsContact O-CG 3.3Å; E111-L115 WeakPolarHBondContact O-CG 3.35Å; E111-L115 PolarHBondContact O-N 2.86Å; L115-A118 PolarHBondContact O-N 2.99Å; L115-L119 WeakPolarHBondContact O-CB 3.37Å; L115-L119 VanDerWaalsContact O-CG 3.24Å; L115-L119 WeakPolarHBondContact O-CG 3.18Å; L115-L119 PolarHBondContact O-N 3Å; L115-Y280 HydrophobicContact CD1-CE1 4.18Å; L115-I283 HydrophobicContact CD2-CD1 3.35Å
116	R	81.6	Confident	75.1	Confident	143 Å²	143	76.5 Å²	76.5	54%	0.54	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-44.9	176	-177.2	-178.3	-67.8	150.2	-2	111.8	R112 Q113 L114 R120	R112-R116 WeakPolarHBondContact O-CB 3.39Å; R112-R116 PolarHBondContact O-N 3.03Å; Q113-R116 PolarHBondContact O-N 3.15Å; L114-R116 VanDerWaalsContact C-N 3.3Å; L114-R116 PolarHBondContact O-N 3.35Å; R116-R120 HydrophobicContact CG-CG 4.49Å; R116-R120 VanDerWaalsContact O-CB 3.29Å; R116-R120 WeakPolarHBondContact O-CB 3.19Å; R116-R120 VanDerWaalsContact O-CG 3.27Å; R116-R120 WeakPolarHBondContact O-CG 3.34Å; R116-R120 PolarHBondContact O-N 3.45Å
117	A	79.6	Confident	76.9	Confident	3 Å²	3	75.5 Å²	75.5	3%	0.025	37%	0.368	C	S	.	.	H	α-helix	trans	-64.4	-44.1	178.7	0	0	0	0	0	111.6	G86 Q113 L114 R120 R121	G86-A117 WeakPolarHBondContact O-CA 3.27Å; Q113-A117 WeakPolarHBondContact O-CB 3.36Å; Q113-A117 PolarHBondContact O-N 3.46Å; L114-A117 PolarHBondContact O-N 3.21Å; A117-R120 PolarHBondContact O-N 3.46Å; A117-R121 WeakPolarHBondContact O-CB 3.01Å; A117-R121 PolarHBondContact O-N 3.22Å
118	A	77.4	Confident	78.9	Confident	45 Å²	45	66.6 Å²	66.6	37%	0.372	33%	0.328	S	S	.	.	H	α-helix	trans	-61.7	-49	177.1	0	0	0	0	0	112.2	L114 L115 R121 A122	L114-A118 WeakPolarHBondContact O-CB 3.41Å; L114-A118 PolarHBondContact O-N 3.33Å; L115-A118 PolarHBondContact O-N 2.99Å; A118-R121 PolarHBondContact O-N 3.17Å; A118-A122 PolarHBondContact O-N 3.11Å
119	L	80.6	Confident	80.1	Confident	125 Å²	125	66.7 Å²	66.7	65%	0.654	33%	0.327	S	S	*	.	H	α-helix	trans	-65	-40.7	178.5	-69.9	172.4	0	0	0	112.1	L115 A122 D123	L115-L119 WeakPolarHBondContact O-CB 3.37Å; L115-L119 VanDerWaalsContact O-CG 3.24Å; L115-L119 WeakPolarHBondContact O-CG 3.18Å; L115-L119 PolarHBondContact O-N 3Å; L119-A122 PolarHBondContact O-N 2.79Å; L119-D123 WeakPolarHBondContact O-CB 3.27Å; L119-D123 PolarHBondContact O-N 2.77Å
120	R	84.1	Confident	80.9	Confident	129 Å²	129	67.6 Å²	67.6	49%	0.487	34%	0.336	S	S	.	.	H	α-helix	trans	-61.6	-43.4	174.3	-80.7	-177	174.7	-168.7	-1.1	111.9	R116 A117 D123 C124	R116-R120 HydrophobicContact CG-CG 4.49Å; R116-R120 VanDerWaalsContact O-CB 3.29Å; R116-R120 WeakPolarHBondContact O-CB 3.19Å; R116-R120 VanDerWaalsContact O-CG 3.27Å; R116-R120 WeakPolarHBondContact O-CG 3.34Å; R116-R120 PolarHBondContact O-N 3.45Å; A117-R120 PolarHBondContact O-N 3.46Å; R120-D123 PolarHBondContact O-N 2.91Å; R120-C124 WeakPolarHBondContact O-CB 3.38Å; R120-C124 PolarHBondContact O-N 2.51Å
121	R	83.2	Confident	81.6	Confident	38 Å²	38	71.7 Å²	71.7	14%	0.143	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-45.7	176.1	-173.2	-178.8	-177.7	77.8	11.9	111	G78 A82 A87 A117 A118 C124 L125 Q258	G78-R121 PolarHBondContact O-NH2 3.47Å; G78-R121 VanDerWaalsContact O-NH2 3.09Å; A82-R121 VanDerWaalsContact CB-NH1 3.32Å; A87-R121 HydrophobicContact CB-CB 4.48Å; A117-R121 WeakPolarHBondContact O-CB 3.01Å; A117-R121 PolarHBondContact O-N 3.22Å; A118-R121 PolarHBondContact O-N 3.17Å; R121-C124 PolarHBondContact O-N 3.25Å; R121-L125 HydrophobicContact CG-CD1 4.17Å; R121-L125 VanDerWaalsContact O-CG 3.27Å; R121-L125 WeakPolarHBondContact O-CG 3.39Å; R121-L125 PolarHBondContact O-N 3.47Å; R121-Q258 VanDerWaalsContact NE-OE1 3.1Å
122	A	81.1	Confident	82.2	Confident	50 Å²	50	74.7 Å²	74.7	41%	0.413	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-43	178.6	0	0	0	0	0	112.4	A118 L119 L125 T126	A118-A122 PolarHBondContact O-N 3.11Å; L119-A122 PolarHBondContact O-N 2.79Å; A122-L125 PolarHBondContact O-N 3.49Å; A122-T126 WeakPolarHBondContact O-CB 3.45Å; A122-T126 PolarHBondContact O-N 2.77Å; A122-T126 PolarHBondContact O-OG1 3.28Å
123	D	85.8	Confident	82.4	Confident	88 Å²	88	68.2 Å²	68.2	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-64.1	-46.3	175.5	-176.5	40.7	0	0	0	111.4	L119 R120 L125 T126 Q127	L119-D123 WeakPolarHBondContact O-CB 3.27Å; L119-D123 PolarHBondContact O-N 2.77Å; R120-D123 PolarHBondContact O-N 2.91Å; D123-L125 PolarHBondContact O-N 3.06Å; D123-T126 PolarHBondContact O-N 2.99Å; D123-Q127 WeakPolarHBondContact O-CB 3.36Å; D123-Q127 WeakPolarHBondContact O-CG 3.46Å; D123-Q127 PolarHBondContact O-N 3.29Å; D123-Q127 PolarHBondContact OD1-NE2 2.89Å; D123-Q127 PolarHBondContact OD2-NE2 3.22Å
124	C	88.1	Confident	82.3	Confident	11 Å²	11	65.1 Å²	65.1	7%	0.074	33%	0.329	C	S	.	.	H	α-helix	trans	-57.2	-47.7	175.4	177.9	0	0	0	0	112	C81 E84 R120 R121 T126 Q127 C128	C81-C124 WeakPolarHBondContact CA-SG 3.25Å; C81-C124 HydrophobicContact CB-CB 3.78Å; C81-C124 WeakPolarHBondContact CB-SG 3.25Å; C81-C124 WeakPolarHBondContact SG-CB 3.44Å; C81-C124 PolarHBondContact SG-O 2.9Å; C81-C124 CovalentContact SG-SG 2.04Å; C81-C124 PolarHBondContact SG-SG 2.77Å; E84-C124 VanDerWaalsContact CD-SG 3.51Å; E84-C124 PolarHBondContact OE2-SG 2.95Å; R120-C124 WeakPolarHBondContact O-CB 3.38Å; R120-C124 PolarHBondContact O-N 2.51Å; R121-C124 PolarHBondContact O-N 3.25Å; C124-T126 VanDerWaalsContact C-N 3.32Å; C124-T126 PolarHBondContact O-N 3.23Å; C124-Q127 PolarHBondContact O-N 3.43Å; C124-C128 WeakPolarHBondContact O-CB 3.46Å; C124-C128 PolarHBondContact O-N 3.37Å
125	L	84.3	Confident	81.8	Confident	37 Å²	37	68.1 Å²	68.1	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-44	179.1	-72	171.1	0	0	0	111.2	C77 C81 R121 A122 D123 C128 A129 Q258	C77-L125 HydrophobicContact CB-CD2 4.29Å; C81-L125 HydrophobicContact CB-CD2 4.05Å; C81-L125 HydrophobicContact CB-CG 4.27Å; C81-L125 PolarHBondContact SG-N 2.63Å; C81-L125 VanDerWaalsContact SG-N 3.42Å; R121-L125 HydrophobicContact CG-CD1 4.17Å; R121-L125 VanDerWaalsContact O-CG 3.27Å; R121-L125 WeakPolarHBondContact O-CG 3.39Å; R121-L125 PolarHBondContact O-N 3.47Å; A122-L125 PolarHBondContact O-N 3.49Å; D123-L125 PolarHBondContact O-N 3.06Å; L125-C128 PolarHBondContact O-N 3.48Å; L125-A129 VanDerWaalsContact O-CB 3.28Å; L125-A129 WeakPolarHBondContact O-CB 3.15Å; L125-A129 PolarHBondContact O-N 3.04Å; L125-Q258 HydrophobicContact CD1-CB 4.37Å
126	T	83.3	Confident	81.1	Confident	97 Å²	97	68.2 Å²	68.2	60%	0.595	36%	0.362	S	S	*	.	H	α-helix	trans	-61.7	-47.9	178.4	-57.9	0	0	0	0	111.2	A122 D123 C124 A130	A122-T126 WeakPolarHBondContact O-CB 3.45Å; A122-T126 PolarHBondContact O-N 2.77Å; A122-T126 PolarHBondContact O-OG1 3.28Å; D123-T126 PolarHBondContact O-N 2.99Å; C124-T126 VanDerWaalsContact C-N 3.32Å; C124-T126 PolarHBondContact O-N 3.23Å; T126-A130 WeakPolarHBondContact O-CB 3.38Å; T126-A130 PolarHBondContact O-N 3.24Å
127	Q	87.1	Confident	80.3	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	34%	0.339	S	S	.	.	H	α-helix	trans	-67.6	-43	179.2	-69.6	-177.4	34.7	0	0	112.4	D123 C124 A129 A130 R131	D123-Q127 WeakPolarHBondContact O-CB 3.36Å; D123-Q127 WeakPolarHBondContact O-CG 3.46Å; D123-Q127 PolarHBondContact O-N 3.29Å; D123-Q127 PolarHBondContact OD1-NE2 2.89Å; D123-Q127 PolarHBondContact OD2-NE2 3.22Å; C124-Q127 PolarHBondContact O-N 3.43Å; Q127-A129 VanDerWaalsContact C-N 3.34Å; Q127-A129 PolarHBondContact O-N 3.04Å; Q127-A130 PolarHBondContact O-N 3.34Å; Q127-R131 VanDerWaalsContact O-CG 3.28Å; Q127-R131 WeakPolarHBondContact O-CG 3.49Å; Q127-R131 PolarHBondContact O-N 3.05Å; Q127-R131 VanDerWaalsContact OE1-NH2 3.15Å
128	C	88.2	Confident	79.5	Confident	16 Å²	16	63.5 Å²	63.5	11%	0.108	36%	0.355	C	S	.	.	H	α-helix	trans	-61.3	-45.9	178.5	-179.9	0	0	0	0	110.9	C77 C124 L125 A130 R131 R132	C77-C128 WeakPolarHBondContact CA-SG 3.37Å; C77-C128 HydrophobicContact CB-CB 3.7Å; C77-C128 WeakPolarHBondContact CB-SG 3.41Å; C77-C128 WeakPolarHBondContact SG-CB 3.48Å; C77-C128 CovalentContact SG-SG 2.04Å; C77-C128 PolarHBondContact SG-SG 3.16Å; C124-C128 WeakPolarHBondContact O-CB 3.46Å; C124-C128 PolarHBondContact O-N 3.37Å; L125-C128 PolarHBondContact O-N 3.48Å; C128-A130 PolarHBondContact O-N 3.18Å; C128-R131 PolarHBondContact O-N 2.88Å; C128-R132 PolarHBondContact O-N 2.66Å
129	A	82.9	Confident	78.7	Confident	15 Å²	15	65.1 Å²	65.1	12%	0.124	37%	0.368	C	S	.	.	H	α-helix	trans	-65.1	-40.7	177.6	0	0	0	0	0	111.5	L125 Q127 R131 R132 L133 A138	L125-A129 VanDerWaalsContact O-CB 3.28Å; L125-A129 WeakPolarHBondContact O-CB 3.15Å; L125-A129 PolarHBondContact O-N 3.04Å; Q127-A129 VanDerWaalsContact C-N 3.34Å; Q127-A129 PolarHBondContact O-N 3.04Å; A129-R131 PolarHBondContact O-N 3.32Å; A129-R132 PolarHBondContact O-N 3.43Å; A129-L133 HydrophobicContact CB-CD1 4.37Å; A129-L133 VanDerWaalsContact O-CB 3.28Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 PolarHBondContact O-N 2.79Å; A129-A138 HydrophobicContact CB-CB 3.77Å
130	A	83.6	Confident	77.9	Confident	39 Å²	39	68 Å²	68	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-36.2	175.1	0	0	0	0	0	113.2	T126 Q127 C128 G134	T126-A130 WeakPolarHBondContact O-CB 3.38Å; T126-A130 PolarHBondContact O-N 3.24Å; Q127-A130 PolarHBondContact O-N 3.34Å; C128-A130 PolarHBondContact O-N 3.18Å; A130-G134 CarbonylContact O-C 3.13Å; A130-G134 WeakPolarHBondContact O-CA 3.33Å; A130-G134 PolarHBondContact O-N 2.94Å
131	R	85.9	Confident	76.9	Confident	194 Å²	194	62 Å²	62	73%	0.732	35%	0.348	S	S	*	.	H	α-helix	trans	-68.3	-39	176.1	-72.6	174.5	-163.6	173	9.2	112.2	Q127 C128 A129	Q127-R131 VanDerWaalsContact O-CG 3.28Å; Q127-R131 WeakPolarHBondContact O-CG 3.49Å; Q127-R131 PolarHBondContact O-N 3.05Å; Q127-R131 VanDerWaalsContact OE1-NH2 3.15Å; C128-R131 PolarHBondContact O-N 2.88Å; A129-R131 PolarHBondContact O-N 3.32Å
132	R	84.1	Confident	76.1	Confident	128 Å²	128	64.9 Å²	64.9	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-86.9	-30.8	-175.3	-68.9	-174.3	174.6	-128.6	11	114	V73 D76 C128 A129	V73-R132 HydrophobicContact CG1-CB 3.82Å; V73-R132 HydrophobicContact CG2-CB 4.07Å; D76-R132 IonicContact OD2-CZ 3.65Å; D76-R132 IonicContact OD2-NH1 2.76Å; D76-R132 PolarHBondContact OD2-NH1 2.9Å; D76-R132 IonicContact OD2-NH2 3.15Å; C128-R132 PolarHBondContact O-N 2.66Å; A129-R132 PolarHBondContact O-N 3.43Å
133	L	79.6	Confident	75.3	Confident	19 Å²	19	62.8 Å²	62.8	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-111.3	-3.6	-175.4	-55.6	166.4	0	0	0	112.9	P34 L70 V73 A129 A138 L141	P34-L133 HydrophobicContact CG-CD2 3.47Å; P34-L133 VanDerWaalsContact CG-CD2 3.47Å; L70-L133 HydrophobicContact CD1-CD1 3.8Å; V73-L133 HydrophobicContact CB-CD1 4.46Å; V73-L133 HydrophobicContact CB-CD2 4.21Å; V73-L133 HydrophobicContact CB-CG 4.43Å; V73-L133 HydrophobicContact CG1-CD1 3.87Å; V73-L133 HydrophobicContact CG1-CD2 4.22Å; V73-L133 HydrophobicContact CG1-CG 3.9Å; V73-L133 HydrophobicContact CG2-CD2 3.85Å; V73-L133 HydrophobicContact CG2-CG 4.39Å; A129-L133 HydrophobicContact CB-CD1 4.37Å; A129-L133 VanDerWaalsContact O-CB 3.28Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 PolarHBondContact O-N 2.79Å; L133-A138 HydrophobicContact CD1-CB 4.3Å; L133-L141 HydrophobicContact CB-CD1 4.33Å; L133-L141 HydrophobicContact CD1-CD1 4.1Å; L133-L141 HydrophobicContact CD2-CD1 3.78Å; L133-L141 HydrophobicContact CG-CD1 4.28Å
134	G	75.4	Confident	74.5	Confident	25 Å²	25	60.5 Å²	60.5	26%	0.258	34%	0.338	S	S	.	.			trans	84.2	168.6	-173.1	0	0	0	0	0	113.8	A130 G136 G137	A130-G134 CarbonylContact O-C 3.13Å; A130-G134 WeakPolarHBondContact O-CA 3.33Å; A130-G134 PolarHBondContact O-N 2.94Å; G134-G136 PolarHBondContact O-N 3.33Å; G134-G137 PolarHBondContact O-N 2.87Å
135	P	63.5	Low	73.5	Confident	114 Å²	114	68 Å²	68	74%	0.74	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	124.2	-179.8	-24.4	34.1	0	0	0	112.4	G137	P135-G137 PolarHBondContact O-N 3.46Å
136	G	63.3	Low	72.8	Confident	40 Å²	40	72 Å²	72	41%	0.412	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	3.3	-176.4	0	0	0	0	0	114.7	G134 A138 A139 R140	G134-G136 PolarHBondContact O-N 3.33Å; G136-A138 PolarHBondContact O-N 2.8Å; G136-A139 PolarHBondContact O-N 3.36Å; G136-A139 VanDerWaalsContact O-N 3.17Å; G136-R140 WeakPolarHBondContact O-CB 3.3Å; G136-R140 VanDerWaalsContact O-CG 3.25Å; G136-R140 WeakPolarHBondContact O-CG 3.44Å; G136-R140 PolarHBondContact O-N 3.32Å
137	G	65.9	Low	72.3	Confident	6 Å²	6	68.4 Å²	68.4	6%	0.062	37%	0.368	C	S	.	.	H	α-helix	trans	-56.6	-50	-177.3	0	0	0	0	0	113	G134 P135 A139 R140 L141	G134-G137 PolarHBondContact O-N 2.87Å; P135-G137 PolarHBondContact O-N 3.46Å; G137-A139 VanDerWaalsContact C-N 3.25Å; G137-A139 PolarHBondContact O-N 3.36Å; G137-R140 PolarHBondContact O-N 2.97Å; G137-R140 VanDerWaalsContact O-N 3.12Å; G137-L141 WeakPolarHBondContact O-CB 3.15Å; G137-L141 WeakPolarHBondContact O-CG 3.39Å; G137-L141 PolarHBondContact O-N 2.94Å
138	A	61.3	Low	71.8	Confident	42 Å²	42	67.4 Å²	67.4	35%	0.347	36%	0.361	S	S	.	.	H	α-helix	trans	-59	-34.5	178	0	0	0	0	0	114	A129 L133 G136	A129-A138 HydrophobicContact CB-CB 3.77Å; L133-A138 HydrophobicContact CD1-CB 4.3Å; G136-A138 PolarHBondContact O-N 2.8Å
139	A	62.2	Low	71.1	Confident	78 Å²	78	69.6 Å²	69.6	65%	0.645	37%	0.371	S	S	*	.	H	α-helix	trans	-77	-37.2	176.6	0	0	0	0	0	112.2	G136 G137 R142	G136-A139 PolarHBondContact O-N 3.36Å; G136-A139 VanDerWaalsContact O-N 3.17Å; G137-A139 VanDerWaalsContact C-N 3.25Å; G137-A139 PolarHBondContact O-N 3.36Å; A139-R142 VanDerWaalsContact O-CB 3.31Å; A139-R142 WeakPolarHBondContact O-CB 3.41Å; A139-R142 PolarHBondContact O-N 3.3Å
140	R	62.5	Low	70.9	Confident	185 Å²	185	69.9 Å²	69.9	70%	0.698	37%	0.374	S	S	*	.	H	α-helix	trans	-74.1	-27.8	178.3	-72.2	172.8	-179.4	-178.7	0.5	113.7	A36 G136 G137 R142	A36-R140 WeakPolarHBondContact CB-O 3.26Å; G136-R140 WeakPolarHBondContact O-CB 3.3Å; G136-R140 VanDerWaalsContact O-CG 3.25Å; G136-R140 WeakPolarHBondContact O-CG 3.44Å; G136-R140 PolarHBondContact O-N 3.32Å; G137-R140 PolarHBondContact O-N 2.97Å; G137-R140 VanDerWaalsContact O-N 3.12Å; R140-R142 VanDerWaalsContact C-N 3.27Å
141	L	63.9	Low	71.1	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.026	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	11	177.3	-57	179.7	0	0	0	111.8	P34 Q35 A36 L70 L133 G137 V143	P34-L141 HydrophobicContact CB-CD1 4.28Å; P34-L141 HydrophobicContact CG-CD1 4.01Å; Q35-L141 WeakPolarHBondContact O-CD2 3.21Å; A36-L141 VanDerWaalsContact CA-CD2 3.45Å; A36-L141 HydrophobicContact CB-CD2 4.31Å; A36-L141 VanDerWaalsContact N-CD2 3.26Å; L70-L141 HydrophobicContact CD1-CB 4.11Å; L70-L141 HydrophobicContact CD1-CD1 4.13Å; L70-L141 HydrophobicContact CD2-CB 4.05Å; L70-L141 VanDerWaalsContact CD2-O 3.26Å; L70-L141 WeakPolarHBondContact CD2-O 3.26Å; L133-L141 HydrophobicContact CB-CD1 4.33Å; L133-L141 HydrophobicContact CD1-CD1 4.1Å; L133-L141 HydrophobicContact CD2-CD1 3.78Å; L133-L141 HydrophobicContact CG-CD1 4.28Å; G137-L141 WeakPolarHBondContact O-CB 3.15Å; G137-L141 WeakPolarHBondContact O-CG 3.39Å; G137-L141 PolarHBondContact O-N 2.94Å; L141-V143 PolarHBondContact O-N 3.4Å
142	R	65.7	Low	70.8	Confident	98 Å²	98	66.2 Å²	66.2	37%	0.37	35%	0.352	S	S	.	.			trans	-69.2	113.9	-179.6	-166.8	178	-161.9	170.7	-1.2	109.3	A139 R140 P260 E261	A139-R142 VanDerWaalsContact O-CB 3.31Å; A139-R142 WeakPolarHBondContact O-CB 3.41Å; A139-R142 PolarHBondContact O-N 3.3Å; R140-R142 VanDerWaalsContact C-N 3.27Å; R142-P260 PolarHBondContact NH2-O 3.29Å; R142-E261 PolarHBondContact NH2-O 3.44Å
143	V	65.7	Low	70.6	Confident	6 Å²	6	67.5 Å²	67.5	4%	0.036	36%	0.357	C	S	.	.			trans	-90.8	124.8	178.6	-177.4	0	0	0	0	108.5	P37 L141 L147 R148	P37-V143 HydrophobicContact CB-CG2 4.04Å; P37-V143 HydrophobicContact CG-CG2 3.98Å; L141-V143 PolarHBondContact O-N 3.4Å; V143-L147 HydrophobicContact CG1-CB 3.64Å; V143-L147 HydrophobicContact CG1-CD2 3.71Å; V143-L147 HydrophobicContact CG1-CG 3.62Å; V143-R148 HydrophobicContact CB-CG 4.13Å; V143-R148 HydrophobicContact CG1-CB 4.44Å; V143-R148 HydrophobicContact CG1-CG 3.8Å; V143-R148 PolarHBondContact O-NE 3.09Å; V143-R148 PolarHBondContact O-NH2 3.49Å
144	G	67.5	Low	71	Confident	40 Å²	40	67.1 Å²	67.1	41%	0.412	35%	0.354	S	S	.	.			trans	-59.2	163	174	0	0	0	0	0	112.8	L147 R148	G144-L147 PolarHBondContact O-N 2.79Å; G144-R148 PolarHBondContact O-N 2.59Å
145	R	68.3	Low	71.7	Confident	167 Å²	167	67.9 Å²	67.9	63%	0.63	35%	0.35	S	S	*	.	H	α-helix	trans	-58.5	-50	-179.1	-167.5	-171.5	-150.9	-156.2	13.3	112.1	L147 R148 D149	R145-L147 PolarHBondContact O-N 3.43Å; R145-R148 WeakPolarHBondContact O-CB 3.38Å; R145-R148 PolarHBondContact O-N 3.08Å; R145-D149 PolarHBondContact O-N 3.41Å
146	T	68.3	Low	73.1	Confident	121 Å²	121	62.4 Å²	62.4	74%	0.742	32%	0.315	S	S	*	.	H	α-helix	trans	-52.7	-43	178.2	48	0	0	0	0	112.5	D149 A150	T146-D149 PolarHBondContact O-N 3.44Å; T146-A150 PolarHBondContact O-N 3.4Å
147	L	74.1	Confident	74.5	Confident	22 Å²	22	61.5 Å²	61.5	12%	0.115	30%	0.299	C	S	.	.	H	α-helix	trans	-74.4	-40.2	179.3	-174.1	60.9	0	0	0	111.7	D38 Y41 V143 G144 R145 D149 A150 F151	D38-L147 HydrophobicContact CB-CD2 3.39Å; Y41-L147 HydrophobicContact CD1-CD1 3.33Å; Y41-L147 HydrophobicContact CE1-CD1 3.62Å; Y41-L147 HydrophobicContact CG-CD1 3.88Å; V143-L147 HydrophobicContact CG1-CB 3.64Å; V143-L147 HydrophobicContact CG1-CD2 3.71Å; V143-L147 HydrophobicContact CG1-CG 3.62Å; G144-L147 PolarHBondContact O-N 2.79Å; R145-L147 PolarHBondContact O-N 3.43Å; L147-D149 PolarHBondContact O-N 3.09Å; L147-A150 HydrophobicContact CD1-CB 4.38Å; L147-A150 WeakPolarHBondContact O-CB 3.35Å; L147-A150 PolarHBondContact O-N 3.03Å; L147-A150 VanDerWaalsContact O-N 3.1Å; L147-F151 HydrophobicContact CD1-CD2 3.88Å; L147-F151 HydrophobicContact CD1-CE2 3.64Å; L147-F151 HydrophobicContact CD2-CE2 4.23Å; L147-F151 HydrophobicContact CG-CD2 3.92Å; L147-F151 HydrophobicContact CG-CE2 3.78Å; L147-F151 VanDerWaalsContact O-CD2 3.3Å; L147-F151 WeakPolarHBondContact O-CD2 3.09Å; L147-F151 PolarHBondContact O-N 2.65Å
148	R	76.8	Confident	75.6	Confident	56 Å²	56	62.7 Å²	62.7	21%	0.211	30%	0.304	C	S	.	.	H	α-helix	trans	-57.2	-41.1	171.8	-95.3	175.5	-69.5	-176	3.9	112	V143 G144 R145 A150 F151 R152 E262	V143-R148 HydrophobicContact CB-CG 4.13Å; V143-R148 HydrophobicContact CG1-CB 4.44Å; V143-R148 HydrophobicContact CG1-CG 3.8Å; V143-R148 PolarHBondContact O-NE 3.09Å; V143-R148 PolarHBondContact O-NH2 3.49Å; G144-R148 PolarHBondContact O-N 2.59Å; R145-R148 WeakPolarHBondContact O-CB 3.38Å; R145-R148 PolarHBondContact O-N 3.08Å; R148-A150 VanDerWaalsContact C-N 3.34Å; R148-F151 PolarHBondContact O-N 2.96Å; R148-R152 WeakPolarHBondContact O-CB 3.4Å; R148-R152 WeakPolarHBondContact O-CG 3.28Å; R148-R152 PolarHBondContact O-N 3.08Å; R148-E262 IonicContact CZ-OE1 3.28Å; R148-E262 IonicContact CZ-OE2 3.19Å; R148-E262 IonicContact NH1-OE1 3.19Å; R148-E262 PolarHBondContact NH1-OE1 2.96Å; R148-E262 IonicContact NH1-OE2 2.6Å; R148-E262 IonicContact NH2-OE1 2.92Å; R148-E262 PolarHBondContact NH2-OE1 3.47Å; R148-E262 IonicContact NH2-OE2 2.63Å; R148-E262 PolarHBondContact NH2-OE2 3.21Å
149	D	71.9	Confident	77.1	Confident	62 Å²	62	63.5 Å²	63.5	33%	0.332	30%	0.299	S	S	.	.	H	α-helix	trans	-64.4	-39.3	176.2	-66.9	-26.4	0	0	0	111.6	R145 T146 L147 F151 R152 R153	R145-D149 PolarHBondContact O-N 3.41Å; T146-D149 PolarHBondContact O-N 3.44Å; L147-D149 PolarHBondContact O-N 3.09Å; D149-F151 PolarHBondContact O-N 3.06Å; D149-R152 PolarHBondContact O-N 2.8Å; D149-R153 WeakPolarHBondContact O-CB 3.3Å; D149-R153 VanDerWaalsContact O-CG 3.3Å; D149-R153 WeakPolarHBondContact O-CG 3.42Å; D149-R153 PolarHBondContact O-N 3.06Å
150	A	80.1	Confident	78.6	Confident	21 Å²	21	59.9 Å²	59.9	17%	0.174	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-43.5	174.1	0	0	0	0	0	112.1	T146 L147 R148 R153 R154 E155	T146-A150 PolarHBondContact O-N 3.4Å; L147-A150 HydrophobicContact CD1-CB 4.38Å; L147-A150 WeakPolarHBondContact O-CB 3.35Å; L147-A150 PolarHBondContact O-N 3.03Å; L147-A150 VanDerWaalsContact O-N 3.1Å; R148-A150 VanDerWaalsContact C-N 3.34Å; A150-R153 CarbonylContact O-C 3.47Å; A150-R153 PolarHBondContact O-N 3.36Å; A150-R154 PolarHBondContact O-N 3.04Å; A150-R154 VanDerWaalsContact O-N 3.14Å; A150-E155 HydrophobicContact CB-CB 4.03Å; A150-E155 WeakPolarHBondContact O-CB 3.41Å; A150-E155 PolarHBondContact O-N 3.18Å
151	F	86.6	Confident	80.1	Confident	7 Å²	7	51.3 Å²	51.3	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-40	175.4	-82.6	-92.7	0	0	0	112.5	Y41 A63 L64 Q67 L147 R148 D149 R153 R154 P156	Y41-F151 HydrophobicContact CD2-CE2 4.29Å; Y41-F151 HydrophobicContact CD2-CZ 4.24Å; Y41-F151 HydrophobicContact CG-CE2 4.3Å; Y41-F151 HydrophobicContact CG-CZ 4.5Å; A63-F151 HydrophobicContact CB-CE1 4.37Å; A63-F151 HydrophobicContact CB-CZ 3.88Å; L64-F151 HydrophobicContact CD2-CD1 3.74Å; L64-F151 HydrophobicContact CD2-CE1 3.74Å; L64-F151 HydrophobicContact CG-CE1 4.12Å; Q67-F151 VanDerWaalsContact NE2-CB 3.28Å; Q67-F151 VanDerWaalsContact OE1-CB 3.3Å; L147-F151 HydrophobicContact CD1-CD2 3.88Å; L147-F151 HydrophobicContact CD1-CE2 3.64Å; L147-F151 HydrophobicContact CD2-CE2 4.23Å; L147-F151 HydrophobicContact CG-CD2 3.92Å; L147-F151 HydrophobicContact CG-CE2 3.78Å; L147-F151 VanDerWaalsContact O-CD2 3.3Å; L147-F151 WeakPolarHBondContact O-CD2 3.09Å; L147-F151 PolarHBondContact O-N 2.65Å; R148-F151 PolarHBondContact O-N 2.96Å; D149-F151 PolarHBondContact O-N 3.06Å; F151-R153 VanDerWaalsContact C-N 3.28Å; F151-R153 PolarHBondContact O-N 3.24Å; F151-R154 WeakPolarHBondContact O-CA 3.3Å; F151-R154 PolarHBondContact O-N 2.88Å; F151-P156 HydrophobicContact CD1-CG 3.76Å; F151-P156 HydrophobicContact CE1-CG 3.72Å; F151-P156 HydrophobicContact CG-CG 4.27Å; F151-P156 HydrophobicContact CZ-CG 4.15Å
152	R	80.6	Confident	81.3	Confident	149 Å²	149	57.2 Å²	57.2	56%	0.562	26%	0.259	S	S	*	.	H	α-helix	trans	-59.7	-38.7	173.1	-76.8	176.1	171.3	-151.2	-10.8	112	R148 D149 R154 E300	R148-R152 WeakPolarHBondContact O-CB 3.4Å; R148-R152 WeakPolarHBondContact O-CG 3.28Å; R148-R152 PolarHBondContact O-N 3.08Å; D149-R152 PolarHBondContact O-N 2.8Å; R152-R154 PolarHBondContact O-N 3Å; R152-E300 IonicContact CZ-OE1 3.73Å; R152-E300 VanDerWaalsContact CZ-OE1 3.31Å; R152-E300 IonicContact CZ-OE2 2.69Å; R152-E300 IonicContact NH1-OE1 3.82Å; R152-E300 PolarHBondContact NH1-OE1 2.89Å; R152-E300 IonicContact NH1-OE2 3.53Å; R152-E300 VanDerWaalsContact NH2-CD 3.31Å; R152-E300 IonicContact NH2-OE1 2.92Å; R152-E300 PolarHBondContact NH2-OE1 3.03Å; R152-E300 IonicContact NH2-OE2 3Å; R152-E300 PolarHBondContact NH2-OE2 3.33Å
153	R	79	Confident	82.6	Confident	155 Å²	155	52.6 Å²	52.6	59%	0.585	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	4.7	172.6	-67.4	175.9	-176.9	-90.9	0.6	113.2	D149 A150 F151 E155 N184	D149-R153 WeakPolarHBondContact O-CB 3.3Å; D149-R153 VanDerWaalsContact O-CG 3.3Å; D149-R153 WeakPolarHBondContact O-CG 3.42Å; D149-R153 PolarHBondContact O-N 3.06Å; A150-R153 CarbonylContact O-C 3.47Å; A150-R153 PolarHBondContact O-N 3.36Å; F151-R153 VanDerWaalsContact C-N 3.28Å; F151-R153 PolarHBondContact O-N 3.24Å; R153-E155 PolarHBondContact O-N 3.44Å; R153-E155 VanDerWaalsContact O-N 3.16Å; R153-N184 PolarHBondContact O-ND2 3.47Å
154	R	88.9	Confident	83.9	Confident	10 Å²	10	53 Å²	53	4%	0.038	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	26.7	179	-56.7	-176.1	178.4	170.8	-9.4	113.8	A150 F151 R152 P156 Y157 T179 F180 A183 D210 E212	A150-R154 PolarHBondContact O-N 3.04Å; A150-R154 VanDerWaalsContact O-N 3.14Å; F151-R154 WeakPolarHBondContact O-CA 3.3Å; F151-R154 PolarHBondContact O-N 2.88Å; R152-R154 PolarHBondContact O-N 3Å; R154-P156 VanDerWaalsContact C-N 3.32Å; R154-Y157 HydrophobicContact CB-CD2 3.89Å; R154-Y157 WeakPolarHBondContact O-CB 3.43Å; R154-Y157 WeakPolarHBondContact O-CD2 3.5Å; R154-Y157 PolarHBondContact O-N 3.01Å; R154-T179 WeakPolarHBondContact CD-O 3.42Å; R154-T179 PolarHBondContact NH1-O 3.08Å; R154-F180 WeakPolarHBondContact O-CD2 3.49Å; R154-A183 HydrophobicContact CB-CB 4.1Å; R154-A183 HydrophobicContact CG-CB 3.8Å; R154-D210 IonicContact CZ-OD1 2.67Å; R154-D210 IonicContact CZ-OD2 2.69Å; R154-D210 VanDerWaalsContact CZ-OD2 3.23Å; R154-D210 IonicContact NH1-OD1 3.52Å; R154-D210 PolarHBondContact NH1-OD1 3.25Å; R154-D210 IonicContact NH1-OD2 3.08Å; R154-D210 PolarHBondContact NH1-OD2 3.48Å; R154-D210 IonicContact NH2-OD1 2.68Å; R154-D210 IonicContact NH2-OD2 3.65Å; R154-D210 PolarHBondContact NH2-OD2 2.83Å; R154-E212 IonicContact NE-OE2 3.82Å; R154-E212 PolarHBondContact NH2-O 3.23Å
155	E	89.3	Confident	85.1	Confident	41 Å²	41	54.7 Å²	54.7	19%	0.192	24%	0.237	C	C	.	.	H	α-helix	trans	-53.8	-35.9	-178.2	-169.6	60.9	-146.7	0	0	114.4	Y41 A150 R153 Y157 N158 Y159 F180	Y41-E155 WeakPolarHBondContact OH-CG 3.38Å; A150-E155 HydrophobicContact CB-CB 4.03Å; A150-E155 WeakPolarHBondContact O-CB 3.41Å; A150-E155 PolarHBondContact O-N 3.18Å; R153-E155 PolarHBondContact O-N 3.44Å; R153-E155 VanDerWaalsContact O-N 3.16Å; E155-Y157 PolarHBondContact O-N 3.42Å; E155-N158 VanDerWaalsContact O-CB 3.23Å; E155-N158 WeakPolarHBondContact O-CB 3.44Å; E155-N158 PolarHBondContact O-N 3.27Å; E155-N158 PolarHBondContact OE1-ND2 3.11Å; E155-Y159 HydrophobicContact CG-CE2 3.88Å; E155-Y159 WeakPolarHBondContact O-CD2 3.36Å; E155-F180 WeakPolarHBondContact OE2-CE2 3.46Å
156	P	93.4	Very high	86.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-52.4	-31.3	173.2	-27.9	35.4	0	0	0	113.9	Y41 L64 F151 R154 Y159 L160	Y41-P156 HydrophobicContact CD2-CG 4.16Å; Y41-P156 HydrophobicContact CE2-CB 4.32Å; Y41-P156 HydrophobicContact CE2-CG 3.83Å; L64-P156 HydrophobicContact CD1-CB 4.18Å; L64-P156 HydrophobicContact CD2-CB 4.12Å; L64-P156 HydrophobicContact CD2-CG 4.06Å; L64-P156 HydrophobicContact CG-CB 4.18Å; L64-P156 HydrophobicContact CG-CG 4.48Å; F151-P156 HydrophobicContact CD1-CG 3.76Å; F151-P156 HydrophobicContact CE1-CG 3.72Å; F151-P156 HydrophobicContact CG-CG 4.27Å; F151-P156 HydrophobicContact CZ-CG 4.15Å; R154-P156 VanDerWaalsContact C-N 3.32Å; P156-Y159 PolarHBondContact O-N 3.45Å; P156-L160 WeakPolarHBondContact O-CB 3.42Å; P156-L160 VanDerWaalsContact O-CG 3.29Å; P156-L160 WeakPolarHBondContact O-CG 3.24Å; P156-L160 PolarHBondContact O-N 3.34Å
157	Y	92.9	Very high	87.3	Confident	20 Å²	20	47.7 Å²	47.7	8%	0.078	20%	0.204	C	C	.	.	H	α-helix	trans	-73.1	-27.1	179.4	-66.8	-85.2	0	0	0	113.7	L64 R154 E155 Y159 L160 Q161 A176 T179 L211 E212	L64-Y157 HydrophobicContact CD1-CE1 4.32Å; L64-Y157 HydrophobicContact CD1-CE2 3.94Å; L64-Y157 HydrophobicContact CD2-CE2 3.89Å; R154-Y157 HydrophobicContact CB-CD2 3.89Å; R154-Y157 WeakPolarHBondContact O-CB 3.43Å; R154-Y157 WeakPolarHBondContact O-CD2 3.5Å; R154-Y157 PolarHBondContact O-N 3.01Å; E155-Y157 PolarHBondContact O-N 3.42Å; Y157-Y159 VanDerWaalsContact C-N 3.26Å; Y157-Y159 PolarHBondContact O-N 3.04Å; Y157-L160 HydrophobicContact CD1-CD1 4.13Å; Y157-L160 HydrophobicContact CE1-CD1 4.36Å; Y157-L160 PolarHBondContact O-N 3.06Å; Y157-Q161 WeakPolarHBondContact O-CB 3.29Å; Y157-Q161 WeakPolarHBondContact O-CG 3.42Å; Y157-Q161 PolarHBondContact O-N 3.38Å; Y157-A176 WeakPolarHBondContact CB-O 3.45Å; Y157-A176 HydrophobicContact CD1-CB 3.99Å; Y157-T179 HydrophobicContact CD1-CG2 3.73Å; Y157-T179 HydrophobicContact CD2-CG2 3.68Å; Y157-T179 HydrophobicContact CE1-CG2 3.76Å; Y157-T179 HydrophobicContact CE2-CG2 3.73Å; Y157-T179 HydrophobicContact CG-CG2 3.67Å; Y157-L211 HydrophobicContact CD1-CD1 4.4Å; Y157-L211 HydrophobicContact CE1-CB 4.19Å; Y157-L211 HydrophobicContact CE1-CD1 3.82Å; Y157-E212 HydrophobicContact CE2-CG 3.89Å; Y157-E212 WeakPolarHBondContact CE2-OE1 3.18Å; Y157-E212 VanDerWaalsContact OH-CG 3.27Å; Y157-E212 WeakPolarHBondContact OH-CG 3.35Å; Y157-E212 PolarHBondContact OH-OE1 2.9Å; Y157-E212 VanDerWaalsContact OH-OE1 3.1Å
158	N	88.4	Confident	88.2	Confident	31 Å²	31	55.6 Å²	55.6	17%	0.166	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-36.9	171.5	-172.9	25.1	0	0	0	111.6	E155 Q161 F180	E155-N158 VanDerWaalsContact O-CB 3.23Å; E155-N158 WeakPolarHBondContact O-CB 3.44Å; E155-N158 PolarHBondContact O-N 3.27Å; E155-N158 PolarHBondContact OE1-ND2 3.11Å; N158-Q161 VanDerWaalsContact O-CG 3.28Å; N158-Q161 WeakPolarHBondContact O-CG 3Å; N158-F180 HydrophobicContact CB-CD1 4.34Å; N158-F180 HydrophobicContact CB-CD2 3.83Å; N158-F180 HydrophobicContact CB-CE1 4.28Å; N158-F180 HydrophobicContact CB-CE2 3.78Å; N158-F180 HydrophobicContact CB-CG 4.1Å; N158-F180 HydrophobicContact CB-CZ 3.99Å
159	Y	92.3	Very high	88.9	Confident	59 Å²	59	55.4 Å²	55.4	23%	0.231	24%	0.238	C	C	.	.	H	α-helix	trans	-81.4	-42	174.8	-61.1	-78.2	0	0	0	112.3	Y41 L45 Y48 E155 P156 Y157 Q161 R162 A163	Y41-Y159 WeakPolarHBondContact OH-CE2 3.47Å; L45-Y159 HydrophobicContact CD2-CD1 3.72Å; L45-Y159 HydrophobicContact CD2-CD2 3.54Å; L45-Y159 HydrophobicContact CD2-CE1 3.69Å; L45-Y159 HydrophobicContact CD2-CE2 3.5Å; L45-Y159 HydrophobicContact CD2-CG 3.65Å; Y48-Y159 AromaticContact CD1-CD1 3.86Å; Y48-Y159 HydrophobicContact CD1-CD1 3.86Å; Y48-Y159 HydrophobicContact CD1-CE1 4.38Å; Y48-Y159 HydrophobicContact CD2-CD1 4.25Å; Y48-Y159 AromaticContact CE1-CD1 3.78Å; Y48-Y159 HydrophobicContact CE1-CD1 3.78Å; Y48-Y159 HydrophobicContact CE1-CE1 4.27Å; Y48-Y159 HydrophobicContact CE2-CD1 4.18Å; Y48-Y159 WeakPolarHBondContact CE2-O 3.28Å; Y48-Y159 HydrophobicContact CG-CD1 4.1Å; Y48-Y159 AromaticContact CZ-CD1 3.94Å; E155-Y159 HydrophobicContact CG-CE2 3.88Å; E155-Y159 WeakPolarHBondContact O-CD2 3.36Å; P156-Y159 PolarHBondContact O-N 3.45Å; Y157-Y159 VanDerWaalsContact C-N 3.26Å; Y157-Y159 PolarHBondContact O-N 3.04Å; Y159-Q161 VanDerWaalsContact C-N 3.34Å; Y159-Q161 PolarHBondContact O-N 3.12Å; Y159-R162 PolarHBondContact O-N 3.47Å; Y159-A163 PolarHBondContact O-N 3.5Å
160	L	95	Very high	89.7	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-41.1	-179.7	-75.9	168.8	0	0	0	112.1	V57 L60 R61 L64 P156 Y157 R162 A163 Y164 A176	V57-L160 HydrophobicContact CB-CD2 4.31Å; V57-L160 HydrophobicContact CG1-CD2 4.25Å; V57-L160 HydrophobicContact CG2-CD2 4.15Å; L60-L160 HydrophobicContact CB-CD1 4.47Å; L60-L160 HydrophobicContact CB-CD2 3.86Å; L60-L160 HydrophobicContact CB-CG 4.09Å; L60-L160 HydrophobicContact CD1-CD2 4.18Å; L60-L160 HydrophobicContact CD1-CG 4.16Å; R61-L160 HydrophobicContact CG-CD2 4.17Å; L64-L160 HydrophobicContact CD1-CD1 3.83Å; P156-L160 WeakPolarHBondContact O-CB 3.42Å; P156-L160 VanDerWaalsContact O-CG 3.29Å; P156-L160 WeakPolarHBondContact O-CG 3.24Å; P156-L160 PolarHBondContact O-N 3.34Å; Y157-L160 HydrophobicContact CD1-CD1 4.13Å; Y157-L160 HydrophobicContact CE1-CD1 4.36Å; Y157-L160 PolarHBondContact O-N 3.06Å; L160-R162 VanDerWaalsContact C-N 3.3Å; L160-R162 PolarHBondContact O-N 3.06Å; L160-A163 PolarHBondContact O-N 2.99Å; L160-Y164 HydrophobicContact CB-CD2 4.15Å; L160-Y164 HydrophobicContact CB-CE2 3.93Å; L160-Y164 HydrophobicContact CD2-CE2 4.17Å; L160-Y164 WeakPolarHBondContact O-CB 3.5Å; L160-Y164 WeakPolarHBondContact O-CD2 3.4Å; L160-Y164 PolarHBondContact O-N 3.14Å; L160-A176 HydrophobicContact CB-CB 4.15Å
161	Q	92.9	Very high	90.1	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.028	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-45.4	179.9	70	88.1	-3.5	0	0	111.6	Y157 N158 Y159 Y164 Y165 A173 A176 A177 M190 D193 Y197	Y157-Q161 WeakPolarHBondContact O-CB 3.29Å; Y157-Q161 WeakPolarHBondContact O-CG 3.42Å; Y157-Q161 PolarHBondContact O-N 3.38Å; N158-Q161 VanDerWaalsContact O-CG 3.28Å; N158-Q161 WeakPolarHBondContact O-CG 3Å; Y159-Q161 VanDerWaalsContact C-N 3.34Å; Y159-Q161 PolarHBondContact O-N 3.12Å; Q161-Y164 PolarHBondContact O-N 3.05Å; Q161-Y165 WeakPolarHBondContact O-CB 3.38Å; Q161-Y165 PolarHBondContact O-N 3.45Å; Q161-A173 WeakPolarHBondContact O-CB 3.18Å; Q161-A176 HydrophobicContact CB-CB 3.88Å; Q161-A177 HydrophobicContact CB-CB 4Å; Q161-A177 HydrophobicContact CG-CB 4.45Å; Q161-M190 HydrophobicContact CG-CE 3.9Å; Q161-D193 PolarHBondContact NE2-OD2 3.1Å; Q161-Y197 PolarHBondContact OE1-OH 3.2Å
162	R	89.9	Confident	90.3	Very high	129 Å²	129	58.2 Å²	58.2	49%	0.487	25%	0.25	S	S	.	.	H	α-helix	trans	-72.9	-38.4	-179	179.1	150.8	163	-170.8	3.8	111.5	Y48 Y159 L160 Y165 Q166	Y48-R162 HydrophobicContact CE2-CB 4.13Å; Y48-R162 HydrophobicContact CE2-CG 4.23Å; Y48-R162 WeakPolarHBondContact OH-CD 3.47Å; Y48-R162 WeakPolarHBondContact OH-CG 3.46Å; Y48-R162 PolarHBondContact OH-NE 3.3Å; Y159-R162 PolarHBondContact O-N 3.47Å; L160-R162 VanDerWaalsContact C-N 3.3Å; L160-R162 PolarHBondContact O-N 3.06Å; R162-Y165 WeakPolarHBondContact O-CB 3.47Å; R162-Y165 PolarHBondContact O-N 3.24Å; R162-Q166 VanDerWaalsContact O-CG 3.25Å; R162-Q166 WeakPolarHBondContact O-CG 3.46Å; R162-Q166 PolarHBondContact O-N 3.4Å
163	A	92.5	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-41.5	174.9	0	0	0	0	0	111.9	Y48 W53 V57 Y159 L160 Q166 L167	Y48-A163 HydrophobicContact CD2-CB 4.39Å; W53-A163 HydrophobicContact CE3-CB 4.07Å; V57-A163 HydrophobicContact CG2-CB 3.56Å; Y159-A163 PolarHBondContact O-N 3.5Å; L160-A163 PolarHBondContact O-N 2.99Å; A163-Q166 PolarHBondContact O-N 3Å; A163-L167 VanDerWaalsContact O-CG 3.3Å; A163-L167 WeakPolarHBondContact O-CG 3.5Å; A163-L167 PolarHBondContact O-N 3.21Å; A163-L167 VanDerWaalsContact O-N 3.08Å
164	Y	94	Very high	90.8	Very high	14 Å²	14	43.8 Å²	43.8	6%	0.055	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-39.8	173.9	-74.2	-49	0	0	0	112.7	L25 V57 R61 L160 Q161 Q166 L167 K168 K169 L172 A176	L25-Y164 HydrophobicContact CD1-CE1 4.3Å; L25-Y164 HydrophobicContact CD2-CE1 4.18Å; V57-Y164 HydrophobicContact CG1-CD1 4.37Å; V57-Y164 HydrophobicContact CG1-CE1 3.55Å; V57-Y164 HydrophobicContact CG2-CD1 4.15Å; V57-Y164 HydrophobicContact CG2-CE1 4.1Å; R61-Y164 WeakPolarHBondContact CD-OH 3.5Å; L160-Y164 HydrophobicContact CB-CD2 4.15Å; L160-Y164 HydrophobicContact CB-CE2 3.93Å; L160-Y164 HydrophobicContact CD2-CE2 4.17Å; L160-Y164 WeakPolarHBondContact O-CB 3.5Å; L160-Y164 WeakPolarHBondContact O-CD2 3.4Å; L160-Y164 PolarHBondContact O-N 3.14Å; Q161-Y164 PolarHBondContact O-N 3.05Å; Y164-Q166 PolarHBondContact O-N 3.27Å; Y164-L167 CarbonylContact O-C 3.57Å; Y164-L167 PolarHBondContact O-N 3.37Å; Y164-K168 PolarHBondContact O-N 3.06Å; Y164-K169 HydrophobicContact CD1-CB 4.27Å; Y164-K169 HydrophobicContact CD1-CD 4.36Å; Y164-K169 PolarHBondContact O-N 3.28Å; Y164-L172 HydrophobicContact CD1-CB 3.87Å; Y164-L172 HydrophobicContact CD1-CD1 4.06Å; Y164-L172 HydrophobicContact CD2-CB 3.75Å; Y164-L172 WeakPolarHBondContact CD2-O 3.3Å; Y164-L172 HydrophobicContact CE1-CB 4.05Å; Y164-L172 HydrophobicContact CE1-CD1 3.73Å; Y164-L172 HydrophobicContact CE2-CB 3.94Å; Y164-L172 HydrophobicContact CG-CB 3.72Å; Y164-A176 HydrophobicContact CD2-CB 4.19Å; Y164-A176 HydrophobicContact CE2-CB 4.38Å
165	Y	91.4	Very high	90.7	Very high	77 Å²	77	43.3 Å²	43.3	30%	0.302	19%	0.194	S	C	.	.	H	α-helix	trans	-58.8	-46.2	174.8	179.1	-104.4	0	0	0	111.8	Q161 R162 L167 K168 L170 K196 Y197 M200	Q161-Y165 WeakPolarHBondContact O-CB 3.38Å; Q161-Y165 PolarHBondContact O-N 3.45Å; R162-Y165 WeakPolarHBondContact O-CB 3.47Å; R162-Y165 PolarHBondContact O-N 3.24Å; Y165-L167 VanDerWaalsContact C-N 3.26Å; Y165-L167 PolarHBondContact O-N 3.37Å; Y165-K168 PolarHBondContact O-N 3.14Å; Y165-L170 HydrophobicContact CD2-CD2 3.78Å; Y165-L170 HydrophobicContact CE2-CD2 4.06Å; Y165-K196 PolarHBondContact OH-NZ 3.32Å; Y165-Y197 AromaticContact CD2-CE1 3.73Å; Y165-Y197 HydrophobicContact CD2-CE1 3.73Å; Y165-Y197 HydrophobicContact CE2-CE1 4.31Å; Y165-Y197 HydrophobicContact CG-CE1 4.43Å; Y165-M200 HydrophobicContact CE2-CE 3.49Å; Y165-M200 VanDerWaalsContact CE2-CE 3.49Å; Y165-M200 HydrophobicContact CE2-SD 4Å
166	Q	91.9	Very high	90.7	Very high	87 Å²	87	41.4 Å²	41.4	41%	0.407	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-30.8	177.4	-65.6	-70.2	-8.8	0	0	112.7	W53 R162 A163 Y164 K168	W53-Q166 HydrophobicContact CB-CB 4.44Å; W53-Q166 HydrophobicContact CD2-CB 3.61Å; W53-Q166 HydrophobicContact CD2-CG 3.78Å; W53-Q166 HydrophobicContact CE3-CB 4.29Å; W53-Q166 HydrophobicContact CE3-CG 4.14Å; W53-Q166 HydrophobicContact CG-CB 3.64Å; W53-Q166 HydrophobicContact CG-CG 4.35Å; W53-Q166 HydrophobicContact CH2-CG 4.05Å; W53-Q166 HydrophobicContact CZ2-CB 4.31Å; W53-Q166 HydrophobicContact CZ2-CG 3.66Å; W53-Q166 HydrophobicContact CZ3-CG 4.27Å; R162-Q166 VanDerWaalsContact O-CG 3.25Å; R162-Q166 WeakPolarHBondContact O-CG 3.46Å; R162-Q166 PolarHBondContact O-N 3.4Å; A163-Q166 PolarHBondContact O-N 3Å; Y164-Q166 PolarHBondContact O-N 3.27Å; Q166-K168 PolarHBondContact O-N 3.24Å
167	L	92.4	Very high	90.1	Very high	54 Å²	54	41.4 Å²	41.4	28%	0.283	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.3	173.2	-65.7	174	0	0	0	113.8	W53 A54 V57 A163 Y164 Y165 K169	W53-L167 HydrophobicContact CB-CD1 4.29Å; W53-L167 HydrophobicContact CB-CD2 3.91Å; W53-L167 HydrophobicContact CB-CG 3.86Å; A54-L167 HydrophobicContact CB-CD1 4.49Å; A54-L167 HydrophobicContact CB-CD2 4.28Å; V57-L167 HydrophobicContact CG2-CD1 3.95Å; A163-L167 VanDerWaalsContact O-CG 3.3Å; A163-L167 WeakPolarHBondContact O-CG 3.5Å; A163-L167 PolarHBondContact O-N 3.21Å; A163-L167 VanDerWaalsContact O-N 3.08Å; Y164-L167 CarbonylContact O-C 3.57Å; Y164-L167 PolarHBondContact O-N 3.37Å; Y165-L167 VanDerWaalsContact C-N 3.26Å; Y165-L167 PolarHBondContact O-N 3.37Å; L167-K169 HydrophobicContact CB-CD 4.46Å; L167-K169 HydrophobicContact CB-CG 4.31Å; L167-K169 PolarHBondContact O-N 3.01Å
168	K	91.6	Very high	89.5	Confident	187 Å²	187	41.8 Å²	41.8	81%	0.813	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	25.4	-177	-54.1	179.7	179	179.9	0	114	Y164 Y165 Q166 L170	Y164-K168 PolarHBondContact O-N 3.06Å; Y165-K168 PolarHBondContact O-N 3.14Å; Q166-K168 PolarHBondContact O-N 3.24Å; K168-L170 PolarHBondContact O-N 2.64Å
169	K	91.5	Very high	89.3	Confident	52 Å²	52	40.3 Å²	40.3	23%	0.226	18%	0.18	C	C	.	.			trans	-96.7	70.2	176.7	-64.3	-176.3	-177.9	-178.4	0	109.7	G24 L25 Y164 L167 D171 L172 A173	G24-K169 PolarHBondContact O-NZ 3.19Å; L25-K169 HydrophobicContact CD2-CD 4.08Å; L25-K169 HydrophobicContact CG-CD 4.34Å; Y164-K169 HydrophobicContact CD1-CB 4.27Å; Y164-K169 HydrophobicContact CD1-CD 4.36Å; Y164-K169 PolarHBondContact O-N 3.28Å; L167-K169 HydrophobicContact CB-CD 4.46Å; L167-K169 HydrophobicContact CB-CG 4.31Å; L167-K169 PolarHBondContact O-N 3.01Å; K169-D171 VanDerWaalsContact C-N 3.34Å; K169-D171 PolarHBondContact O-N 3.02Å; K169-L172 HydrophobicContact CB-CB 4.38Å; K169-L172 HydrophobicContact CB-CD1 4.29Å; K169-L172 HydrophobicContact CD-CD1 4.17Å; K169-L172 PolarHBondContact O-N 3.23Å; K169-A173 PolarHBondContact O-N 3.25Å
170	L	89.1	Confident	88.8	Confident	45 Å²	45	37.6 Å²	37.6	24%	0.236	17%	0.169	C	C	.	.	H	α-helix	trans	-62	-37	-169.1	-59.3	-179.4	0	0	0	113.4	Y165 K168 L172 A173 A174 M200 V203	Y165-L170 HydrophobicContact CD2-CD2 3.78Å; Y165-L170 HydrophobicContact CE2-CD2 4.06Å; K168-L170 PolarHBondContact O-N 2.64Å; L170-L172 PolarHBondContact O-N 3.03Å; L170-A173 WeakPolarHBondContact O-CB 3.35Å; L170-A173 PolarHBondContact O-N 3.25Å; L170-A174 WeakPolarHBondContact O-CB 3.43Å; L170-A174 PolarHBondContact O-N 2.99Å; L170-M200 HydrophobicContact CD2-SD 4.18Å; L170-V203 HydrophobicContact CB-CG2 3.68Å; L170-V203 HydrophobicContact CD1-CG2 4.38Å
171	D	87.7	Confident	87.9	Confident	80 Å²	80	39.9 Å²	39.9	43%	0.428	18%	0.179	S	C	.	.	H	α-helix	trans	-62.7	-42.1	177.4	-67.8	-39	0	0	0	112.7	K169 A174 A175 S207	K169-D171 VanDerWaalsContact C-N 3.34Å; K169-D171 PolarHBondContact O-N 3.02Å; D171-A174 PolarHBondContact O-N 3.47Å; D171-A175 WeakPolarHBondContact O-CB 3.41Å; D171-A175 PolarHBondContact O-N 3.37Å; D171-S207 PolarHBondContact OD1-OG 3.22Å
172	L	91.8	Very high	86.8	Confident	25 Å²	25	41.6 Å²	41.6	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-73.9	-32.2	177.9	-63.2	177.2	0	0	0	111.8	L25 Y164 K169 L170 A176	L25-L172 HydrophobicContact CD1-CD1 3.5Å; Y164-L172 HydrophobicContact CD1-CB 3.87Å; Y164-L172 HydrophobicContact CD1-CD1 4.06Å; Y164-L172 HydrophobicContact CD2-CB 3.75Å; Y164-L172 WeakPolarHBondContact CD2-O 3.3Å; Y164-L172 HydrophobicContact CE1-CB 4.05Å; Y164-L172 HydrophobicContact CE1-CD1 3.73Å; Y164-L172 HydrophobicContact CE2-CB 3.94Å; Y164-L172 HydrophobicContact CG-CB 3.72Å; K169-L172 HydrophobicContact CB-CB 4.38Å; K169-L172 HydrophobicContact CB-CD1 4.29Å; K169-L172 HydrophobicContact CD-CD1 4.17Å; K169-L172 PolarHBondContact O-N 3.23Å; L170-L172 PolarHBondContact O-N 3.03Å; L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.37Å
173	A	90.9	Very high	85.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-46.8	172.6	0	0	0	0	0	110.9	Q161 K169 L170 A176 A177 Y197	Q161-A173 WeakPolarHBondContact O-CB 3.18Å; K169-A173 PolarHBondContact O-N 3.25Å; L170-A173 WeakPolarHBondContact O-CB 3.35Å; L170-A173 PolarHBondContact O-N 3.25Å; A173-A176 PolarHBondContact O-N 3.49Å; A173-A177 VanDerWaalsContact O-CB 3.25Å; A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.28Å; A173-Y197 HydrophobicContact CB-CE1 4.14Å
174	A	79.4	Confident	84.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-43.5	176.3	0	0	0	0	0	112.2	L170 D171 A177 H178 Y197 V203 S207 F208	L170-A174 WeakPolarHBondContact O-CB 3.43Å; L170-A174 PolarHBondContact O-N 2.99Å; D171-A174 PolarHBondContact O-N 3.47Å; A174-A177 PolarHBondContact O-N 2.94Å; A174-H178 WeakPolarHBondContact O-CB 3.38Å; A174-H178 PolarHBondContact O-N 3.38Å; A174-Y197 HydrophobicContact CB-CG 4.46Å; A174-V203 HydrophobicContact CB-CG1 3.84Å; A174-S207 CarbonylContact C-O 3.48Å; A174-F208 HydrophobicContact CB-CD1 4.21Å; A174-F208 HydrophobicContact CB-CE1 3.93Å; A174-F208 HydrophobicContact CB-CZ 4.23Å
175	A	85.5	Confident	83.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-42.7	177.6	0	0	0	0	0	112.3	D171 H178 T179 S207 R209 L211	D171-A175 WeakPolarHBondContact O-CB 3.41Å; D171-A175 PolarHBondContact O-N 3.37Å; A175-H178 PolarHBondContact O-N 2.88Å; A175-T179 WeakPolarHBondContact O-CB 3.35Å; A175-T179 PolarHBondContact O-N 3.3Å; A175-T179 PolarHBondContact O-OG1 3.45Å; A175-S207 VanDerWaalsContact CA-O 3.27Å; A175-S207 WeakPolarHBondContact CA-O 3.14Å; A175-S207 WeakPolarHBondContact CB-O 3.36Å; A175-S207 PolarHBondContact N-O 3.14Å; A175-S207 VanDerWaalsContact N-O 3.13Å; A175-R209 HydrophobicContact CB-CG 4.17Å; A175-L211 HydrophobicContact CB-CD1 4.01Å; A175-L211 HydrophobicContact CB-CD2 4.17Å; A175-L211 HydrophobicContact CB-CG 4.13Å
176	A	91.1	Very high	81.6	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-42.7	175.9	0	0	0	0	0	111.7	Y157 L160 Q161 Y164 L172 A173 H178 T179 F180	Y157-A176 WeakPolarHBondContact CB-O 3.45Å; Y157-A176 HydrophobicContact CD1-CB 3.99Å; L160-A176 HydrophobicContact CB-CB 4.15Å; Q161-A176 HydrophobicContact CB-CB 3.88Å; Y164-A176 HydrophobicContact CD2-CB 4.19Å; Y164-A176 HydrophobicContact CE2-CB 4.38Å; L172-A176 VanDerWaalsContact O-CB 3.29Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.37Å; A173-A176 PolarHBondContact O-N 3.49Å; A176-H178 PolarHBondContact O-N 3.4Å; A176-T179 PolarHBondContact O-N 2.89Å; A176-F180 PolarHBondContact O-N 3.03Å
177	A	80.8	Confident	80.2	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-45.5	175.6	0	0	0	0	0	111.8	Q161 A173 A174 F180 F181 M190 M194 Y197	Q161-A177 HydrophobicContact CB-CB 4Å; Q161-A177 HydrophobicContact CG-CB 4.45Å; A173-A177 VanDerWaalsContact O-CB 3.25Å; A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.28Å; A174-A177 PolarHBondContact O-N 2.94Å; A177-F180 PolarHBondContact O-N 2.81Å; A177-F181 VanDerWaalsContact O-CB 3.25Å; A177-F181 WeakPolarHBondContact O-CB 3.38Å; A177-F181 PolarHBondContact O-N 3.18Å; A177-M190 HydrophobicContact CB-SD 3.56Å; A177-M190 VanDerWaalsContact CB-SD 3.56Å; A177-M194 HydrophobicContact CB-CG 4.36Å; A177-M194 HydrophobicContact CB-SD 3.6Å; A177-M194 VanDerWaalsContact CB-SD 3.6Å; A177-Y197 HydrophobicContact CB-CD2 3.87Å; A177-Y197 HydrophobicContact CB-CE2 3.64Å
178	H	79.8	Confident	78.7	Confident	29 Å²	29	42 Å²	42	13%	0.134	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-46	175.8	-174.6	-91.3	0	0	0	111.6	A174 A175 A176 F180 F181 V182 M194 D210	A174-H178 WeakPolarHBondContact O-CB 3.38Å; A174-H178 PolarHBondContact O-N 3.38Å; A175-H178 PolarHBondContact O-N 2.88Å; A176-H178 PolarHBondContact O-N 3.4Å; H178-F180 VanDerWaalsContact C-N 3.34Å; H178-F180 PolarHBondContact O-N 3.45Å; H178-F181 PolarHBondContact O-N 3.06Å; H178-F181 VanDerWaalsContact O-N 3.16Å; H178-V182 WeakPolarHBondContact O-CG2 3.21Å; H178-V182 PolarHBondContact O-N 3.23Å; H178-M194 HydrophobicContact CB-CE 3.93Å; H178-M194 HydrophobicContact CB-SD 4.23Å; H178-M194 PolarHBondContact N-SD 2.87Å; H178-D210 PolarHBondContact ND1-N 3.03Å; H178-D210 VanDerWaalsContact ND1-N 3.11Å
179	T	82.8	Confident	77.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-56.8	-45.1	178.3	-58.2	0	0	0	0	111.9	R154 Y157 A175 A176 D210 L211 E212	R154-T179 WeakPolarHBondContact CD-O 3.42Å; R154-T179 PolarHBondContact NH1-O 3.08Å; Y157-T179 HydrophobicContact CD1-CG2 3.73Å; Y157-T179 HydrophobicContact CD2-CG2 3.68Å; Y157-T179 HydrophobicContact CE1-CG2 3.76Å; Y157-T179 HydrophobicContact CE2-CG2 3.73Å; Y157-T179 HydrophobicContact CG-CG2 3.67Å; A175-T179 WeakPolarHBondContact O-CB 3.35Å; A175-T179 PolarHBondContact O-N 3.3Å; A175-T179 PolarHBondContact O-OG1 3.45Å; A176-T179 PolarHBondContact O-N 2.89Å; T179-D210 WeakPolarHBondContact CG2-OD1 3.12Å; T179-L211 HydrophobicContact CG2-CB 4.31Å; T179-L211 WeakPolarHBondContact OG1-CB 3.46Å; T179-L211 WeakPolarHBondContact OG1-CG 3.44Å; T179-L211 PolarHBondContact OG1-N 2.96Å; T179-E212 HydrophobicContact CG2-CB 4.37Å; T179-E212 HydrophobicContact CG2-CG 4.17Å
180	F	83.3	Confident	76.6	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	18%	0.183	C	C	.	.	H	α-helix	trans	-68.8	-42.6	175.2	-179.8	-103	0	0	0	112.5	R154 E155 N158 A176 A177 H178 V182 A183 N184 H187 M190	R154-F180 WeakPolarHBondContact O-CD2 3.49Å; E155-F180 WeakPolarHBondContact OE2-CE2 3.46Å; N158-F180 HydrophobicContact CB-CD1 4.34Å; N158-F180 HydrophobicContact CB-CD2 3.83Å; N158-F180 HydrophobicContact CB-CE1 4.28Å; N158-F180 HydrophobicContact CB-CE2 3.78Å; N158-F180 HydrophobicContact CB-CG 4.1Å; N158-F180 HydrophobicContact CB-CZ 3.99Å; A176-F180 PolarHBondContact O-N 3.03Å; A177-F180 PolarHBondContact O-N 2.81Å; H178-F180 VanDerWaalsContact C-N 3.34Å; H178-F180 PolarHBondContact O-N 3.45Å; F180-V182 VanDerWaalsContact C-N 3.33Å; F180-V182 PolarHBondContact O-N 2.87Å; F180-A183 PolarHBondContact O-N 3.44Å; F180-N184 HydrophobicContact CD1-CB 4.49Å; F180-N184 WeakPolarHBondContact CD2-ND2 3.23Å; F180-N184 HydrophobicContact CE1-CB 4.08Å; F180-N184 HydrophobicContact CE2-CB 4.49Å; F180-N184 VanDerWaalsContact CE2-ND2 3.25Å; F180-N184 WeakPolarHBondContact CE2-ND2 3.49Å; F180-N184 HydrophobicContact CZ-CB 4.09Å; F180-N184 PolarHBondContact O-N 2.98Å; F180-N184 PolarHBondContact O-ND2 3.49Å; F180-H187 HydrophobicContact CE1-CB 3.96Å; F180-H187 AromaticContact CE1-CD2 3.81Å; F180-H187 AromaticContact CE1-CG 3.62Å; F180-H187 AromaticContact CE1-ND1 3.83Å; F180-H187 AromaticContact CZ-CD2 3.97Å; F180-M190 HydrophobicContact CB-CE 4.13Å; F180-M190 HydrophobicContact CD1-CB 4.08Å; F180-M190 HydrophobicContact CD1-CE 3.3Å; F180-M190 HydrophobicContact CD1-CG 3.85Å; F180-M190 HydrophobicContact CD1-SD 4.3Å; F180-M190 HydrophobicContact CE1-CB 4.27Å; F180-M190 HydrophobicContact CE1-CE 3.97Å; F180-M190 HydrophobicContact CG-CE 3.99Å
181	F	74.8	Confident	75.5	Confident	50 Å²	50	39 Å²	39	22%	0.219	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-41.9	-178.6	179.9	-108	0	0	0	112.2	A177 H178 A183 N184 P185 M190 R191 M194	A177-F181 VanDerWaalsContact O-CB 3.25Å; A177-F181 WeakPolarHBondContact O-CB 3.38Å; A177-F181 PolarHBondContact O-N 3.18Å; H178-F181 PolarHBondContact O-N 3.06Å; H178-F181 VanDerWaalsContact O-N 3.16Å; F181-A183 VanDerWaalsContact C-N 3.26Å; F181-A183 PolarHBondContact O-N 3.4Å; F181-N184 CarbonylContact O-C 3.57Å; F181-N184 PolarHBondContact O-N 3.43Å; F181-P185 VanDerWaalsContact CE2-O 3.31Å; F181-P185 WeakPolarHBondContact CE2-O 3.26Å; F181-P185 HydrophobicContact CZ-CB 4.43Å; F181-P185 WeakPolarHBondContact O-CA 3.28Å; F181-M190 HydrophobicContact CB-CG 3.8Å; F181-M190 HydrophobicContact CD2-CB 4.45Å; F181-M190 HydrophobicContact CD2-CG 4.21Å; F181-M190 HydrophobicContact CG-CG 4.45Å; F181-R191 HydrophobicContact CD2-CG 4.12Å; F181-R191 HydrophobicContact CE2-CG 3.35Å; F181-R191 HydrophobicContact CZ-CG 4.12Å; F181-M194 HydrophobicContact CB-CG 4.41Å; F181-M194 HydrophobicContact CG-CG 4.49Å
182	V	71.3	Confident	74.3	Confident	42 Å²	42	40.9 Å²	40.9	26%	0.255	20%	0.2	S	C	.	.	H	α-helix	trans	-57.2	-39.6	176.4	166	0	0	0	0	111.4	H178 F180 D210 P305 G306	H178-V182 WeakPolarHBondContact O-CG2 3.21Å; H178-V182 PolarHBondContact O-N 3.23Å; F180-V182 VanDerWaalsContact C-N 3.33Å; F180-V182 PolarHBondContact O-N 2.87Å; V182-D210 HydrophobicContact CG2-CB 4.29Å; V182-P305 HydrophobicContact CG1-CB 3.79Å; V182-P305 CarbonylContact O-C 3.56Å; V182-G306 VanDerWaalsContact O-CA 3.29Å; V182-G306 WeakPolarHBondContact O-CA 3.31Å
183	A	70.3	Confident	73.3	Confident	14 Å²	14	41 Å²	41	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-82.4	-13.2	175.8	0	0	0	0	0	114.3	R154 F180 F181 G306	R154-A183 HydrophobicContact CB-CB 4.1Å; R154-A183 HydrophobicContact CG-CB 3.8Å; F180-A183 PolarHBondContact O-N 3.44Å; F181-A183 VanDerWaalsContact C-N 3.26Å; F181-A183 PolarHBondContact O-N 3.4Å; A183-G306 VanDerWaalsContact O-CA 3.3Å; A183-G306 WeakPolarHBondContact O-CA 3.09Å
184	N	68.1	Low	72.4	Confident	25 Å²	25	41.2 Å²	41.2	13%	0.134	20%	0.202	C	C	.	.			trans	-142.2	63.8	-174.9	-55	-90.1	0	0	0	111	R153 F180 F181 M186 H187	R153-N184 PolarHBondContact O-ND2 3.47Å; F180-N184 HydrophobicContact CD1-CB 4.49Å; F180-N184 WeakPolarHBondContact CD2-ND2 3.23Å; F180-N184 HydrophobicContact CE1-CB 4.08Å; F180-N184 HydrophobicContact CE2-CB 4.49Å; F180-N184 VanDerWaalsContact CE2-ND2 3.25Å; F180-N184 WeakPolarHBondContact CE2-ND2 3.49Å; F180-N184 HydrophobicContact CZ-CB 4.09Å; F180-N184 PolarHBondContact O-N 2.98Å; F180-N184 PolarHBondContact O-ND2 3.49Å; F181-N184 CarbonylContact O-C 3.57Å; F181-N184 PolarHBondContact O-N 3.43Å; N184-M186 PolarHBondContact O-N 3.2Å; N184-H187 HydrophobicContact CB-CB 4.1Å; N184-H187 WeakPolarHBondContact O-CB 3.41Å; N184-H187 PolarHBondContact O-N 3.23Å
185	P	60.3	Low	71.9	Confident	44 Å²	44	43.1 Å²	43.1	29%	0.286	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.7	-172.3	23.9	-34.4	0	0	0	113.3	F181	F181-P185 VanDerWaalsContact CE2-O 3.31Å; F181-P185 WeakPolarHBondContact CE2-O 3.26Å; F181-P185 HydrophobicContact CZ-CB 4.43Å; F181-P185 WeakPolarHBondContact O-CA 3.28Å
186	M	60.1	Low	71.3	Confident	124 Å²	124	47 Å²	47	61%	0.611	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.3	176.9	-62.9	-171.8	74.8	0	0	114.4	N184 L188 P602	N184-M186 PolarHBondContact O-N 3.2Å; M186-L188 PolarHBondContact O-N 3.03Å; M186-P602 HydrophobicContact CE-CB 3.53Å; M186-P602 HydrophobicContact CE-CG 3.51Å; M186-P602 HydrophobicContact CG-CG 4.28Å; M186-P602 HydrophobicContact SD-CB 3.78Å; M186-P602 HydrophobicContact SD-CG 3.39Å; M186-P602 WeakPolarHBondContact SD-CG 3.34Å
187	H	62.5	Low	70.4	Confident	66 Å²	66	47.2 Å²	47.2	31%	0.306	24%	0.235	S	C	.	.			trans	-71.2	100.3	-174.1	-168.4	-87.3	0	0	0	111.2	F180 N184 Q189 M190 R191	F180-H187 HydrophobicContact CE1-CB 3.96Å; F180-H187 AromaticContact CE1-CD2 3.81Å; F180-H187 AromaticContact CE1-CG 3.62Å; F180-H187 AromaticContact CE1-ND1 3.83Å; F180-H187 AromaticContact CZ-CD2 3.97Å; N184-H187 HydrophobicContact CB-CB 4.1Å; N184-H187 WeakPolarHBondContact O-CB 3.41Å; N184-H187 PolarHBondContact O-N 3.23Å; H187-Q189 PolarHBondContact O-N 3.21Å; H187-M190 HydrophobicContact CB-CB 4.07Å; H187-M190 WeakPolarHBondContact ND1-CB 3.34Å; H187-M190 PolarHBondContact ND1-N 3.08Å; H187-M190 VanDerWaalsContact ND1-N 3.13Å; H187-M190 WeakPolarHBondContact O-CB 3.41Å; H187-M190 PolarHBondContact O-N 3.3Å; H187-R191 PolarHBondContact O-N 2.8Å; H187-R191 VanDerWaalsContact O-N 3.09Å
188	L	60.2	Low	70.1	Confident	97 Å²	97	55 Å²	55	51%	0.508	26%	0.264	S	S	.	.	H	α-helix	trans	-54.1	-49.1	-172	-64.6	177.6	0	0	0	113	M186 M190 R191 E192	M186-L188 PolarHBondContact O-N 3.03Å; L188-M190 PolarHBondContact O-N 3.16Å; L188-R191 WeakPolarHBondContact O-CB 3.36Å; L188-R191 PolarHBondContact O-N 2.9Å; L188-R191 VanDerWaalsContact O-N 3.15Å; L188-E192 PolarHBondContact O-N 2.94Å
189	Q	64.6	Low	69.9	Low	99 Å²	99	63.2 Å²	63.2	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-34	179.7	-176	63.3	59.1	0	0	111.7	H187 E192 D193	H187-Q189 PolarHBondContact O-N 3.21Å; Q189-E192 PolarHBondContact O-N 2.91Å; Q189-D193 PolarHBondContact NE2-OD1 3.4Å; Q189-D193 WeakPolarHBondContact O-CB 3.18Å; Q189-D193 VanDerWaalsContact O-CG 3.24Å; Q189-D193 PolarHBondContact O-N 3.03Å
190	M	73.8	Confident	69.7	Low	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-73	-36.2	-179.8	-169.5	58.8	64.7	0	0	110.9	Q161 A177 F180 F181 H187 L188 E192 D193 M194	Q161-M190 HydrophobicContact CG-CE 3.9Å; A177-M190 HydrophobicContact CB-SD 3.56Å; A177-M190 VanDerWaalsContact CB-SD 3.56Å; F180-M190 HydrophobicContact CB-CE 4.13Å; F180-M190 HydrophobicContact CD1-CB 4.08Å; F180-M190 HydrophobicContact CD1-CE 3.3Å; F180-M190 HydrophobicContact CD1-CG 3.85Å; F180-M190 HydrophobicContact CD1-SD 4.3Å; F180-M190 HydrophobicContact CE1-CB 4.27Å; F180-M190 HydrophobicContact CE1-CE 3.97Å; F180-M190 HydrophobicContact CG-CE 3.99Å; F181-M190 HydrophobicContact CB-CG 3.8Å; F181-M190 HydrophobicContact CD2-CB 4.45Å; F181-M190 HydrophobicContact CD2-CG 4.21Å; F181-M190 HydrophobicContact CG-CG 4.45Å; H187-M190 HydrophobicContact CB-CB 4.07Å; H187-M190 WeakPolarHBondContact ND1-CB 3.34Å; H187-M190 PolarHBondContact ND1-N 3.08Å; H187-M190 VanDerWaalsContact ND1-N 3.13Å; H187-M190 WeakPolarHBondContact O-CB 3.41Å; H187-M190 PolarHBondContact O-N 3.3Å; L188-M190 PolarHBondContact O-N 3.16Å; M190-E192 VanDerWaalsContact C-N 3.3Å; M190-E192 PolarHBondContact O-N 2.85Å; M190-D193 PolarHBondContact O-N 3.11Å; M190-D193 HydrophobicContact SD-CB 4.3Å; M190-M194 HydrophobicContact CG-CG 4.26Å; M190-M194 WeakPolarHBondContact O-CB 3.5Å; M190-M194 WeakPolarHBondContact O-CG 3.27Å; M190-M194 PolarHBondContact O-N 2.98Å; M190-M194 HydrophobicContact SD-CG 4.5Å
191	R	66.3	Low	69.5	Low	123 Å²	123	70.8 Å²	70.8	46%	0.464	34%	0.343	S	S	.	.	H	α-helix	trans	-59.4	-43.2	174	-69.2	-179.3	73.2	179.7	4.3	111.6	F181 H187 L188 A195	F181-R191 HydrophobicContact CD2-CG 4.12Å; F181-R191 HydrophobicContact CE2-CG 3.35Å; F181-R191 HydrophobicContact CZ-CG 4.12Å; H187-R191 PolarHBondContact O-N 2.8Å; H187-R191 VanDerWaalsContact O-N 3.09Å; L188-R191 WeakPolarHBondContact O-CB 3.36Å; L188-R191 PolarHBondContact O-N 2.9Å; L188-R191 VanDerWaalsContact O-N 3.15Å; R191-A195 WeakPolarHBondContact O-CB 3.38Å; R191-A195 PolarHBondContact O-N 3.27Å
192	E	62	Low	69.6	Low	119 Å²	119	70.7 Å²	70.7	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-46.1	176.3	-68.2	176.6	-176.4	0	0	111.7	L188 Q189 M190 M194 A195 K196	L188-E192 PolarHBondContact O-N 2.94Å; Q189-E192 PolarHBondContact O-N 2.91Å; M190-E192 VanDerWaalsContact C-N 3.3Å; M190-E192 PolarHBondContact O-N 2.85Å; E192-M194 VanDerWaalsContact C-N 3.33Å; E192-M194 PolarHBondContact O-N 3.44Å; E192-A195 PolarHBondContact O-N 3.34Å; E192-K196 WeakPolarHBondContact O-CB 3.28Å; E192-K196 PolarHBondContact O-N 3.33Å
193	D	71.2	Confident	69.8	Low	26 Å²	26	69.4 Å²	69.4	14%	0.139	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-41.8	177.5	-73	-3.7	0	0	0	111.4	Q161 Q189 M190 K196 Y197	Q161-D193 PolarHBondContact NE2-OD2 3.1Å; Q189-D193 PolarHBondContact NE2-OD1 3.4Å; Q189-D193 WeakPolarHBondContact O-CB 3.18Å; Q189-D193 VanDerWaalsContact O-CG 3.24Å; Q189-D193 PolarHBondContact O-N 3.03Å; M190-D193 PolarHBondContact O-N 3.11Å; M190-D193 HydrophobicContact SD-CB 4.3Å; D193-K196 WeakPolarHBondContact O-CB 3.39Å; D193-K196 PolarHBondContact O-N 2.88Å; D193-Y197 HydrophobicContact CB-CE2 4.2Å; D193-Y197 WeakPolarHBondContact O-CD2 3.27Å; D193-Y197 PolarHBondContact O-N 3.37Å
194	M	71.4	Confident	70.2	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.03	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-46.4	175.2	-74.8	-69.5	-71	0	0	112.2	A177 H178 F181 M190 E192 K196 Y197 R198 F208	A177-M194 HydrophobicContact CB-CG 4.36Å; A177-M194 HydrophobicContact CB-SD 3.6Å; A177-M194 VanDerWaalsContact CB-SD 3.6Å; H178-M194 HydrophobicContact CB-CE 3.93Å; H178-M194 HydrophobicContact CB-SD 4.23Å; H178-M194 PolarHBondContact N-SD 2.87Å; F181-M194 HydrophobicContact CB-CG 4.41Å; F181-M194 HydrophobicContact CG-CG 4.49Å; M190-M194 HydrophobicContact CG-CG 4.26Å; M190-M194 WeakPolarHBondContact O-CB 3.5Å; M190-M194 WeakPolarHBondContact O-CG 3.27Å; M190-M194 PolarHBondContact O-N 2.98Å; M190-M194 HydrophobicContact SD-CG 4.5Å; E192-M194 VanDerWaalsContact C-N 3.33Å; E192-M194 PolarHBondContact O-N 3.44Å; M194-K196 PolarHBondContact O-N 2.95Å; M194-Y197 PolarHBondContact O-N 3.33Å; M194-R198 WeakPolarHBondContact O-CG 3.23Å; M194-R198 PolarHBondContact O-N 3.13Å; M194-F208 HydrophobicContact CE-CD1 3.4Å; M194-F208 HydrophobicContact CE-CE1 3.79Å; M194-F208 HydrophobicContact CE-CG 4.44Å; M194-F208 HydrophobicContact SD-CD1 3.96Å; M194-F208 HydrophobicContact SD-CE1 3.94Å
195	A	69.3	Low	70.2	Confident	39 Å²	39	77 Å²	77	32%	0.322	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-32.1	175.2	0	0	0	0	0	112.1	R191 E192 R199	R191-A195 WeakPolarHBondContact O-CB 3.38Å; R191-A195 PolarHBondContact O-N 3.27Å; E192-A195 PolarHBondContact O-N 3.34Å; A195-R199 WeakPolarHBondContact O-CG 3.48Å; A195-R199 PolarHBondContact O-NE 3.46Å
196	K	72.8	Confident	70.9	Confident	82 Å²	82	81.1 Å²	81.1	36%	0.357	41%	0.405	S	S	.	.	H	α-helix	trans	-68.2	-48.5	172.9	-178.4	-173.7	-176.8	-164.6	0	111.4	Y165 E192 D193 M194 R198 R199 M200	Y165-K196 PolarHBondContact OH-NZ 3.32Å; E192-K196 WeakPolarHBondContact O-CB 3.28Å; E192-K196 PolarHBondContact O-N 3.33Å; D193-K196 WeakPolarHBondContact O-CB 3.39Å; D193-K196 PolarHBondContact O-N 2.88Å; M194-K196 PolarHBondContact O-N 2.95Å; K196-R198 VanDerWaalsContact C-N 3.31Å; K196-R198 PolarHBondContact O-N 3.3Å; K196-R199 PolarHBondContact O-N 3.31Å; K196-R199 VanDerWaalsContact O-N 3.1Å; K196-M200 HydrophobicContact CD-CE 4Å; K196-M200 VanDerWaalsContact CE-CE 3.41Å; K196-M200 HydrophobicContact CG-CE 3.73Å; K196-M200 PolarHBondContact O-N 3.25Å
197	Y	73.4	Confident	71.7	Confident	6 Å²	6	75.6 Å²	75.6	2%	0.024	38%	0.379	C	S	.	.	H	α-helix	trans	-59.7	-39.4	178.5	-67.8	-43	0	0	0	112.7	Q161 Y165 A173 A174 A177 D193 M194 R199 M200 V203	Q161-Y197 PolarHBondContact OE1-OH 3.2Å; Y165-Y197 AromaticContact CD2-CE1 3.73Å; Y165-Y197 HydrophobicContact CD2-CE1 3.73Å; Y165-Y197 HydrophobicContact CE2-CE1 4.31Å; Y165-Y197 HydrophobicContact CG-CE1 4.43Å; A173-Y197 HydrophobicContact CB-CE1 4.14Å; A174-Y197 HydrophobicContact CB-CG 4.46Å; A177-Y197 HydrophobicContact CB-CD2 3.87Å; A177-Y197 HydrophobicContact CB-CE2 3.64Å; D193-Y197 HydrophobicContact CB-CE2 4.2Å; D193-Y197 WeakPolarHBondContact O-CD2 3.27Å; D193-Y197 PolarHBondContact O-N 3.37Å; M194-Y197 PolarHBondContact O-N 3.33Å; Y197-R199 PolarHBondContact O-N 2.92Å; Y197-R199 VanDerWaalsContact O-N 3.15Å; Y197-M200 HydrophobicContact CD1-SD 3.86Å; Y197-M200 HydrophobicContact CE1-SD 4.34Å; Y197-M200 PolarHBondContact O-N 2.97Å; Y197-M200 VanDerWaalsContact O-N 3.15Å; Y197-V203 WeakPolarHBondContact O-CB 3.47Å
198	R	74.8	Confident	72.3	Confident	163 Å²	163	74.1 Å²	74.1	62%	0.615	37%	0.371	S	S	*	.	H	α-helix	trans	-60.6	-24.4	177.3	-74.3	178.4	-179.2	160.4	-1.9	113.7	M194 K196 F208	M194-R198 WeakPolarHBondContact O-CG 3.23Å; M194-R198 PolarHBondContact O-N 3.13Å; K196-R198 VanDerWaalsContact C-N 3.31Å; K196-R198 PolarHBondContact O-N 3.3Å; R198-F208 HydrophobicContact CB-CZ 4.16Å; R198-F208 HydrophobicContact CG-CD2 4.49Å; R198-F208 HydrophobicContact CG-CE1 3.98Å; R198-F208 HydrophobicContact CG-CE2 3.64Å; R198-F208 HydrophobicContact CG-CZ 3.33Å
199	R	75.4	Confident	73.2	Confident	201 Å²	201	75.3 Å²	75.3	76%	0.758	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.6	-178.3	-68.6	180	-73.7	179.8	-0.6	113.5	A195 K196 Y197	A195-R199 WeakPolarHBondContact O-CG 3.48Å; A195-R199 PolarHBondContact O-NE 3.46Å; K196-R199 PolarHBondContact O-N 3.31Å; K196-R199 VanDerWaalsContact O-N 3.1Å; Y197-R199 PolarHBondContact O-N 2.92Å; Y197-R199 VanDerWaalsContact O-N 3.15Å
200	M	78.5	Confident	73.9	Confident	41 Å²	41	71.7 Å²	71.7	20%	0.202	35%	0.353	C	S	.	.	S	Bend	trans	-80.5	131.6	-177.2	-75.1	178.3	168.7	0	0	111.7	Y165 L170 K196 Y197 G202 V203	Y165-M200 HydrophobicContact CE2-CE 3.49Å; Y165-M200 VanDerWaalsContact CE2-CE 3.49Å; Y165-M200 HydrophobicContact CE2-SD 4Å; L170-M200 HydrophobicContact CD2-SD 4.18Å; K196-M200 HydrophobicContact CD-CE 4Å; K196-M200 VanDerWaalsContact CE-CE 3.41Å; K196-M200 HydrophobicContact CG-CE 3.73Å; K196-M200 PolarHBondContact O-N 3.25Å; Y197-M200 HydrophobicContact CD1-SD 3.86Å; Y197-M200 HydrophobicContact CE1-SD 4.34Å; Y197-M200 PolarHBondContact O-N 2.97Å; Y197-M200 VanDerWaalsContact O-N 3.15Å; M200-G202 PolarHBondContact O-N 3.42Å; M200-V203 HydrophobicContact CB-CG2 4.05Å; M200-V203 PolarHBondContact O-N 3.35Å
201	S	78.1	Confident	74.5	Confident	119 Å²	119	75.3 Å²	75.3	83%	0.832	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	118.6	170.4	56.3	0	0	0	0	110.2
202	G	77	Confident	75.4	Confident	49 Å²	49	72.8 Å²	72.8	51%	0.505	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	110	-9.8	-179.9	0	0	0	0	0	114.7	M200	M200-G202 PolarHBondContact O-N 3.42Å
203	V	76.8	Confident	76.3	Confident	15 Å²	15	70 Å²	70	9%	0.091	36%	0.357	C	S	.	.			trans	-93.7	125.9	169.9	-178.2	0	0	0	0	108.6	L170 A174 Y197 M200 F208	L170-V203 HydrophobicContact CB-CG2 3.68Å; L170-V203 HydrophobicContact CD1-CG2 4.38Å; A174-V203 HydrophobicContact CB-CG1 3.84Å; Y197-V203 WeakPolarHBondContact O-CB 3.47Å; M200-V203 HydrophobicContact CB-CG2 4.05Å; M200-V203 PolarHBondContact O-N 3.35Å; V203-F208 HydrophobicContact CG1-CE2 3.7Å; V203-F208 HydrophobicContact CG1-CZ 3.77Å
204	Q	78.8	Confident	77.1	Confident	97 Å²	97	70.1 Å²	70.1	45%	0.453	36%	0.359	S	S	.	.			trans	-99.9	160	-180	-59.1	-63.5	-31.3	0	0	110.9	Q206 S207	Q204-Q206 HydrophobicContact CB-CG 3.98Å; Q204-Q206 PolarHBondContact O-N 2.89Å; Q204-S207 PolarHBondContact N-OG 3.07Å; Q204-S207 WeakPolarHBondContact O-CB 3.44Å; Q204-S207 PolarHBondContact O-N 2.99Å; Q204-S207 PolarHBondContact O-OG 2.97Å
205	P	67.3	Low	78	Confident	100 Å²	100	74.3 Å²	74.3	65%	0.649	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-52.7	-39.4	173.3	-27.7	36.3	0	0	0	112.9	S207 F208	P205-S207 PolarHBondContact O-N 2.91Å; P205-S207 VanDerWaalsContact O-N 3.17Å; P205-F208 PolarHBondContact O-N 2.82Å; P205-F208 VanDerWaalsContact O-N 3.15Å
206	Q	75.3	Confident	79.1	Confident	131 Å²	131	72.7 Å²	72.7	61%	0.612	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-67	-12.2	176.5	62.8	-91.6	19.6	0	0	115.2	Q204 F208	Q204-Q206 HydrophobicContact CB-CG 3.98Å; Q204-Q206 PolarHBondContact O-N 2.89Å; Q206-F208 PolarHBondContact O-N 3.36Å
207	S	75.4	Confident	79.8	Confident	9 Å²	9	69 Å²	69	6%	0.063	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-74	-18.1	175.2	-50.6	0	0	0	0	111.4	D171 A174 A175 Q204 P205 R209	D171-S207 PolarHBondContact OD1-OG 3.22Å; A174-S207 CarbonylContact C-O 3.48Å; A175-S207 VanDerWaalsContact CA-O 3.27Å; A175-S207 WeakPolarHBondContact CA-O 3.14Å; A175-S207 WeakPolarHBondContact CB-O 3.36Å; A175-S207 PolarHBondContact N-O 3.14Å; A175-S207 VanDerWaalsContact N-O 3.13Å; Q204-S207 PolarHBondContact N-OG 3.07Å; Q204-S207 WeakPolarHBondContact O-CB 3.44Å; Q204-S207 PolarHBondContact O-N 2.99Å; Q204-S207 PolarHBondContact O-OG 2.97Å; P205-S207 PolarHBondContact O-N 2.91Å; P205-S207 VanDerWaalsContact O-N 3.17Å; S207-R209 PolarHBondContact O-N 3.13Å
208	F	75.8	Confident	80.6	Confident	34 Å²	34	70.7 Å²	70.7	15%	0.149	37%	0.371	C	S	.	.			trans	-88.7	84.9	173.5	-59.9	-77.8	0	0	0	110.1	A174 M194 R198 V203 P205 Q206	A174-F208 HydrophobicContact CB-CD1 4.21Å; A174-F208 HydrophobicContact CB-CE1 3.93Å; A174-F208 HydrophobicContact CB-CZ 4.23Å; M194-F208 HydrophobicContact CE-CD1 3.4Å; M194-F208 HydrophobicContact CE-CE1 3.79Å; M194-F208 HydrophobicContact CE-CG 4.44Å; M194-F208 HydrophobicContact SD-CD1 3.96Å; M194-F208 HydrophobicContact SD-CE1 3.94Å; R198-F208 HydrophobicContact CB-CZ 4.16Å; R198-F208 HydrophobicContact CG-CD2 4.49Å; R198-F208 HydrophobicContact CG-CE1 3.98Å; R198-F208 HydrophobicContact CG-CE2 3.64Å; R198-F208 HydrophobicContact CG-CZ 3.33Å; V203-F208 HydrophobicContact CG1-CE2 3.7Å; V203-F208 HydrophobicContact CG1-CZ 3.77Å; P205-F208 PolarHBondContact O-N 2.82Å; P205-F208 VanDerWaalsContact O-N 3.15Å; Q206-F208 PolarHBondContact O-N 3.36Å
209	R	79.4	Confident	81.4	Confident	122 Å²	122	63.1 Å²	63.1	46%	0.46	34%	0.343	S	S	.	.			trans	-132.8	142.1	177.5	64.4	-174.5	-178.2	-163.8	0.3	110.1	A175 S207 L211	A175-R209 HydrophobicContact CB-CG 4.17Å; S207-R209 PolarHBondContact O-N 3.13Å; R209-L211 HydrophobicContact CG-CD2 4.19Å; R209-L211 PolarHBondContact O-N 3.05Å
210	D	79.6	Confident	82.1	Confident	24 Å²	24	54.4 Å²	54.4	13%	0.128	31%	0.31	C	S	.	.			trans	-80.1	114.6	172.9	174.8	15	0	0	0	109.6	R154 H178 T179 V182 E212 T213	R154-D210 IonicContact CZ-OD1 2.67Å; R154-D210 IonicContact CZ-OD2 2.69Å; R154-D210 VanDerWaalsContact CZ-OD2 3.23Å; R154-D210 IonicContact NH1-OD1 3.52Å; R154-D210 PolarHBondContact NH1-OD1 3.25Å; R154-D210 IonicContact NH1-OD2 3.08Å; R154-D210 PolarHBondContact NH1-OD2 3.48Å; R154-D210 IonicContact NH2-OD1 2.68Å; R154-D210 IonicContact NH2-OD2 3.65Å; R154-D210 PolarHBondContact NH2-OD2 2.83Å; H178-D210 PolarHBondContact ND1-N 3.03Å; H178-D210 VanDerWaalsContact ND1-N 3.11Å; T179-D210 WeakPolarHBondContact CG2-OD1 3.12Å; V182-D210 HydrophobicContact CG2-CB 4.29Å; D210-E212 PolarHBondContact O-N 3.24Å; D210-E212 PolarHBondContact OD1-N 3.1Å; D210-T213 WeakPolarHBondContact CB-OG1 3.47Å; D210-T213 PolarHBondContact O-OG1 2.96Å; D210-T213 PolarHBondContact OD1-N 2.99Å; D210-T213 PolarHBondContact OD2-N 2.85Å; D210-T213 PolarHBondContact OD2-OG1 2.87Å
211	L	85.8	Confident	82.4	Confident	76 Å²	76	54.4 Å²	54.4	40%	0.398	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-11.9	-178.3	-60.9	173.6	0	0	0	112.7	Y157 A175 T179 R209	Y157-L211 HydrophobicContact CD1-CD1 4.4Å; Y157-L211 HydrophobicContact CE1-CB 4.19Å; Y157-L211 HydrophobicContact CE1-CD1 3.82Å; A175-L211 HydrophobicContact CB-CD1 4.01Å; A175-L211 HydrophobicContact CB-CD2 4.17Å; A175-L211 HydrophobicContact CB-CG 4.13Å; T179-L211 HydrophobicContact CG2-CB 4.31Å; T179-L211 WeakPolarHBondContact OG1-CB 3.46Å; T179-L211 WeakPolarHBondContact OG1-CG 3.44Å; T179-L211 PolarHBondContact OG1-N 2.96Å; R209-L211 HydrophobicContact CG-CD2 4.19Å; R209-L211 PolarHBondContact O-N 3.05Å
212	E	85.1	Confident	82.9	Confident	69 Å²	69	51.3 Å²	51.3	32%	0.322	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	25.5	178.4	-61.8	-161.2	164.6	0	0	112.5	R154 Y157 T179 D210 P214	R154-E212 IonicContact NE-OE2 3.82Å; R154-E212 PolarHBondContact NH2-O 3.23Å; Y157-E212 HydrophobicContact CE2-CG 3.89Å; Y157-E212 WeakPolarHBondContact CE2-OE1 3.18Å; Y157-E212 VanDerWaalsContact OH-CG 3.27Å; Y157-E212 WeakPolarHBondContact OH-CG 3.35Å; Y157-E212 PolarHBondContact OH-OE1 2.9Å; Y157-E212 VanDerWaalsContact OH-OE1 3.1Å; T179-E212 HydrophobicContact CG2-CB 4.37Å; T179-E212 HydrophobicContact CG2-CG 4.17Å; D210-E212 PolarHBondContact O-N 3.24Å; D210-E212 PolarHBondContact OD1-N 3.1Å; E212-P214 WeakPolarHBondContact O-CD 3.36Å; E212-P214 VanDerWaalsContact O-N 3.15Å
213	T	82.2	Confident	83.5	Confident	62 Å²	62	49 Å²	49	38%	0.38	26%	0.264	S	S	.	.			trans	-57.3	119.2	174.8	-50.2	0	0	0	0	109.3	D210 A218	D210-T213 WeakPolarHBondContact CB-OG1 3.47Å; D210-T213 PolarHBondContact O-OG1 2.96Å; D210-T213 PolarHBondContact OD1-N 2.99Å; D210-T213 PolarHBondContact OD2-N 2.85Å; D210-T213 PolarHBondContact OD2-OG1 2.87Å; T213-A218 HydrophobicContact CG2-CB 4Å
214	P	86.4	Confident	83.9	Confident	28 Å²	28	49.8 Å²	49.8	18%	0.182	27%	0.267	C	S	.	.			trans	-62.7	130.6	176.3	-24	36.6	0	0	0	110.1	E212 H216 W217 A218 P305	E212-P214 WeakPolarHBondContact O-CD 3.36Å; E212-P214 VanDerWaalsContact O-N 3.15Å; P214-H216 VanDerWaalsContact CB-CE1 3.41Å; P214-H216 WeakPolarHBondContact CB-CE1 3.45Å; P214-H216 WeakPolarHBondContact CB-ND1 3.32Å; P214-H216 PolarHBondContact O-N 3.2Å; P214-H216 VanDerWaalsContact O-N 3.16Å; P214-W217 PolarHBondContact O-N 3.33Å; P214-W217 VanDerWaalsContact O-N 3.09Å; P214-A218 PolarHBondContact O-N 3.03Å; P214-P305 HydrophobicContact CG-CG 4.23Å
215	P	90.4	Very high	84	Confident	93 Å²	93	49.6 Å²	49.6	60%	0.604	27%	0.266	S	S	*	.	H	α-helix	trans	-57	-35	-174.1	-28	34.9	0	0	0	113.9	A218 A219	P215-A218 PolarHBondContact O-N 3.17Å; P215-A219 WeakPolarHBondContact O-CB 3.23Å; P215-A219 PolarHBondContact O-N 2Å
216	H	93.3	Very high	85.1	Confident	5 Å²	5	46 Å²	46	2%	0.023	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-36.8	-179.8	70.8	-77.8	0	0	0	112.6	P214 Y220 S246 T301 F314	P214-H216 VanDerWaalsContact CB-CE1 3.41Å; P214-H216 WeakPolarHBondContact CB-CE1 3.45Å; P214-H216 WeakPolarHBondContact CB-ND1 3.32Å; P214-H216 PolarHBondContact O-N 3.2Å; P214-H216 VanDerWaalsContact O-N 3.16Å; H216-Y220 VanDerWaalsContact O-CB 3.28Å; H216-Y220 WeakPolarHBondContact O-CB 3.49Å; H216-Y220 PolarHBondContact O-N 3.07Å; H216-S246 PolarHBondContact CD2-OG 2.75Å; H216-T301 PolarHBondContact NE2-O 3.5Å; H216-F314 AromaticContact CD2-CE1 3.97Å
217	W	87.9	Confident	85.4	Confident	6 Å²	6	41.3 Å²	41.3	2%	0.023	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-45.4	175	-81.5	122.1	0	0	0	111.5	P214 A219 Y220 D221 T301 A302 R304 V311 F314	P214-W217 PolarHBondContact O-N 3.33Å; P214-W217 VanDerWaalsContact O-N 3.09Å; W217-A219 VanDerWaalsContact C-N 3.3Å; W217-A219 PolarHBondContact O-N 2.54Å; W217-Y220 AromaticContact CE3-CD1 3.96Å; W217-Y220 HydrophobicContact CE3-CD1 3.96Å; W217-Y220 AromaticContact CZ3-CD1 3.74Å; W217-Y220 HydrophobicContact CZ3-CD1 3.74Å; W217-Y220 HydrophobicContact CZ3-CE1 4.11Å; W217-Y220 WeakPolarHBondContact O-CB 3.18Å; W217-Y220 PolarHBondContact O-N 2.99Å; W217-Y220 VanDerWaalsContact O-N 3.13Å; W217-D221 VanDerWaalsContact O-CG 3.24Å; W217-D221 PolarHBondContact O-N 3.38Å; W217-T301 PolarHBondContact NE1-O 3.32Å; W217-A302 WeakPolarHBondContact CZ2-O 3.37Å; W217-R304 HydrophobicContact CD2-CG 3.98Å; W217-R304 HydrophobicContact CE3-CG 4.01Å; W217-R304 VanDerWaalsContact CE3-CZ 3.46Å; W217-R304 HydrophobicContact CH2-CG 3.7Å; W217-R304 HydrophobicContact CZ2-CG 3.63Å; W217-R304 HydrophobicContact CZ3-CG 3.87Å; W217-R304 VanDerWaalsContact CZ3-CZ 3.45Å; W217-V311 HydrophobicContact CH2-CB 4.34Å; W217-V311 HydrophobicContact CH2-CG2 3.7Å; W217-V311 HydrophobicContact CZ2-CG2 4.45Å; W217-F314 HydrophobicContact CD2-CZ 4.33Å; W217-F314 HydrophobicContact CE3-CE2 4.19Å; W217-F314 HydrophobicContact CE3-CZ 4.08Å; W217-F314 AromaticContact CH2-CD2 3.77Å; W217-F314 HydrophobicContact CH2-CD2 3.77Å; W217-F314 HydrophobicContact CH2-CE1 4.28Å; W217-F314 AromaticContact CH2-CE2 3.22Å; W217-F314 HydrophobicContact CH2-CE2 3.22Å; W217-F314 AromaticContact CH2-CZ 3.51Å; W217-F314 HydrophobicContact CH2-CZ 3.51Å; W217-F314 HydrophobicContact CZ2-CD2 4.49Å; W217-F314 HydrophobicContact CZ2-CE1 4.21Å; W217-F314 AromaticContact CZ2-CE2 3.97Å; W217-F314 HydrophobicContact CZ2-CE2 3.97Å; W217-F314 AromaticContact CZ2-CZ 3.8Å; W217-F314 HydrophobicContact CZ2-CZ 3.8Å; W217-F314 HydrophobicContact CZ3-CD2 4.27Å; W217-F314 AromaticContact CZ3-CE2 3.37Å; W217-F314 HydrophobicContact CZ3-CE2 3.37Å; W217-F314 AromaticContact CZ3-CZ 3.68Å; W217-F314 HydrophobicContact CZ3-CZ 3.68Å
218	A	88.4	Confident	85.7	Confident	41 Å²	41	48.5 Å²	48.5	34%	0.339	25%	0.253	S	S	.	.	H	α-helix	trans	-59.3	-42	177	0	0	0	0	0	112.2	T213 P214 P215 T222	T213-A218 HydrophobicContact CG2-CB 4Å; P214-A218 PolarHBondContact O-N 3.03Å; P215-A218 PolarHBondContact O-N 3.17Å; A218-T222 WeakPolarHBondContact O-CB 3.4Å; A218-T222 PolarHBondContact O-N 2.91Å; A218-T222 VanDerWaalsContact O-N 3.13Å; A218-T222 PolarHBondContact O-OG1 2.81Å
219	A	93	Very high	86.4	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-67.3	-39.6	175.8	0	0	0	0	0	111.9	P215 W217 G223 E241 A242	P215-A219 WeakPolarHBondContact O-CB 3.23Å; P215-A219 PolarHBondContact O-N 2Å; W217-A219 VanDerWaalsContact C-N 3.3Å; W217-A219 PolarHBondContact O-N 2.54Å; A219-G223 PolarHBondContact O-N 3.15Å; A219-E241 HydrophobicContact CB-CB 4.01Å; A219-E241 HydrophobicContact CB-CG 3.77Å; A219-A242 HydrophobicContact CB-CB 4.05Å
220	Y	89.7	Confident	87	Confident	17 Å²	17	56.5 Å²	56.5	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-50.4	177.8	-173	-114.3	0	0	0	111.6	H216 W217 T222 G223 L224 A242 F314 Q318	H216-Y220 VanDerWaalsContact O-CB 3.28Å; H216-Y220 WeakPolarHBondContact O-CB 3.49Å; H216-Y220 PolarHBondContact O-N 3.07Å; W217-Y220 AromaticContact CE3-CD1 3.96Å; W217-Y220 HydrophobicContact CE3-CD1 3.96Å; W217-Y220 AromaticContact CZ3-CD1 3.74Å; W217-Y220 HydrophobicContact CZ3-CD1 3.74Å; W217-Y220 HydrophobicContact CZ3-CE1 4.11Å; W217-Y220 WeakPolarHBondContact O-CB 3.18Å; W217-Y220 PolarHBondContact O-N 2.99Å; W217-Y220 VanDerWaalsContact O-N 3.13Å; Y220-T222 PolarHBondContact O-N 3.39Å; Y220-G223 WeakPolarHBondContact O-CA 3.46Å; Y220-G223 PolarHBondContact O-N 3.35Å; Y220-G223 VanDerWaalsContact O-N 3.07Å; Y220-L224 HydrophobicContact CD1-CD1 4.01Å; Y220-L224 HydrophobicContact CE1-CD1 3.52Å; Y220-L224 HydrophobicContact CE1-CG 4.24Å; Y220-L224 HydrophobicContact CE2-CD1 4.47Å; Y220-L224 HydrophobicContact CE2-CD2 4.35Å; Y220-L224 HydrophobicContact CE2-CG 4.41Å; Y220-L224 WeakPolarHBondContact O-CG 3.2Å; Y220-L224 PolarHBondContact O-N 3.18Å; Y220-A242 HydrophobicContact CD2-CB 4.24Å; Y220-F314 HydrophobicContact CD1-CE2 4.1Å; Y220-F314 HydrophobicContact CE1-CE2 4.02Å; Y220-F314 HydrophobicContact CG-CE2 4.36Å; Y220-Q318 HydrophobicContact CD2-CG 3.74Å; Y220-Q318 HydrophobicContact CE2-CG 3.46Å; Y220-Q318 VanDerWaalsContact CE2-CG 3.46Å
221	D	84	Confident	87.7	Confident	41 Å²	41	59.2 Å²	59.2	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-47	-180	-64.9	-19.9	0	0	0	110.8	W217 G223 L224 E225 R304	W217-D221 VanDerWaalsContact O-CG 3.24Å; W217-D221 PolarHBondContact O-N 3.38Å; D221-G223 VanDerWaalsContact C-N 3.28Å; D221-G223 PolarHBondContact O-N 2.97Å; D221-L224 PolarHBondContact O-N 3.47Å; D221-E225 PolarHBondContact O-N 3.22Å; D221-R304 VanDerWaalsContact CG-NH1 3.31Å; D221-R304 IonicContact OD1-CZ 2.83Å; D221-R304 VanDerWaalsContact OD1-CZ 3.22Å; D221-R304 IonicContact OD1-NH1 3.6Å; D221-R304 PolarHBondContact OD1-NH1 2.98Å; D221-R304 IonicContact OD1-NH2 3.44Å; D221-R304 PolarHBondContact OD1-NH2 3.32Å; D221-R304 IonicContact OD2-CZ 3.23Å; D221-R304 IonicContact OD2-NH1 3.6Å; D221-R304 PolarHBondContact OD2-NH1 2.97Å
222	T	89.1	Confident	88.1	Confident	55 Å²	55	56 Å²	56	34%	0.337	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-39.9	175	-53.8	0	0	0	0	111.7	A218 Y220 L226 R238	A218-T222 WeakPolarHBondContact O-CB 3.4Å; A218-T222 PolarHBondContact O-N 2.91Å; A218-T222 VanDerWaalsContact O-N 3.13Å; A218-T222 PolarHBondContact O-OG1 2.81Å; Y220-T222 PolarHBondContact O-N 3.39Å; T222-L226 HydrophobicContact CG2-CD1 4.13Å; T222-L226 WeakPolarHBondContact O-CD1 3.46Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.3Å; T222-L226 PolarHBondContact O-N 2.99Å; T222-R238 HydrophobicContact CG2-CG 4.04Å
223	G	90.1	Very high	88.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-42.5	177.7	0	0	0	0	0	112.4	A219 Y220 D221 L226 L227	A219-G223 PolarHBondContact O-N 3.15Å; Y220-G223 WeakPolarHBondContact O-CA 3.46Å; Y220-G223 PolarHBondContact O-N 3.35Å; Y220-G223 VanDerWaalsContact O-N 3.07Å; D221-G223 VanDerWaalsContact C-N 3.28Å; D221-G223 PolarHBondContact O-N 2.97Å; G223-L226 PolarHBondContact O-N 2.86Å; G223-L227 WeakPolarHBondContact O-CG 3.42Å; G223-L227 PolarHBondContact O-N 2.97Å; G223-L227 VanDerWaalsContact O-N 3.13Å
224	L	85.1	Confident	89.2	Confident	32 Å²	32	57 Å²	57	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-46	177.3	-66.7	-176.2	0	0	0	112.1	Y220 D221 L226 L227 E228 R321	Y220-L224 HydrophobicContact CD1-CD1 4.01Å; Y220-L224 HydrophobicContact CE1-CD1 3.52Å; Y220-L224 HydrophobicContact CE1-CG 4.24Å; Y220-L224 HydrophobicContact CE2-CD1 4.47Å; Y220-L224 HydrophobicContact CE2-CD2 4.35Å; Y220-L224 HydrophobicContact CE2-CG 4.41Å; Y220-L224 WeakPolarHBondContact O-CG 3.2Å; Y220-L224 PolarHBondContact O-N 3.18Å; D221-L224 PolarHBondContact O-N 3.47Å; L224-L226 PolarHBondContact O-N 2.66Å; L224-L227 WeakPolarHBondContact O-CB 3.5Å; L224-L227 PolarHBondContact O-N 2.97Å; L224-E228 WeakPolarHBondContact O-CG 3.47Å; L224-E228 PolarHBondContact O-N 3.44Å; L224-R321 HydrophobicContact CD2-CG 4.18Å
225	E	81.9	Confident	89.7	Confident	93 Å²	93	55.6 Å²	55.6	44%	0.435	29%	0.292	S	S	.	.	H	α-helix	trans	-56.3	-39.7	176.4	-74.4	-176.8	-154	0	0	112.3	D221 E228 R229	D221-E225 PolarHBondContact O-N 3.22Å; E225-E228 PolarHBondContact O-N 2.79Å; E225-R229 WeakPolarHBondContact O-CG 3.36Å; E225-R229 PolarHBondContact O-N 2.84Å; E225-R229 IonicContact OE2-NH2 2.74Å; E225-R229 PolarHBondContact OE2-NH2 2.89Å
226	L	88.6	Confident	90	Very high	23 Å²	23	52 Å²	52	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-69.6	-36	177.8	-71	167.8	0	0	0	112	T222 G223 L224 R229 Q230 E231 L234 A235 R238	T222-L226 HydrophobicContact CG2-CD1 4.13Å; T222-L226 WeakPolarHBondContact O-CD1 3.46Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.3Å; T222-L226 PolarHBondContact O-N 2.99Å; G223-L226 PolarHBondContact O-N 2.86Å; L224-L226 PolarHBondContact O-N 2.66Å; L226-R229 PolarHBondContact O-N 2.99Å; L226-Q230 PolarHBondContact O-N 3.5Å; L226-E231 HydrophobicContact CD2-CB 4.37Å; L226-E231 WeakPolarHBondContact CD2-OE2 3.46Å; L226-E231 PolarHBondContact O-N 3.23Å; L226-L234 HydrophobicContact CD1-CB 4.14Å; L226-L234 HydrophobicContact CD2-CB 4.25Å; L226-A235 HydrophobicContact CB-CB 3.73Å; L226-R238 HydrophobicContact CD1-CG 4.21Å
227	L	82.4	Confident	90.2	Very high	33 Å²	33	55.5 Å²	55.5	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-39.3	173.8	-71.3	-177.7	0	0	0	112.1	G223 L224 R229 Q230 A232 A235 L239 R321 A325	G223-L227 WeakPolarHBondContact O-CG 3.42Å; G223-L227 PolarHBondContact O-N 2.97Å; G223-L227 VanDerWaalsContact O-N 3.13Å; L224-L227 WeakPolarHBondContact O-CB 3.5Å; L224-L227 PolarHBondContact O-N 2.97Å; L227-R229 PolarHBondContact O-N 3.34Å; L227-Q230 WeakPolarHBondContact O-CA 3.46Å; L227-Q230 PolarHBondContact O-N 3.22Å; L227-A232 HydrophobicContact CD2-CB 4.29Å; L227-A235 HydrophobicContact CD2-CB 3.62Å; L227-A235 HydrophobicContact CG-CB 3.82Å; L227-L239 HydrophobicContact CD1-CD1 3.87Å; L227-L239 HydrophobicContact CD2-CD1 4.45Å; L227-L239 HydrophobicContact CG-CD1 4.28Å; L227-R321 HydrophobicContact CD1-CB 4.27Å; L227-A325 HydrophobicContact CD2-CB 3.96Å
228	E	82.4	Confident	90.7	Very high	161 Å²	161	60.4 Å²	60.4	75%	0.752	31%	0.309	S	S	*	.	H	α-helix	trans	-61.4	-35	175	-70.6	-179.5	168.5	0	0	112.1	L224 E225 Q230	L224-E228 WeakPolarHBondContact O-CG 3.47Å; L224-E228 PolarHBondContact O-N 3.44Å; E225-E228 PolarHBondContact O-N 2.79Å; E228-Q230 PolarHBondContact O-N 3.23Å
229	R	90.3	Very high	91.1	Very high	152 Å²	152	58.6 Å²	58.6	57%	0.574	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	2.9	173.7	-64	174.8	-164.6	167.6	14	113.7	E225 L226 L227 E231	E225-R229 WeakPolarHBondContact O-CG 3.36Å; E225-R229 PolarHBondContact O-N 2.84Å; E225-R229 IonicContact OE2-NH2 2.74Å; E225-R229 PolarHBondContact OE2-NH2 2.89Å; L226-R229 PolarHBondContact O-N 2.99Å; L227-R229 PolarHBondContact O-N 3.34Å; R229-E231 HydrophobicContact CB-CG 4.17Å; R229-E231 PolarHBondContact O-N 3.26Å
230	Q	91.2	Very high	91.3	Very high	171 Å²	171	61 Å²	61	80%	0.799	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	23.7	-176	-52.1	-179.5	19.7	0	0	113.8	L226 L227 E228 A232	L226-Q230 PolarHBondContact O-N 3.5Å; L227-Q230 WeakPolarHBondContact O-CA 3.46Å; L227-Q230 PolarHBondContact O-N 3.22Å; E228-Q230 PolarHBondContact O-N 3.23Å; Q230-A232 VanDerWaalsContact C-N 3.35Å; Q230-A232 PolarHBondContact O-N 3.26Å
231	E	94.4	Very high	91.7	Very high	82 Å²	82	64.6 Å²	64.6	38%	0.383	32%	0.322	S	S	.	.			trans	-95.8	54.4	-179.4	-65.2	178.8	-164.1	0	0	111.3	L226 R229 G233 L234 A235	L226-E231 HydrophobicContact CD2-CB 4.37Å; L226-E231 WeakPolarHBondContact CD2-OE2 3.46Å; L226-E231 PolarHBondContact O-N 3.23Å; R229-E231 HydrophobicContact CB-CG 4.17Å; R229-E231 PolarHBondContact O-N 3.26Å; E231-G233 PolarHBondContact O-N 3.23Å; E231-G233 VanDerWaalsContact O-N 3.13Å; E231-L234 HydrophobicContact CB-CB 4.45Å; E231-L234 HydrophobicContact CB-CD1 4.49Å; E231-L234 PolarHBondContact O-N 3.02Å; E231-L234 WeakPolarHBondContact OE2-CD1 3.43Å; E231-A235 PolarHBondContact O-N 3.49Å
232	A	93.8	Very high	92.3	Very high	7 Å²	7	62.6 Å²	62.6	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-55.1	-36.6	-173.3	0	0	0	0	0	114	L227 Q230 L234 A235 L236 A325 Q328 V329	L227-A232 HydrophobicContact CD2-CB 4.29Å; Q230-A232 VanDerWaalsContact C-N 3.35Å; Q230-A232 PolarHBondContact O-N 3.26Å; A232-L234 VanDerWaalsContact C-N 3.3Å; A232-L234 PolarHBondContact O-N 3.23Å; A232-A235 PolarHBondContact O-N 3.14Å; A232-L236 WeakPolarHBondContact O-CG 3.48Å; A232-L236 PolarHBondContact O-N 3.35Å; A232-A325 HydrophobicContact CB-CB 4.46Å; A232-Q328 HydrophobicContact CB-CB 4.08Å; A232-V329 HydrophobicContact CB-CG2 3.87Å
233	G	95.3	Very high	92.8	Very high	45 Å²	45	60 Å²	60	46%	0.464	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-34.3	177.3	0	0	0	0	0	113.9	E231 P237	E231-G233 PolarHBondContact O-N 3.23Å; E231-G233 VanDerWaalsContact O-N 3.13Å; G233-P237 WeakPolarHBondContact O-CD 3.09Å
234	L	96.4	Very high	93.1	Very high	107 Å²	107	63.8 Å²	63.8	56%	0.56	31%	0.313	S	S	*	.	H	α-helix	trans	-84.1	-28.8	176	-63.7	179.2	0	0	0	111.9	L226 E231 A232 P237	L226-L234 HydrophobicContact CD1-CB 4.14Å; L226-L234 HydrophobicContact CD2-CB 4.25Å; E231-L234 HydrophobicContact CB-CB 4.45Å; E231-L234 HydrophobicContact CB-CD1 4.49Å; E231-L234 PolarHBondContact O-N 3.02Å; E231-L234 WeakPolarHBondContact OE2-CD1 3.43Å; A232-L234 VanDerWaalsContact C-N 3.3Å; A232-L234 PolarHBondContact O-N 3.23Å; L234-P237 WeakPolarHBondContact O-CD 3.31Å; L234-P237 WeakPolarHBondContact O-CG 3.48Å
235	A	95.8	Very high	93.7	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68.1	-40.1	176.8	0	0	0	0	0	112.6	L226 L227 E231 A232 R238 L239	L226-A235 HydrophobicContact CB-CB 3.73Å; L227-A235 HydrophobicContact CD2-CB 3.62Å; L227-A235 HydrophobicContact CG-CB 3.82Å; E231-A235 PolarHBondContact O-N 3.49Å; A232-A235 PolarHBondContact O-N 3.14Å; A235-R238 WeakPolarHBondContact O-CA 3.28Å; A235-R238 WeakPolarHBondContact O-CB 3.33Å; A235-R238 PolarHBondContact O-N 3.42Å; A235-L239 HydrophobicContact CB-CD1 4.24Å; A235-L239 WeakPolarHBondContact O-CG 2.9Å; A235-L239 PolarHBondContact O-N 3.11Å
236	L	97.7	Very high	94.4	Very high	18 Å²	18	59 Å²	59	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-47.4	-53.9	-176.8	-80.9	174.8	0	0	0	115.1	A232 R238 L239 E240 L322 A325 H326 V329	A232-L236 WeakPolarHBondContact O-CG 3.48Å; A232-L236 PolarHBondContact O-N 3.35Å; L236-R238 VanDerWaalsContact C-N 3.25Å; L236-R238 PolarHBondContact O-N 3.31Å; L236-L239 PolarHBondContact O-N 2.93Å; L236-E240 WeakPolarHBondContact O-CB 3.45Å; L236-E240 PolarHBondContact O-N 3.1Å; L236-L322 HydrophobicContact CD2-CD2 4.32Å; L236-A325 HydrophobicContact CD2-CB 3.56Å; L236-A325 HydrophobicContact CG-CB 4.06Å; L236-H326 VanDerWaalsContact CD2-CE1 3.45Å; L236-H326 WeakPolarHBondContact CD2-CE1 3.47Å; L236-V329 HydrophobicContact CD1-CB 4.33Å; L236-V329 HydrophobicContact CD1-CG2 4Å
237	P	97.8	Very high	94.7	Very high	78 Å²	78	59 Å²	59	51%	0.506	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-31	178.6	23.9	-34.7	0	0	0	113.1	G233 L234 E241	G233-P237 WeakPolarHBondContact O-CD 3.09Å; L234-P237 WeakPolarHBondContact O-CD 3.31Å; L234-P237 WeakPolarHBondContact O-CG 3.48Å; P237-E241 VanDerWaalsContact O-CB 3.28Å; P237-E241 WeakPolarHBondContact O-CB 3.49Å; P237-E241 PolarHBondContact O-N 3.14Å
238	R	97.9	Very high	95.2	Very high	109 Å²	109	60 Å²	60	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-73.7	-40.3	177.4	-63	-58.3	-174.9	-175.7	3.8	112.3	T222 L226 A235 L236 E240 E241 A242	T222-R238 HydrophobicContact CG2-CG 4.04Å; L226-R238 HydrophobicContact CD1-CG 4.21Å; A235-R238 WeakPolarHBondContact O-CA 3.28Å; A235-R238 WeakPolarHBondContact O-CB 3.33Å; A235-R238 PolarHBondContact O-N 3.42Å; L236-R238 VanDerWaalsContact C-N 3.25Å; L236-R238 PolarHBondContact O-N 3.31Å; R238-E240 VanDerWaalsContact C-N 3.34Å; R238-E241 IonicContact CZ-OE2 3.98Å; R238-E241 IonicContact NH1-OE2 3.18Å; R238-E241 PolarHBondContact NH1-OE2 3.47Å; R238-E241 PolarHBondContact O-N 3Å; R238-A242 WeakPolarHBondContact O-CB 3.37Å; R238-A242 PolarHBondContact O-N 3.01Å
239	L	96.5	Very high	95.7	Very high	2 Å²	2	56 Å²	56	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-67	-36.9	174.8	-64.9	170.9	0	0	0	111.7	L227 A235 L236 A242 L243 R321 L322 A325	L227-L239 HydrophobicContact CD1-CD1 3.87Å; L227-L239 HydrophobicContact CD2-CD1 4.45Å; L227-L239 HydrophobicContact CG-CD1 4.28Å; A235-L239 HydrophobicContact CB-CD1 4.24Å; A235-L239 WeakPolarHBondContact O-CG 2.9Å; A235-L239 PolarHBondContact O-N 3.11Å; L236-L239 PolarHBondContact O-N 2.93Å; L239-A242 WeakPolarHBondContact O-CB 3.28Å; L239-A242 PolarHBondContact O-N 3.26Å; L239-L243 PolarHBondContact O-N 2.76Å; L239-R321 HydrophobicContact CD1-CB 4.29Å; L239-R321 HydrophobicContact CD2-CB 4.36Å; L239-L322 HydrophobicContact CB-CD2 3.52Å; L239-L322 HydrophobicContact CB-CG 3.97Å; L239-A325 HydrophobicContact CD1-CB 4.22Å
240	E	97.8	Very high	95.8	Very high	56 Å²	56	49 Å²	49	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-69.4	-41.2	175.2	-172.3	58.9	-144.9	0	0	111.3	L236 R238 A242 L243 Q244 R373	L236-E240 WeakPolarHBondContact O-CB 3.45Å; L236-E240 PolarHBondContact O-N 3.1Å; R238-E240 VanDerWaalsContact C-N 3.34Å; E240-A242 VanDerWaalsContact C-N 3.3Å; E240-A242 PolarHBondContact O-N 2.96Å; E240-L243 PolarHBondContact O-N 2.87Å; E240-Q244 WeakPolarHBondContact O-CB 3.45Å; E240-Q244 WeakPolarHBondContact O-CG 3.26Å; E240-Q244 PolarHBondContact O-N 2.94Å; E240-Q244 PolarHBondContact OE1-NE2 3.29Å; E240-Q244 VanDerWaalsContact OE1-NE2 3.13Å; E240-R373 IonicContact OE1-CZ 3.72Å; E240-R373 IonicContact OE1-NH1 2.59Å; E240-R373 PolarHBondContact OE1-NH1 3.4Å; E240-R373 IonicContact OE1-NH2 3.93Å; E240-R373 PolarHBondContact OE1-NH2 2.89Å; E240-R373 IonicContact OE2-CZ 2.81Å; E240-R373 IonicContact OE2-NH1 3.73Å; E240-R373 PolarHBondContact OE2-NH1 3.11Å; E240-R373 IonicContact OE2-NH2 2.89Å
241	E	98.1	Very high	95.8	Very high	91 Å²	91	44.1 Å²	44.1	43%	0.425	24%	0.242	S	C	.	.	H	α-helix	trans	-59	-41.3	171.5	-178.3	178.4	-166.9	0	0	111.5	A219 P237 R238 G245	A219-E241 HydrophobicContact CB-CB 4.01Å; A219-E241 HydrophobicContact CB-CG 3.77Å; P237-E241 VanDerWaalsContact O-CB 3.28Å; P237-E241 WeakPolarHBondContact O-CB 3.49Å; P237-E241 PolarHBondContact O-N 3.14Å; R238-E241 IonicContact CZ-OE2 3.98Å; R238-E241 IonicContact NH1-OE2 3.18Å; R238-E241 PolarHBondContact NH1-OE2 3.47Å; R238-E241 PolarHBondContact O-N 3Å; E241-G245 WeakPolarHBondContact O-CA 3.08Å; E241-G245 PolarHBondContact O-N 3.31Å
242	A	96.9	Very high	95.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-45.9	175.6	0	0	0	0	0	112.4	A219 Y220 R238 L239 E240 G245 S246 Q318	A219-A242 HydrophobicContact CB-CB 4.05Å; Y220-A242 HydrophobicContact CD2-CB 4.24Å; R238-A242 WeakPolarHBondContact O-CB 3.37Å; R238-A242 PolarHBondContact O-N 3.01Å; L239-A242 WeakPolarHBondContact O-CB 3.28Å; L239-A242 PolarHBondContact O-N 3.26Å; E240-A242 VanDerWaalsContact C-N 3.3Å; E240-A242 PolarHBondContact O-N 2.96Å; A242-G245 PolarHBondContact O-N 3.48Å; A242-S246 WeakPolarHBondContact O-CB 3.44Å; A242-S246 PolarHBondContact O-N 3.06Å; A242-S246 PolarHBondContact O-OG 3.03Å; A242-Q318 PolarHBondContact O-OE1 2.89Å
243	L	97.8	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-49.3	-178.7	179.1	64.4	0	0	0	111.5	L239 E240 G245 S246 L247 L315 Q318 L319 L322 R373 I376	L239-L243 PolarHBondContact O-N 2.76Å; E240-L243 PolarHBondContact O-N 2.87Å; L243-G245 VanDerWaalsContact C-N 3.32Å; L243-G245 PolarHBondContact O-N 2.89Å; L243-S246 WeakPolarHBondContact O-CB 3.37Å; L243-S246 PolarHBondContact O-N 2.77Å; L243-L247 PolarHBondContact O-N 3.11Å; L243-L315 HydrophobicContact CD1-CD2 3.72Å; L243-Q318 HydrophobicContact CD1-CB 4.28Å; L243-L319 HydrophobicContact CD2-CD2 3.72Å; L243-L322 HydrophobicContact CB-CD1 4.18Å; L243-L322 HydrophobicContact CD2-CD1 3.61Å; L243-R373 VanDerWaalsContact CD2-CZ 3.45Å; L243-I376 HydrophobicContact CD1-CD1 4.3Å
244	Q	97.4	Very high	95	Very high	80 Å²	80	40.4 Å²	40.4	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-41.8	177.2	-68.3	-57.1	-36.9	0	0	111.3	E240 S246 L247 A248 D375	E240-Q244 WeakPolarHBondContact O-CB 3.45Å; E240-Q244 WeakPolarHBondContact O-CG 3.26Å; E240-Q244 PolarHBondContact O-N 2.94Å; E240-Q244 PolarHBondContact OE1-NE2 3.29Å; E240-Q244 VanDerWaalsContact OE1-NE2 3.13Å; Q244-S246 VanDerWaalsContact C-N 3.33Å; Q244-S246 PolarHBondContact O-N 3.37Å; Q244-L247 PolarHBondContact O-N 2.74Å; Q244-A248 WeakPolarHBondContact O-CB 3.36Å; Q244-A248 PolarHBondContact O-N 3.4Å; Q244-D375 PolarHBondContact NE2-OD2 3.01Å
245	G	96.6	Very high	94.4	Very high	24 Å²	24	35.6 Å²	35.6	25%	0.247	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-40.8	174.9	0	0	0	0	0	112.3	E241 A242 L243 A248 Q249	E241-G245 WeakPolarHBondContact O-CA 3.08Å; E241-G245 PolarHBondContact O-N 3.31Å; A242-G245 PolarHBondContact O-N 3.48Å; L243-G245 VanDerWaalsContact C-N 3.32Å; L243-G245 PolarHBondContact O-N 2.89Å; G245-A248 PolarHBondContact O-N 3Å; G245-Q249 WeakPolarHBondContact O-CB 3.43Å; G245-Q249 PolarHBondContact O-N 3.28Å
246	S	96.6	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-47.4	177.4	-61.1	0	0	0	0	111.1	H216 A242 L243 Q244 A248 Q249 M250 T301 F314 Q318	H216-S246 PolarHBondContact CD2-OG 2.75Å; A242-S246 WeakPolarHBondContact O-CB 3.44Å; A242-S246 PolarHBondContact O-N 3.06Å; A242-S246 PolarHBondContact O-OG 3.03Å; L243-S246 WeakPolarHBondContact O-CB 3.37Å; L243-S246 PolarHBondContact O-N 2.77Å; Q244-S246 VanDerWaalsContact C-N 3.33Å; Q244-S246 PolarHBondContact O-N 3.37Å; S246-A248 PolarHBondContact O-N 3.43Å; S246-Q249 PolarHBondContact O-N 3.47Å; S246-M250 WeakPolarHBondContact O-CG 3.25Å; S246-M250 PolarHBondContact O-N 3.36Å; S246-T301 WeakPolarHBondContact O-CG2 3.32Å; S246-F314 WeakPolarHBondContact OG-CE1 3.22Å; S246-Q318 PolarHBondContact OG-NE2 3.13Å; S246-Q318 VanDerWaalsContact OG-NE2 3.08Å
247	L	95.9	Very high	93	Very high	22 Å²	22	38.5 Å²	38.5	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-42.6	176.4	-68.1	172.8	0	0	0	111.6	L243 Q244 M250 E251 L315 D375 I376 F379	L243-L247 PolarHBondContact O-N 3.11Å; Q244-L247 PolarHBondContact O-N 2.74Å; L247-M250 WeakPolarHBondContact O-CB 3.46Å; L247-M250 PolarHBondContact O-N 2.84Å; L247-E251 PolarHBondContact O-N 3.42Å; L247-L315 HydrophobicContact CD2-CD1 4.13Å; L247-L315 HydrophobicContact CD2-CD2 4.21Å; L247-L315 HydrophobicContact CG-CD2 4.5Å; L247-D375 HydrophobicContact CD1-CB 4.11Å; L247-I376 HydrophobicContact CD1-CD1 4.22Å; L247-F379 HydrophobicContact CD2-CD2 4.21Å; L247-F379 HydrophobicContact CD2-CG 4.43Å
248	A	93	Very high	92	Very high	55 Å²	55	36.5 Å²	36.5	46%	0.455	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-41.1	176.8	0	0	0	0	0	112.4	Q244 G245 S246 M250 E251 S252	Q244-A248 WeakPolarHBondContact O-CB 3.36Å; Q244-A248 PolarHBondContact O-N 3.4Å; G245-A248 PolarHBondContact O-N 3Å; S246-A248 PolarHBondContact O-N 3.43Å; A248-M250 VanDerWaalsContact C-N 3.32Å; A248-M250 PolarHBondContact O-N 2.94Å; A248-E251 PolarHBondContact O-N 2.65Å; A248-S252 PolarHBondContact O-N 2.72Å
249	Q	92.6	Very high	90.5	Very high	78 Å²	78	32.9 Å²	32.9	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-63.2	-39.6	175.6	-177.6	58.7	42.5	0	0	111.4	G245 S246 S252 C253 T301	G245-Q249 WeakPolarHBondContact O-CB 3.43Å; G245-Q249 PolarHBondContact O-N 3.28Å; S246-Q249 PolarHBondContact O-N 3.47Å; Q249-S252 WeakPolarHBondContact O-CB 3.48Å; Q249-S252 PolarHBondContact O-N 3.37Å; Q249-C253 PolarHBondContact O-N 2.93Å; Q249-T301 HydrophobicContact CB-CG2 4.13Å; Q249-T301 HydrophobicContact CG-CG2 4.16Å
250	M	92.7	Very high	89	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-44.9	173	-69.5	178.8	-170.5	0	0	111.5	S246 L247 A248 S252 C253 R254 V298 T301 L315 F379	S246-M250 WeakPolarHBondContact O-CG 3.25Å; S246-M250 PolarHBondContact O-N 3.36Å; L247-M250 WeakPolarHBondContact O-CB 3.46Å; L247-M250 PolarHBondContact O-N 2.84Å; A248-M250 VanDerWaalsContact C-N 3.32Å; A248-M250 PolarHBondContact O-N 2.94Å; M250-S252 VanDerWaalsContact C-N 3.33Å; M250-S252 PolarHBondContact O-N 3.49Å; M250-C253 PolarHBondContact O-N 3.44Å; M250-R254 WeakPolarHBondContact O-CB 3.45Å; M250-R254 WeakPolarHBondContact O-CD 3.16Å; M250-R254 WeakPolarHBondContact O-CG 3.4Å; M250-R254 PolarHBondContact O-N 3.38Å; M250-V298 HydrophobicContact CE-CG1 4.18Å; M250-V298 HydrophobicContact SD-CG2 4.47Å; M250-T301 HydrophobicContact CE-CG2 3.84Å; M250-T301 HydrophobicContact CG-CG2 3.93Å; M250-T301 VanDerWaalsContact CG-OG1 3.23Å; M250-T301 WeakPolarHBondContact CG-OG1 3.35Å; M250-T301 PolarHBondContact N-OG1 3.4Å; M250-L315 HydrophobicContact CE-CD1 3.67Å; M250-L315 HydrophobicContact CE-CD2 4.16Å; M250-L315 HydrophobicContact CE-CG 3.79Å; M250-L315 HydrophobicContact SD-CD1 3.94Å; M250-F379 HydrophobicContact SD-CE2 3.72Å; M250-F379 HydrophobicContact SD-CZ 4.29Å
251	E	89.8	Confident	87	Confident	70 Å²	70	38.9 Å²	38.9	33%	0.327	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-39	176.1	-67.4	-51.3	137.7	0	0	112.6	L75 L247 A248 R254 A255 R382	L75-E251 HydrophobicContact CD1-CB 4.42Å; L247-E251 PolarHBondContact O-N 3.42Å; A248-E251 PolarHBondContact O-N 2.65Å; E251-R254 PolarHBondContact O-N 3.47Å; E251-A255 PolarHBondContact O-N 3.35Å; E251-R382 IonicContact OE1-CZ 3.9Å; E251-R382 IonicContact OE1-NH1 3.96Å; E251-R382 PolarHBondContact OE1-NH1 3.13Å; E251-R382 IonicContact OE1-NH2 3.95Å; E251-R382 PolarHBondContact OE1-NH2 3.18Å; E251-R382 IonicContact OE2-NH1 3.9Å; E251-R382 PolarHBondContact OE2-NH1 3.18Å
252	S	88.1	Confident	84.9	Confident	30 Å²	30	37.7 Å²	37.7	21%	0.21	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-50	174.1	-168.1	0	0	0	0	111.3	A248 Q249 M250 R254 A255 D256	A248-S252 PolarHBondContact O-N 2.72Å; Q249-S252 WeakPolarHBondContact O-CB 3.48Å; Q249-S252 PolarHBondContact O-N 3.37Å; M250-S252 VanDerWaalsContact C-N 3.33Å; M250-S252 PolarHBondContact O-N 3.49Å; S252-R254 VanDerWaalsContact C-N 3.34Å; S252-R254 PolarHBondContact O-N 3.48Å; S252-A255 WeakPolarHBondContact O-CB 3.41Å; S252-A255 PolarHBondContact O-N 3.37Å; S252-D256 PolarHBondContact O-N 3.24Å
253	C	89.4	Confident	82.4	Confident	12 Å²	12	46.6 Å²	46.6	8%	0.081	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-43	175.9	173.1	0	0	0	0	112.1	Q249 M250 A255 D256 C257 C297 E300	Q249-C253 PolarHBondContact O-N 2.93Å; M250-C253 PolarHBondContact O-N 3.44Å; C253-A255 VanDerWaalsContact C-N 3.25Å; C253-A255 PolarHBondContact O-N 3.39Å; C253-D256 WeakPolarHBondContact O-CB 3.43Å; C253-D256 PolarHBondContact O-N 3.41Å; C253-C257 PolarHBondContact O-N 3.01Å; C253-C297 HydrophobicContact CB-CB 3.66Å; C253-C297 WeakPolarHBondContact CB-SG 3.14Å; C253-C297 WeakPolarHBondContact SG-CA 3.38Å; C253-C297 WeakPolarHBondContact SG-CB 3.5Å; C253-C297 CovalentContact SG-SG 2.04Å; C253-C297 PolarHBondContact SG-SG 3.36Å; C253-E300 PolarHBondContact SG-OE2 3.47Å; C253-E300 VanDerWaalsContact SG-OE2 3.39Å
254	R	89.4	Confident	79.8	Confident	13 Å²	13	54.6 Å²	54.6	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-26.5	-179.2	-70	166.9	65.5	81.2	8	113	M250 E251 S252 R294 C297 E386	M250-R254 WeakPolarHBondContact O-CB 3.45Å; M250-R254 WeakPolarHBondContact O-CD 3.16Å; M250-R254 WeakPolarHBondContact O-CG 3.4Å; M250-R254 PolarHBondContact O-N 3.38Å; E251-R254 PolarHBondContact O-N 3.47Å; S252-R254 VanDerWaalsContact C-N 3.34Å; S252-R254 PolarHBondContact O-N 3.48Å; R254-R294 HydrophobicContact CB-CG 4.08Å; R254-R294 HydrophobicContact CG-CB 4.23Å; R254-R294 HydrophobicContact CG-CG 4.05Å; R254-R294 PolarHBondContact NH1-O 3.01Å; R254-C297 HydrophobicContact CG-CB 3.98Å; R254-C297 PolarHBondContact N-SG 3.34Å; R254-C297 VanDerWaalsContact N-SG 3.44Å; R254-E386 IonicContact CZ-OE1 2.81Å; R254-E386 IonicContact CZ-OE2 3.4Å; R254-E386 IonicContact NH1-OE1 3.5Å; R254-E386 IonicContact NH1-OE2 3.43Å; R254-E386 PolarHBondContact NH1-OE2 3.11Å; R254-E386 VanDerWaalsContact NH2-CD 3.27Å; R254-E386 IonicContact NH2-OE1 3.42Å; R254-E386 PolarHBondContact NH2-OE1 3.43Å; R254-E386 IonicContact NH2-OE2 2.75Å; R254-E386 PolarHBondContact NH2-OE2 2.93Å; R254-E386 VanDerWaalsContact NH2-OE2 3.11Å
255	A	84.1	Confident	76.9	Confident	7 Å²	7	54 Å²	54	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-70.4	-35.6	172.1	0	0	0	0	0	111.7	L75 E251 S252 C253 C257 Q258	L75-A255 HydrophobicContact CB-CB 4.22Å; L75-A255 HydrophobicContact CD1-CB 4.03Å; E251-A255 PolarHBondContact O-N 3.35Å; S252-A255 WeakPolarHBondContact O-CB 3.41Å; S252-A255 PolarHBondContact O-N 3.37Å; C253-A255 VanDerWaalsContact C-N 3.25Å; C253-A255 PolarHBondContact O-N 3.39Å; A255-C257 PolarHBondContact O-N 3.37Å; A255-Q258 PolarHBondContact O-N 3.43Å
256	D	80.8	Confident	73.9	Confident	65 Å²	65	58 Å²	58	35%	0.348	34%	0.342	S	S	.	.	H	α-helix	trans	-68.6	-20	176	-80.6	-41.9	0	0	0	113.8	R74 S252 C253 Q258	R74-D256 WeakPolarHBondContact CD-OD1 3.27Å; R74-D256 IonicContact CZ-OD1 2.97Å; R74-D256 IonicContact NE-OD1 2.94Å; R74-D256 IonicContact NH1-OD1 3.84Å; R74-D256 PolarHBondContact NH1-OD1 3.47Å; S252-D256 PolarHBondContact O-N 3.24Å; C253-D256 WeakPolarHBondContact O-CB 3.43Å; C253-D256 PolarHBondContact O-N 3.41Å; D256-Q258 PolarHBondContact O-N 2.9Å
257	C	83.6	Confident	71	Confident	13 Å²	13	66.4 Å²	66.4	9%	0.088	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.4	173.8	-62.5	0	0	0	0	114	C253 A255 C293 R294	C253-C257 PolarHBondContact O-N 3.01Å; A255-C257 PolarHBondContact O-N 3.37Å; C257-C293 WeakPolarHBondContact CA-SG 3.22Å; C257-C293 HydrophobicContact CB-CB 3.67Å; C257-C293 WeakPolarHBondContact CB-SG 3.26Å; C257-C293 WeakPolarHBondContact SG-CB 3.35Å; C257-C293 CovalentContact SG-SG 2.04Å; C257-C293 PolarHBondContact SG-SG 2.97Å; C257-R294 HydrophobicContact CB-CG 3.96Å; C257-R294 PolarHBondContact SG-N 2.84Å; C257-R294 VanDerWaalsContact SG-N 3.38Å
258	Q	76.3	Confident	68.2	Low	37 Å²	37	74.4 Å²	74.4	17%	0.173	42%	0.419	C	S	.	.			trans	-94.8	104.6	-177.9	-63.2	176.1	45.7	0	0	109.8	R121 L125 A255 D256	R121-Q258 VanDerWaalsContact NE-OE1 3.1Å; L125-Q258 HydrophobicContact CD1-CB 4.37Å; A255-Q258 PolarHBondContact O-N 3.43Å; D256-Q258 PolarHBondContact O-N 2.9Å
259	G	67.3	Low	65.5	Low	33 Å²	33	80.2 Å²	80.2	34%	0.34	44%	0.437	S	S	.	.	S	Bend	trans	-177.2	168.6	179.2	0	0	0	0	0	111.9	H286	G259-H286 PolarHBondContact O-CE1 3.04Å
260	P	63.7	Low	62.8	Low	93 Å²	93	86 Å²	86	60%	0.604	46%	0.463	S	S	*	.	S	Bend	trans	-55	142.2	176.3	18.3	-27.8	0	0	0	110.9	R142 E262	R142-P260 PolarHBondContact NH2-O 3.29Å; P260-E262 PolarHBondContact O-N 2.72Å
261	E	56.5	Low	60.1	Low	91 Å²	91	92.8 Å²	92.8	43%	0.425	50%	0.5	S	S	.	.			trans	-49.7	129.7	175.2	-171.6	164.3	-150	0	0	109	R142	R142-E261 PolarHBondContact NH2-O 3.44Å
262	E	54.2	Low	57.5	Low	66 Å²	66	92.8 Å²	92.8	31%	0.308	52%	0.519	S	S	.	.			trans	-82.7	113.1	166	-76	163.7	-157.2	0	0	105.3	R148 P260 E264	R148-E262 IonicContact CZ-OE1 3.28Å; R148-E262 IonicContact CZ-OE2 3.19Å; R148-E262 IonicContact NH1-OE1 3.19Å; R148-E262 PolarHBondContact NH1-OE1 2.96Å; R148-E262 IonicContact NH1-OE2 2.6Å; R148-E262 IonicContact NH2-OE1 2.92Å; R148-E262 PolarHBondContact NH2-OE1 3.47Å; R148-E262 IonicContact NH2-OE2 2.63Å; R148-E262 PolarHBondContact NH2-OE2 3.21Å; P260-E262 PolarHBondContact O-N 2.72Å; E262-E264 PolarHBondContact O-N 3.27Å
263	Q	45.4	Very low	55	Low	186 Å²	186	96.1 Å²	96.1	87%	0.869	55%	0.548	S	S	*	.			trans	-53	111.9	164.3	-84	154.3	-7.6	0	0	106.2	G265	Q263-G265 PolarHBondContact O-N 3.27Å
264	E	41.4	Very low	52.8	Low	169 Å²	169	99.8 Å²	99.8	79%	0.79	59%	0.588	S	S	*	*			trans	-48.3	134.2	163.1	-69.9	-179	150.9	0	0	106.2	E262 A266	E262-E264 PolarHBondContact O-N 3.27Å; E264-A266 PolarHBondContact O-N 2.94Å; E264-A266 VanDerWaalsContact O-N 3.11Å
265	G	37.5	Very low	50.7	Low	66 Å²	66	104 Å²	104	68%	0.68	62%	0.619	S	S	*	*			trans	-49	127.5	179.4	0	0	0	0	0	108.1	Q263 E267	Q263-G265 PolarHBondContact O-N 3.27Å; G265-E267 PolarHBondContact O-N 3.14Å
266	A	33.5	Very low	49.4	Very low	108 Å²	108	113 Å²	113	89%	0.893	66%	0.66	S	S	*	*	S	Bend	trans	-66	69.7	173.7	0	0	0	0	0	109.7	E264	E264-A266 PolarHBondContact O-N 2.94Å; E264-A266 VanDerWaalsContact O-N 3.11Å
267	E	35.8	Very low	48.3	Very low	178 Å²	178	110.5 Å²	110.5	83%	0.832	65%	0.65	S	S	*	*			trans	-130.1	109.1	163.5	-67.8	-178.5	-172.7	0	0	103.2	G265	G265-E267 PolarHBondContact O-N 3.14Å
268	E	37.5	Very low	48.1	Very low	189 Å²	189	112 Å²	112	88%	0.883	67%	0.668	S	S	*	*	S	Bend	trans	90.4	70.8	-170.6	-51.7	-179.3	-169.8	0	0	115.7
269	E	35.3	Very low	48.2	Very low	178 Å²	178	116 Å²	116	83%	0.832	69%	0.69	S	S	*	*			trans	-167.6	66.7	132.8	-102.5	177.8	-155.6	0	0	108.4	D271	E269-D271 PolarHBondContact O-N 2.95Å
270	E	37.1	Very low	48.7	Very low	198 Å²	198	120.8 Å²	120.8	93%	0.925	70%	0.699	S	S	*	*			trans	-78.9	65.6	146.4	-90.7	-166.1	158.4	0	0	107.1
271	D	34.7	Very low	49.6	Very low	146 Å²	146	121.7 Å²	121.7	78%	0.781	70%	0.695	S	S	*	*	S	Bend	trans	-165.2	107.2	159.5	-96.1	-29.6	0	0	0	109.9	E269	E269-D271 PolarHBondContact O-N 2.95Å
272	G	35.8	Very low	50.7	Low	71 Å²	71	119.4 Å²	119.4	73%	0.732	69%	0.691	S	S	*	*	S	Bend	trans	89.4	92.3	151.3	0	0	0	0	0	117.8
273	A	35.5	Very low	51.9	Low	99 Å²	99	119.5 Å²	119.5	82%	0.818	69%	0.693	S	S	*	*			trans	55.2	90.8	142.5	0	0	0	0	0	117.1	S275	A273-S275 VanDerWaalsContact C-N 3.3Å; A273-S275 PolarHBondContact O-N 2.89Å
274	G	43.3	Very low	53.6	Low	89 Å²	89	112.3 Å²	112.3	92%	0.918	67%	0.665	S	S	*	*			trans	-57.1	90.1	159.6	0	0	0	0	0	111.9
275	S	45.6	Very low	55.6	Low	102 Å²	102	109.9 Å²	109.9	71%	0.713	65%	0.649	S	S	*	*			trans	-84.8	100.6	153.6	-172.2	0	0	0	0	106.1	A273 G277	A273-S275 VanDerWaalsContact C-N 3.3Å; A273-S275 PolarHBondContact O-N 2.89Å; S275-G277 PolarHBondContact O-N 2.87Å
276	Q	55.6	Low	57.8	Low	195 Å²	195	109.7 Å²	109.7	91%	0.911	63%	0.63	S	S	*	*			trans	-58.2	99.3	157.6	-76.8	-175.9	-10.1	0	0	106
277	G	59	Low	60.2	Low	13 Å²	13	108.3 Å²	108.3	13%	0.134	60%	0.602	C	S	.	*			trans	-50.2	153.8	176.6	0	0	0	0	0	111.5	S275 E281	S275-G277 PolarHBondContact O-N 2.87Å; G277-E281 WeakPolarHBondContact CA-OE2 3.41Å
278	G	78.9	Confident	62.7	Low	45 Å²	45	100.6 Å²	100.6	46%	0.464	57%	0.566	S	S	.	*			trans	-55	163.7	178.5	0	0	0	0	0	112.3	Y280 E281 A282	G278-Y280 PolarHBondContact O-N 3.4Å; G278-E281 PolarHBondContact N-OE2 3.47Å; G278-E281 WeakPolarHBondContact O-CA 3.49Å; G278-E281 WeakPolarHBondContact O-CB 3.38Å; G278-E281 PolarHBondContact O-N 2.73Å; G278-A282 PolarHBondContact O-N 2.96Å
279	L	78.5	Confident	65	Low	121 Å²	121	94.5 Å²	94.5	63%	0.634	54%	0.538	S	S	*	.	H	α-helix	trans	-47.5	-40.5	-177.7	177.5	63.3	0	0	0	113.3	A282 I283	L279-A282 PolarHBondContact O-N 2.97Å; L279-I283 HydrophobicContact CD1-CD1 4Å; L279-I283 HydrophobicContact CD1-CG1 4.37Å; L279-I283 HydrophobicContact CG-CD1 3.94Å; L279-I283 VanDerWaalsContact O-CG1 3.26Å; L279-I283 WeakPolarHBondContact O-CG1 3.41Å; L279-I283 PolarHBondContact O-N 2.96Å
280	Y	78.7	Confident	67.4	Low	134 Å²	134	86.2 Å²	86.2	53%	0.525	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-39.2	178	-69.7	-68.8	0	0	0	113.4	E111 L115 G278 I283 A284	E111-Y280 PolarHBondContact OE2-OH 3.29Å; L115-Y280 HydrophobicContact CD1-CE1 4.18Å; G278-Y280 PolarHBondContact O-N 3.4Å; Y280-I283 PolarHBondContact O-N 2.87Å; Y280-A284 VanDerWaalsContact O-CB 3.27Å; Y280-A284 WeakPolarHBondContact O-CB 3.1Å; Y280-A284 PolarHBondContact O-N 3Å
281	E	81.2	Confident	69.9	Low	112 Å²	112	76.9 Å²	76.9	52%	0.523	46%	0.456	S	S	.	.	H	α-helix	trans	-67.9	-38.9	176.7	-66.2	172.4	-172.7	0	0	110.9	G277 G278 A284 R285	G277-E281 WeakPolarHBondContact CA-OE2 3.41Å; G278-E281 PolarHBondContact N-OE2 3.47Å; G278-E281 WeakPolarHBondContact O-CA 3.49Å; G278-E281 WeakPolarHBondContact O-CB 3.38Å; G278-E281 PolarHBondContact O-N 2.73Å; E281-A284 PolarHBondContact O-N 2.79Å; E281-R285 VanDerWaalsContact O-CB 3.26Å; E281-R285 WeakPolarHBondContact O-CB 3.45Å; E281-R285 PolarHBondContact O-N 3.11Å
282	A	80.3	Confident	72.6	Confident	43 Å²	43	72.2 Å²	72.2	36%	0.355	43%	0.429	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.2	0	0	0	0	0	112	G278 L279 H286	G278-A282 PolarHBondContact O-N 2.96Å; L279-A282 PolarHBondContact O-N 2.97Å; A282-H286 WeakPolarHBondContact O-CB 3.25Å; A282-H286 PolarHBondContact O-N 3.45Å
283	I	78.4	Confident	75.2	Confident	68 Å²	68	71 Å²	71	35%	0.349	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-44.7	176.2	-68.7	167.9	0	0	0	110.8	L115 L279 Y280 H286 W287	L115-I283 HydrophobicContact CD2-CD1 3.35Å; L279-I283 HydrophobicContact CD1-CD1 4Å; L279-I283 HydrophobicContact CD1-CG1 4.37Å; L279-I283 HydrophobicContact CG-CD1 3.94Å; L279-I283 VanDerWaalsContact O-CG1 3.26Å; L279-I283 WeakPolarHBondContact O-CG1 3.41Å; L279-I283 PolarHBondContact O-N 2.96Å; Y280-I283 PolarHBondContact O-N 2.87Å; I283-H286 PolarHBondContact O-N 2.98Å; I283-W287 WeakPolarHBondContact O-CB 3.47Å; I283-W287 PolarHBondContact O-N 2.79Å
284	A	82.8	Confident	77.8	Confident	34 Å²	34	67.6 Å²	67.6	28%	0.281	38%	0.375	S	S	.	.	H	α-helix	trans	-61.8	-49.7	178.8	0	0	0	0	0	111.2	Y280 E281 H286 W287 I288	Y280-A284 VanDerWaalsContact O-CB 3.27Å; Y280-A284 WeakPolarHBondContact O-CB 3.1Å; Y280-A284 PolarHBondContact O-N 3Å; E281-A284 PolarHBondContact O-N 2.79Å; A284-H286 PolarHBondContact O-N 3.37Å; A284-W287 PolarHBondContact O-N 2.88Å; A284-I288 WeakPolarHBondContact O-CB 3.43Å; A284-I288 VanDerWaalsContact O-CD1 3.3Å; A284-I288 WeakPolarHBondContact O-CD1 3.27Å; A284-I288 WeakPolarHBondContact O-CG1 3.48Å; A284-I288 PolarHBondContact O-N 3.23Å
285	R	83.6	Confident	80.2	Confident	119 Å²	119	63.4 Å²	63.4	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-55.1	-50.3	177.2	-174.2	-177.1	-61	102.4	2.7	111.4	E281 W287 I288 Q289	E281-R285 VanDerWaalsContact O-CB 3.26Å; E281-R285 WeakPolarHBondContact O-CB 3.45Å; E281-R285 PolarHBondContact O-N 3.11Å; R285-W287 PolarHBondContact O-N 2.96Å; R285-I288 PolarHBondContact O-N 3.06Å; R285-Q289 PolarHBondContact O-N 3.01Å
286	H	82.4	Confident	82.4	Confident	61 Å²	61	65.5 Å²	65.5	28%	0.282	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-42.6	178.5	-178.6	53.2	0	0	0	112.1	G259 A282 I283 A284 Q289 V290	G259-H286 PolarHBondContact O-CE1 3.04Å; A282-H286 WeakPolarHBondContact O-CB 3.25Å; A282-H286 PolarHBondContact O-N 3.45Å; I283-H286 PolarHBondContact O-N 2.98Å; A284-H286 PolarHBondContact O-N 3.37Å; H286-Q289 WeakPolarHBondContact O-CB 3.24Å; H286-Q289 PolarHBondContact O-N 3.49Å; H286-V290 WeakPolarHBondContact O-CG2 3.31Å; H286-V290 PolarHBondContact O-N 2.05Å
287	W	84.7	Confident	84.1	Confident	79 Å²	79	56.2 Å²	56.2	30%	0.299	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-37.4	179.7	-162.9	-119.2	0	0	0	112.6	L89 I283 A284 R285 Q289 V290 L291	L89-W287 HydrophobicContact CD1-CZ2 4.44Å; I283-W287 WeakPolarHBondContact O-CB 3.47Å; I283-W287 PolarHBondContact O-N 2.79Å; A284-W287 PolarHBondContact O-N 2.88Å; R285-W287 PolarHBondContact O-N 2.96Å; W287-Q289 VanDerWaalsContact C-N 3.35Å; W287-V290 HydrophobicContact CE3-CB 4.22Å; W287-V290 HydrophobicContact CE3-CG1 4.27Å; W287-V290 HydrophobicContact CE3-CG2 4.47Å; W287-V290 HydrophobicContact CZ3-CG1 4.09Å; W287-V290 PolarHBondContact O-N 3.23Å; W287-L291 WeakPolarHBondContact O-CB 3.48Å; W287-L291 VanDerWaalsContact O-CG 3.3Å; W287-L291 WeakPolarHBondContact O-CG 3.31Å; W287-L291 PolarHBondContact O-N 2.85Å
288	I	87.1	Confident	85.8	Confident	16 Å²	16	56.3 Å²	56.3	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-46.2	173.6	-67.4	156.6	0	0	0	110.1	A284 R285 V290 L291 Q292 L390 A393 L397 T399	A284-I288 WeakPolarHBondContact O-CB 3.43Å; A284-I288 VanDerWaalsContact O-CD1 3.3Å; A284-I288 WeakPolarHBondContact O-CD1 3.27Å; A284-I288 WeakPolarHBondContact O-CG1 3.48Å; A284-I288 PolarHBondContact O-N 3.23Å; R285-I288 PolarHBondContact O-N 3.06Å; I288-V290 VanDerWaalsContact C-N 3.34Å; I288-V290 PolarHBondContact O-N 3.06Å; I288-L291 PolarHBondContact O-N 3.47Å; I288-Q292 HydrophobicContact CG2-CG 4.25Å; I288-Q292 WeakPolarHBondContact O-CB 3.42Å; I288-Q292 VanDerWaalsContact O-CG 3.29Å; I288-Q292 WeakPolarHBondContact O-CG 3.49Å; I288-Q292 PolarHBondContact O-N 3.12Å; I288-L390 HydrophobicContact CG2-CD2 4.09Å; I288-A393 HydrophobicContact CD1-CB 3.63Å; I288-A393 HydrophobicContact CG1-CB 3.79Å; I288-L397 HydrophobicContact CD1-CD1 3.7Å; I288-T399 HydrophobicContact CD1-CG2 4.08Å; I288-T399 HydrophobicContact CG2-CG2 4.17Å
289	Q	86.4	Confident	86.2	Confident	61 Å²	61	54.8 Å²	54.8	29%	0.285	26%	0.263	S	S	.	.	H	α-helix	trans	-57.7	-45.4	175.4	-175.5	-172	38.8	0	0	112	R285 H286 W287 L291 Q292 C293	R285-Q289 PolarHBondContact O-N 3.01Å; H286-Q289 WeakPolarHBondContact O-CB 3.24Å; H286-Q289 PolarHBondContact O-N 3.49Å; W287-Q289 VanDerWaalsContact C-N 3.35Å; Q289-L291 PolarHBondContact O-N 2.89Å; Q289-Q292 PolarHBondContact O-N 3.03Å; Q289-C293 WeakPolarHBondContact O-CB 3.39Å; Q289-C293 PolarHBondContact O-N 3.14Å
290	V	86.4	Confident	86.7	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.024	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-45.1	176.9	172.4	0	0	0	0	111	H286 W287 I288 C293 R294	H286-V290 WeakPolarHBondContact O-CG2 3.31Å; H286-V290 PolarHBondContact O-N 2.05Å; W287-V290 HydrophobicContact CE3-CB 4.22Å; W287-V290 HydrophobicContact CE3-CG1 4.27Å; W287-V290 HydrophobicContact CE3-CG2 4.47Å; W287-V290 HydrophobicContact CZ3-CG1 4.09Å; W287-V290 PolarHBondContact O-N 3.23Å; I288-V290 VanDerWaalsContact C-N 3.34Å; I288-V290 PolarHBondContact O-N 3.06Å; V290-C293 PolarHBondContact O-N 3.1Å; V290-R294 HydrophobicContact CG1-CG 4.48Å; V290-R294 WeakPolarHBondContact O-CB 3.27Å; V290-R294 VanDerWaalsContact O-CG 3.26Å; V290-R294 WeakPolarHBondContact O-CG 3.45Å; V290-R294 PolarHBondContact O-N 3.39Å
291	L	89.9	Confident	87.3	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-43.2	179.4	-70.9	-179.1	0	0	0	112.1	W287 I288 Q289 C293 R294 Q295 E386 Q389 L390	W287-L291 WeakPolarHBondContact O-CB 3.48Å; W287-L291 VanDerWaalsContact O-CG 3.3Å; W287-L291 WeakPolarHBondContact O-CG 3.31Å; W287-L291 PolarHBondContact O-N 2.85Å; I288-L291 PolarHBondContact O-N 3.47Å; Q289-L291 PolarHBondContact O-N 2.89Å; L291-C293 PolarHBondContact O-N 3.24Å; L291-R294 WeakPolarHBondContact O-CB 3.16Å; L291-R294 PolarHBondContact O-N 3.43Å; L291-Q295 WeakPolarHBondContact O-CG 3.26Å; L291-Q295 PolarHBondContact O-N 3.26Å; L291-E386 HydrophobicContact CD2-CB 4.01Å; L291-E386 HydrophobicContact CD2-CG 3.64Å; L291-Q389 HydrophobicContact CD1-CB 3.81Å; L291-L390 HydrophobicContact CB-CD1 4.11Å; L291-L390 HydrophobicContact CB-CD2 3.68Å; L291-L390 HydrophobicContact CB-CG 3.96Å; L291-L390 HydrophobicContact CD1-CD2 4.47Å; L291-L390 HydrophobicContact CD1-CG 4.46Å
292	Q	90.4	Very high	87.6	Confident	47 Å²	47	40.8 Å²	40.8	22%	0.22	20%	0.2	C	C	.	.	H	α-helix	trans	-60.2	-44.9	175.2	-72.8	170.6	-14.6	0	0	111.6	I288 Q289 Q295 R296 L390 S400 F401	I288-Q292 HydrophobicContact CG2-CG 4.25Å; I288-Q292 WeakPolarHBondContact O-CB 3.42Å; I288-Q292 VanDerWaalsContact O-CG 3.29Å; I288-Q292 WeakPolarHBondContact O-CG 3.49Å; I288-Q292 PolarHBondContact O-N 3.12Å; Q289-Q292 PolarHBondContact O-N 3.03Å; Q292-Q295 PolarHBondContact O-N 3.28Å; Q292-R296 PolarHBondContact O-N 3.19Å; Q292-L390 HydrophobicContact CG-CD2 3.67Å; Q292-S400 PolarHBondContact NE2-O 3.46Å; Q292-F401 HydrophobicContact CG-CD2 4.4Å
293	C	89.8	Confident	87.7	Confident	47 Å²	47	40.3 Å²	40.3	32%	0.318	19%	0.193	S	C	.	.	H	α-helix	trans	-59.2	-47.2	174.6	175.7	0	0	0	0	111.2	C257 Q289 V290 L291 Q295 R296 C297	C257-C293 WeakPolarHBondContact CA-SG 3.22Å; C257-C293 HydrophobicContact CB-CB 3.67Å; C257-C293 WeakPolarHBondContact CB-SG 3.26Å; C257-C293 WeakPolarHBondContact SG-CB 3.35Å; C257-C293 CovalentContact SG-SG 2.04Å; C257-C293 PolarHBondContact SG-SG 2.97Å; Q289-C293 WeakPolarHBondContact O-CB 3.39Å; Q289-C293 PolarHBondContact O-N 3.14Å; V290-C293 PolarHBondContact O-N 3.1Å; L291-C293 PolarHBondContact O-N 3.24Å; C293-Q295 VanDerWaalsContact C-N 3.33Å; C293-Q295 PolarHBondContact O-N 3.4Å; C293-R296 WeakPolarHBondContact O-CB 3.49Å; C293-R296 PolarHBondContact O-N 2.93Å; C293-R296 VanDerWaalsContact O-N 3.16Å; C293-C297 PolarHBondContact O-N 3.21Å; C293-C297 PolarHBondContact O-SG 3.45Å
294	R	91.4	Very high	87.6	Confident	26 Å²	26	38.2 Å²	38.2	10%	0.098	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-36.1	-179.4	-82.4	-179.9	176.9	176.1	8.1	113.9	R254 C257 V290 L291 C297 E386	R254-R294 HydrophobicContact CB-CG 4.08Å; R254-R294 HydrophobicContact CG-CB 4.23Å; R254-R294 HydrophobicContact CG-CG 4.05Å; R254-R294 PolarHBondContact NH1-O 3.01Å; C257-R294 HydrophobicContact CB-CG 3.96Å; C257-R294 PolarHBondContact SG-N 2.84Å; C257-R294 VanDerWaalsContact SG-N 3.38Å; V290-R294 HydrophobicContact CG1-CG 4.48Å; V290-R294 WeakPolarHBondContact O-CB 3.27Å; V290-R294 VanDerWaalsContact O-CG 3.26Å; V290-R294 WeakPolarHBondContact O-CG 3.45Å; V290-R294 PolarHBondContact O-N 3.39Å; L291-R294 WeakPolarHBondContact O-CB 3.16Å; L291-R294 PolarHBondContact O-N 3.43Å; R294-C297 WeakPolarHBondContact O-CB 3.49Å; R294-E386 IonicContact NH1-OE1 3.5Å; R294-E386 PolarHBondContact NH1-OE1 3.11Å
295	Q	92.8	Very high	87	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-71.5	-37.9	175.5	-70.8	-64.3	-50.2	0	0	110.9	L291 Q292 C293 C297 V298 S383 E386 L390 F401 P404	L291-Q295 WeakPolarHBondContact O-CG 3.26Å; L291-Q295 PolarHBondContact O-N 3.26Å; Q292-Q295 PolarHBondContact O-N 3.28Å; C293-Q295 VanDerWaalsContact C-N 3.33Å; C293-Q295 PolarHBondContact O-N 3.4Å; Q295-C297 PolarHBondContact O-N 2.9Å; Q295-V298 PolarHBondContact O-N 2.96Å; Q295-S383 PolarHBondContact OE1-OG 3.34Å; Q295-E386 PolarHBondContact NE2-OE2 3.47Å; Q295-L390 HydrophobicContact CB-CD1 4.41Å; Q295-L390 HydrophobicContact CG-CD1 3.67Å; Q295-F401 HydrophobicContact CB-CE2 3.91Å; Q295-F401 HydrophobicContact CB-CZ 4.29Å; Q295-F401 HydrophobicContact CG-CE2 4.25Å; Q295-F401 HydrophobicContact CG-CZ 4.31Å; Q295-P404 WeakPolarHBondContact O-CG 3.29Å
296	R	91.7	Very high	85.8	Confident	146 Å²	146	34 Å²	34	55%	0.551	17%	0.171	S	C	*	.	H	α-helix	trans	-58.8	-29.5	174.7	-165.2	-178.5	-57.1	-156.8	0.6	113.4	Q292 C293 V298 G299 E300	Q292-R296 PolarHBondContact O-N 3.19Å; C293-R296 WeakPolarHBondContact O-CB 3.49Å; C293-R296 PolarHBondContact O-N 2.93Å; C293-R296 VanDerWaalsContact O-N 3.16Å; R296-V298 PolarHBondContact O-N 2.9Å; R296-V298 VanDerWaalsContact O-N 3.13Å; R296-G299 PolarHBondContact O-N 2.98Å; R296-E300 HydrophobicContact CG-CG 4.31Å; R296-E300 PolarHBondContact O-N 3.4Å
297	C	92.8	Very high	85	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.6	-26.8	177.6	-66.7	0	0	0	0	114.1	C253 R254 C293 R294 Q295 E300 T301	C253-C297 HydrophobicContact CB-CB 3.66Å; C253-C297 WeakPolarHBondContact CB-SG 3.14Å; C253-C297 WeakPolarHBondContact SG-CA 3.38Å; C253-C297 WeakPolarHBondContact SG-CB 3.5Å; C253-C297 CovalentContact SG-SG 2.04Å; C253-C297 PolarHBondContact SG-SG 3.36Å; R254-C297 HydrophobicContact CG-CB 3.98Å; R254-C297 PolarHBondContact N-SG 3.34Å; R254-C297 VanDerWaalsContact N-SG 3.44Å; C293-C297 PolarHBondContact O-N 3.21Å; C293-C297 PolarHBondContact O-SG 3.45Å; R294-C297 WeakPolarHBondContact O-CB 3.49Å; Q295-C297 PolarHBondContact O-N 2.9Å; C297-E300 PolarHBondContact O-N 3.38Å; C297-T301 WeakPolarHBondContact O-CB 3.29Å; C297-T301 PolarHBondContact O-N 2.87Å; C297-T301 PolarHBondContact O-OG1 3.07Å
298	V	93.1	Very high	83.9	Confident	16 Å²	16	33.2 Å²	33.2	10%	0.097	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-48.5	174.8	-177.6	0	0	0	0	110.1	M250 Q295 R296 A302 F379 D405	M250-V298 HydrophobicContact CE-CG1 4.18Å; M250-V298 HydrophobicContact SD-CG2 4.47Å; Q295-V298 PolarHBondContact O-N 2.96Å; R296-V298 PolarHBondContact O-N 2.9Å; R296-V298 VanDerWaalsContact O-N 3.13Å; V298-A302 VanDerWaalsContact O-CB 3.32Å; V298-A302 WeakPolarHBondContact O-CB 3.46Å; V298-A302 PolarHBondContact O-N 3.36Å; V298-A302 VanDerWaalsContact O-N 3.13Å; V298-F379 HydrophobicContact CG2-CE2 4.31Å; V298-F379 HydrophobicContact CG2-CZ 3.99Å; V298-D405 WeakPolarHBondContact CG1-OD1 3.33Å
299	G	87.9	Confident	82.7	Confident	13 Å²	13	37.7 Å²	37.7	13%	0.134	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-43.1	174.6	0	0	0	0	0	112.6	R296 T301 A302 T303	R296-G299 PolarHBondContact O-N 2.98Å; G299-T301 PolarHBondContact O-N 2.96Å; G299-A302 CarbonylContact O-C 3.07Å; G299-A302 PolarHBondContact O-N 3.44Å; G299-T303 WeakPolarHBondContact O-CB 3.31Å; G299-T303 PolarHBondContact O-N 3.29Å; G299-T303 PolarHBondContact O-OG1 3.29Å
300	E	88.5	Confident	82.1	Confident	64 Å²	64	37.5 Å²	37.5	30%	0.299	20%	0.202	S	C	.	.	H	α-helix	trans	-62.3	-41.6	179.5	-65.7	-168.4	168.2	0	0	112.3	R152 C253 R296 C297 A302 T303	R152-E300 IonicContact CZ-OE1 3.73Å; R152-E300 VanDerWaalsContact CZ-OE1 3.31Å; R152-E300 IonicContact CZ-OE2 2.69Å; R152-E300 IonicContact NH1-OE1 3.82Å; R152-E300 PolarHBondContact NH1-OE1 2.89Å; R152-E300 IonicContact NH1-OE2 3.53Å; R152-E300 VanDerWaalsContact NH2-CD 3.31Å; R152-E300 IonicContact NH2-OE1 2.92Å; R152-E300 PolarHBondContact NH2-OE1 3.03Å; R152-E300 IonicContact NH2-OE2 3Å; R152-E300 PolarHBondContact NH2-OE2 3.33Å; C253-E300 PolarHBondContact SG-OE2 3.47Å; C253-E300 VanDerWaalsContact SG-OE2 3.39Å; R296-E300 HydrophobicContact CG-CG 4.31Å; R296-E300 PolarHBondContact O-N 3.4Å; C297-E300 PolarHBondContact O-N 3.38Å; E300-A302 VanDerWaalsContact C-N 3.33Å; E300-T303 PolarHBondContact O-N 2.85Å
301	T	92.6	Very high	81.5	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-35.7	175.2	-66.5	0	0	0	0	112.4	H216 W217 S246 Q249 M250 C297 G299 T303 F314	H216-T301 PolarHBondContact NE2-O 3.5Å; W217-T301 PolarHBondContact NE1-O 3.32Å; S246-T301 WeakPolarHBondContact O-CG2 3.32Å; Q249-T301 HydrophobicContact CB-CG2 4.13Å; Q249-T301 HydrophobicContact CG-CG2 4.16Å; M250-T301 HydrophobicContact CE-CG2 3.84Å; M250-T301 HydrophobicContact CG-CG2 3.93Å; M250-T301 VanDerWaalsContact CG-OG1 3.23Å; M250-T301 WeakPolarHBondContact CG-OG1 3.35Å; M250-T301 PolarHBondContact N-OG1 3.4Å; C297-T301 WeakPolarHBondContact O-CB 3.29Å; C297-T301 PolarHBondContact O-N 2.87Å; C297-T301 PolarHBondContact O-OG1 3.07Å; G299-T301 PolarHBondContact O-N 2.96Å; T301-T303 VanDerWaalsContact C-N 3.32Å; T301-F314 HydrophobicContact CG2-CE1 4.48Å
302	A	87.4	Confident	80.8	Confident	5 Å²	5	43 Å²	43	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-81.5	-6.1	179.2	0	0	0	0	0	113.9	W217 V298 G299 E300 P310 V311 F314	W217-A302 WeakPolarHBondContact CZ2-O 3.37Å; V298-A302 VanDerWaalsContact O-CB 3.32Å; V298-A302 WeakPolarHBondContact O-CB 3.46Å; V298-A302 PolarHBondContact O-N 3.36Å; V298-A302 VanDerWaalsContact O-N 3.13Å; G299-A302 CarbonylContact O-C 3.07Å; G299-A302 PolarHBondContact O-N 3.44Å; E300-A302 VanDerWaalsContact C-N 3.33Å; A302-P310 HydrophobicContact CB-CB 3.87Å; A302-V311 PolarHBondContact O-N 2.94Å; A302-F314 HydrophobicContact CB-CB 3.58Å; A302-F314 HydrophobicContact CB-CD1 3.92Å; A302-F314 HydrophobicContact CB-CG 3.95Å
303	T	81.2	Confident	80.5	Confident	34 Å²	34	43 Å²	43	21%	0.209	24%	0.239	C	C	.	.	S	Bend	trans	-90.9	122.7	177.1	-55.2	0	0	0	0	109.3	G299 E300 T301 R307 P310	G299-T303 WeakPolarHBondContact O-CB 3.31Å; G299-T303 PolarHBondContact O-N 3.29Å; G299-T303 PolarHBondContact O-OG1 3.29Å; E300-T303 PolarHBondContact O-N 2.85Å; T301-T303 VanDerWaalsContact C-N 3.32Å; T303-R307 HydrophobicContact CG2-CB 4.22Å; T303-R307 WeakPolarHBondContact CG2-O 3.41Å; T303-P310 WeakPolarHBondContact OG1-CA 3.46Å
304	R	77.7	Confident	80.5	Confident	24 Å²	24	41.2 Å²	41.2	9%	0.091	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-68.3	146.2	172.2	-73.9	-174.7	-178.3	-89.3	4.7	109.9	W217 D221 G306 R307 E596	W217-R304 HydrophobicContact CD2-CG 3.98Å; W217-R304 HydrophobicContact CE3-CG 4.01Å; W217-R304 VanDerWaalsContact CE3-CZ 3.46Å; W217-R304 HydrophobicContact CH2-CG 3.7Å; W217-R304 HydrophobicContact CZ2-CG 3.63Å; W217-R304 HydrophobicContact CZ3-CG 3.87Å; W217-R304 VanDerWaalsContact CZ3-CZ 3.45Å; D221-R304 VanDerWaalsContact CG-NH1 3.31Å; D221-R304 IonicContact OD1-CZ 2.83Å; D221-R304 VanDerWaalsContact OD1-CZ 3.22Å; D221-R304 IonicContact OD1-NH1 3.6Å; D221-R304 PolarHBondContact OD1-NH1 2.98Å; D221-R304 IonicContact OD1-NH2 3.44Å; D221-R304 PolarHBondContact OD1-NH2 3.32Å; D221-R304 IonicContact OD2-CZ 3.23Å; D221-R304 IonicContact OD2-NH1 3.6Å; D221-R304 PolarHBondContact OD2-NH1 2.97Å; R304-G306 PolarHBondContact O-N 3.33Å; R304-R307 HydrophobicContact CB-CB 4.4Å; R304-R307 HydrophobicContact CB-CG 3.74Å; R304-R307 WeakPolarHBondContact O-CB 3.23Å; R304-R307 PolarHBondContact O-N 3.49Å; R304-E596 IonicContact NE-OE2 2.99Å; R304-E596 IonicContact NH2-OE2 3.88Å
305	P	68.7	Low	80.6	Confident	38 Å²	38	40.3 Å²	40.3	25%	0.247	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	131.2	170.7	-28.8	37.1	0	0	0	111.8	V182 P214 R307	V182-P305 HydrophobicContact CG1-CB 3.79Å; V182-P305 CarbonylContact O-C 3.56Å; P214-P305 HydrophobicContact CG-CG 4.23Å; P305-R307 VanDerWaalsContact C-N 3.26Å; P305-R307 PolarHBondContact O-N 3.3Å
306	G	59.1	Low	80.7	Confident	26 Å²	26	40.4 Å²	40.4	27%	0.268	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	-3.5	179.4	0	0	0	0	0	116.1	V182 A183 R304	V182-G306 VanDerWaalsContact O-CA 3.29Å; V182-G306 WeakPolarHBondContact O-CA 3.31Å; A183-G306 VanDerWaalsContact O-CA 3.3Å; A183-G306 WeakPolarHBondContact O-CA 3.09Å; R304-G306 PolarHBondContact O-N 3.33Å
307	R	66.1	Low	80.6	Confident	34 Å²	34	34.7 Å²	34.7	13%	0.128	21%	0.206	C	C	.	.			trans	-92.7	152.4	170.6	-55.9	-62.5	173.8	170.4	-0.6	110.5	T303 R304 P305 V589 D591 W598 E600	T303-R307 HydrophobicContact CG2-CB 4.22Å; T303-R307 WeakPolarHBondContact CG2-O 3.41Å; R304-R307 HydrophobicContact CB-CB 4.4Å; R304-R307 HydrophobicContact CB-CG 3.74Å; R304-R307 WeakPolarHBondContact O-CB 3.23Å; R304-R307 PolarHBondContact O-N 3.49Å; P305-R307 VanDerWaalsContact C-N 3.26Å; P305-R307 PolarHBondContact O-N 3.3Å; R307-V589 PolarHBondContact NH1-O 3.35Å; R307-D591 IonicContact NH2-OD2 3.98Å; R307-D591 PolarHBondContact NH2-OD2 3.42Å; R307-W598 VanDerWaalsContact NH1-CD1 3.26Å; R307-E600 WeakPolarHBondContact CD-OE1 3.39Å; R307-E600 IonicContact NH1-OE1 3.85Å
308	S	60	Low	80.8	Confident	89 Å²	89	34.7 Å²	34.7	62%	0.622	21%	0.206	S	C	*	.	S	Bend	trans	-96.3	-24.2	178.9	-60.5	0	0	0	0	112.1
309	F	62.8	Low	81	Confident	110 Å²	110	34 Å²	34	48%	0.482	20%	0.202	S	C	.	.	S	Bend	trans	-116.7	144.6	-176.9	-62.2	-88.7	0	0	0	111.8	E600 P601	F309-E600 HydrophobicContact CD2-CB 3.63Å; F309-E600 HydrophobicContact CD2-CG 4.49Å; F309-E600 VanDerWaalsContact CD2-OE2 3.32Å; F309-E600 WeakPolarHBondContact CD2-OE2 3.34Å; F309-E600 HydrophobicContact CE2-CB 4.07Å; F309-E600 PolarHBondContact N-OE2 2.81Å; F309-P601 HydrophobicContact CE2-CG 4.22Å
310	P	73.6	Confident	81.3	Confident	58 Å²	58	36.3 Å²	36.3	38%	0.377	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-70.4	149.8	175.6	29.3	-34.2	0	0	0	111.3	A302 T303 P312	A302-P310 HydrophobicContact CB-CB 3.87Å; T303-P310 WeakPolarHBondContact OG1-CA 3.46Å; P310-P312 WeakPolarHBondContact O-CD 3.17Å
311	V	75.1	Confident	81.5	Confident	24 Å²	24	38.2 Å²	38.2	15%	0.145	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-63.4	121	166.2	179.3	0	0	0	0	108.3	W217 A302 F314 W598	W217-V311 HydrophobicContact CH2-CB 4.34Å; W217-V311 HydrophobicContact CH2-CG2 3.7Å; W217-V311 HydrophobicContact CZ2-CG2 4.45Å; A302-V311 PolarHBondContact O-N 2.94Å; V311-F314 HydrophobicContact CB-CB 4.44Å; V311-F314 HydrophobicContact CB-CD2 4.26Å; V311-F314 HydrophobicContact CG1-CD2 4.23Å; V311-W598 HydrophobicContact CG2-CH2 3.69Å; V311-W598 HydrophobicContact CG2-CZ3 3.93Å
312	P	74.4	Confident	81.7	Confident	99 Å²	99	38 Å²	38	64%	0.643	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	144.8	-179.3	27.3	-34.1	0	0	0	110.1	P310 F314	P310-P312 WeakPolarHBondContact O-CD 3.17Å; P312-F314 PolarHBondContact O-N 3.23Å; P312-F314 VanDerWaalsContact O-N 3.1Å
313	D	83.6	Confident	82.1	Confident	47 Å²	47	38.3 Å²	38.3	25%	0.251	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	36.7	178.3	-73.6	-22.9	0	0	0	114.3	L315 P316 S317 Y346	D313-L315 PolarHBondContact O-N 2.85Å; D313-P316 HydrophobicContact CB-CB 4.15Å; D313-P316 HydrophobicContact CB-CG 4.1Å; D313-P316 VanDerWaalsContact O-CD 3.27Å; D313-P316 WeakPolarHBondContact O-CD 3.44Å; D313-S317 VanDerWaalsContact O-CB 3.25Å; D313-S317 WeakPolarHBondContact O-CB 3.49Å; D313-S317 PolarHBondContact O-N 2.97Å; D313-S317 PolarHBondContact O-OG 2.99Å; D313-Y346 PolarHBondContact OD1-OH 2.58Å; D313-Y346 WeakPolarHBondContact OD2-CE2 3.35Å; D313-Y346 PolarHBondContact OD2-OH 3.29Å
314	F	89.4	Confident	82.7	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-55.6	-45.9	-173.9	-175	-125.5	0	0	0	113.7	H216 W217 Y220 S246 T301 A302 V311 P312 S317 Q318	H216-F314 AromaticContact CD2-CE1 3.97Å; W217-F314 HydrophobicContact CD2-CZ 4.33Å; W217-F314 HydrophobicContact CE3-CE2 4.19Å; W217-F314 HydrophobicContact CE3-CZ 4.08Å; W217-F314 AromaticContact CH2-CD2 3.77Å; W217-F314 HydrophobicContact CH2-CD2 3.77Å; W217-F314 HydrophobicContact CH2-CE1 4.28Å; W217-F314 AromaticContact CH2-CE2 3.22Å; W217-F314 HydrophobicContact CH2-CE2 3.22Å; W217-F314 AromaticContact CH2-CZ 3.51Å; W217-F314 HydrophobicContact CH2-CZ 3.51Å; W217-F314 HydrophobicContact CZ2-CD2 4.49Å; W217-F314 HydrophobicContact CZ2-CE1 4.21Å; W217-F314 AromaticContact CZ2-CE2 3.97Å; W217-F314 HydrophobicContact CZ2-CE2 3.97Å; W217-F314 AromaticContact CZ2-CZ 3.8Å; W217-F314 HydrophobicContact CZ2-CZ 3.8Å; W217-F314 HydrophobicContact CZ3-CD2 4.27Å; W217-F314 AromaticContact CZ3-CE2 3.37Å; W217-F314 HydrophobicContact CZ3-CE2 3.37Å; W217-F314 AromaticContact CZ3-CZ 3.68Å; W217-F314 HydrophobicContact CZ3-CZ 3.68Å; Y220-F314 HydrophobicContact CD1-CE2 4.1Å; Y220-F314 HydrophobicContact CE1-CE2 4.02Å; Y220-F314 HydrophobicContact CG-CE2 4.36Å; S246-F314 WeakPolarHBondContact OG-CE1 3.22Å; T301-F314 HydrophobicContact CG2-CE1 4.48Å; A302-F314 HydrophobicContact CB-CB 3.58Å; A302-F314 HydrophobicContact CB-CD1 3.92Å; A302-F314 HydrophobicContact CB-CG 3.95Å; V311-F314 HydrophobicContact CB-CB 4.44Å; V311-F314 HydrophobicContact CB-CD2 4.26Å; V311-F314 HydrophobicContact CG1-CD2 4.23Å; P312-F314 PolarHBondContact O-N 3.23Å; P312-F314 VanDerWaalsContact O-N 3.1Å; F314-S317 PolarHBondContact O-OG 3.38Å; F314-Q318 HydrophobicContact CE2-CG 4.5Å; F314-Q318 WeakPolarHBondContact O-CG 3.4Å; F314-Q318 PolarHBondContact O-N 2.81Å; F314-Q318 PolarHBondContact O-NE2 2.7Å
315	L	94.2	Very high	83.6	Confident	7 Å²	7	39 Å²	39	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-51.6	174.8	-74	178.9	0	0	0	112.8	L243 L247 M250 D313 S317 Q318 L319 F345 F379	L243-L315 HydrophobicContact CD1-CD2 3.72Å; L247-L315 HydrophobicContact CD2-CD1 4.13Å; L247-L315 HydrophobicContact CD2-CD2 4.21Å; L247-L315 HydrophobicContact CG-CD2 4.5Å; M250-L315 HydrophobicContact CE-CD1 3.67Å; M250-L315 HydrophobicContact CE-CD2 4.16Å; M250-L315 HydrophobicContact CE-CG 3.79Å; M250-L315 HydrophobicContact SD-CD1 3.94Å; D313-L315 PolarHBondContact O-N 2.85Å; L315-S317 VanDerWaalsContact C-N 3.27Å; L315-S317 PolarHBondContact O-N 3.08Å; L315-Q318 PolarHBondContact O-N 3.4Å; L315-L319 PolarHBondContact O-N 3.34Å; L315-L319 VanDerWaalsContact O-N 3.14Å; L315-F345 HydrophobicContact CB-CZ 4.46Å; L315-F379 HydrophobicContact CD1-CD1 4.21Å; L315-F379 HydrophobicContact CD1-CD2 4.48Å; L315-F379 HydrophobicContact CD1-CE1 3.78Å; L315-F379 HydrophobicContact CD1-CE2 4.07Å; L315-F379 HydrophobicContact CD1-CZ 3.71Å
316	P	93.9	Very high	84.9	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.019	20%	0.203	C	C	.	.	H	α-helix	trans	-54.2	-40.2	174.3	-25.9	29.6	0	0	0	113.7	D313 L319 R320 F345 Y346	D313-P316 HydrophobicContact CB-CB 4.15Å; D313-P316 HydrophobicContact CB-CG 4.1Å; D313-P316 VanDerWaalsContact O-CD 3.27Å; D313-P316 WeakPolarHBondContact O-CD 3.44Å; P316-L319 WeakPolarHBondContact O-CB 3.46Å; P316-L319 PolarHBondContact O-N 3.35Å; P316-R320 WeakPolarHBondContact O-CG 3.49Å; P316-R320 PolarHBondContact O-N 3.28Å; P316-F345 HydrophobicContact CG-CB 4.18Å; P316-F345 HydrophobicContact CG-CD1 4.06Å; P316-F345 HydrophobicContact CG-CD2 4.02Å; P316-F345 HydrophobicContact CG-CE1 4.45Å; P316-F345 HydrophobicContact CG-CE2 4.41Å; P316-F345 HydrophobicContact CG-CG 3.83Å; P316-Y346 HydrophobicContact CB-CE2 4.36Å; P316-Y346 HydrophobicContact CG-CE2 4.23Å
317	S	90.6	Very high	86.6	Confident	26 Å²	26	37.7 Å²	37.7	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-40.1	-179.9	74.6	0	0	0	0	112.1	D313 F314 L315 L319 R320 R321	D313-S317 VanDerWaalsContact O-CB 3.25Å; D313-S317 WeakPolarHBondContact O-CB 3.49Å; D313-S317 PolarHBondContact O-N 2.97Å; D313-S317 PolarHBondContact O-OG 2.99Å; F314-S317 PolarHBondContact O-OG 3.38Å; L315-S317 VanDerWaalsContact C-N 3.27Å; L315-S317 PolarHBondContact O-N 3.08Å; S317-L319 VanDerWaalsContact C-N 3.34Å; S317-L319 PolarHBondContact O-N 3.5Å; S317-R320 WeakPolarHBondContact O-CB 3.28Å; S317-R320 PolarHBondContact O-N 3.4Å; S317-R321 WeakPolarHBondContact O-CG 3.1Å; S317-R321 PolarHBondContact O-N 2.95Å
318	Q	96.1	Very high	87.9	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-42.7	173.3	-75.1	-178	73	0	0	111.5	Y220 A242 L243 S246 F314 L315 R320 R321 L322	Y220-Q318 HydrophobicContact CD2-CG 3.74Å; Y220-Q318 HydrophobicContact CE2-CG 3.46Å; Y220-Q318 VanDerWaalsContact CE2-CG 3.46Å; A242-Q318 PolarHBondContact O-OE1 2.89Å; L243-Q318 HydrophobicContact CD1-CB 4.28Å; S246-Q318 PolarHBondContact OG-NE2 3.13Å; S246-Q318 VanDerWaalsContact OG-NE2 3.08Å; F314-Q318 HydrophobicContact CE2-CG 4.5Å; F314-Q318 WeakPolarHBondContact O-CG 3.4Å; F314-Q318 PolarHBondContact O-N 2.81Å; F314-Q318 PolarHBondContact O-NE2 2.7Å; L315-Q318 PolarHBondContact O-N 3.4Å; Q318-R320 PolarHBondContact O-N 3.05Å; Q318-R321 PolarHBondContact O-N 3.19Å; Q318-L322 WeakPolarHBondContact O-CB 3.09Å; Q318-L322 WeakPolarHBondContact O-CG 3.3Å; Q318-L322 PolarHBondContact O-N 2.9Å
319	L	97.2	Very high	89.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-38	175.6	-67.1	166	0	0	0	112.4	L243 L315 P316 S317 L322 H323 N338 V342 F345 I376	L243-L319 HydrophobicContact CD2-CD2 3.72Å; L315-L319 PolarHBondContact O-N 3.34Å; L315-L319 VanDerWaalsContact O-N 3.14Å; P316-L319 WeakPolarHBondContact O-CB 3.46Å; P316-L319 PolarHBondContact O-N 3.35Å; S317-L319 VanDerWaalsContact C-N 3.34Å; S317-L319 PolarHBondContact O-N 3.5Å; L319-L322 PolarHBondContact O-N 3.41Å; L319-H323 PolarHBondContact O-CD2 3.22Å; L319-H323 PolarHBondContact O-N 2.94Å; L319-N338 WeakPolarHBondContact CD2-OD1 3.35Å; L319-V342 HydrophobicContact CB-CG2 3.63Å; L319-F345 HydrophobicContact CD1-CD2 4.31Å; L319-F345 HydrophobicContact CD1-CE2 3.66Å; L319-I376 HydrophobicContact CD1-CD1 4.15Å; L319-I376 HydrophobicContact CD1-CG1 4.09Å; L319-I376 HydrophobicContact CD1-CG2 4.2Å; L319-I376 HydrophobicContact CD2-CD1 4.32Å; L319-I376 HydrophobicContact CD2-CG1 4.04Å
320	R	94.5	Very high	90.9	Very high	62 Å²	62	38.2 Å²	38.2	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-58.8	-51.4	172.8	-71	176.5	-160.6	-96.7	4.2	111.2	P316 S317 Q318 L322 H323 E324 V342 D349	P316-R320 WeakPolarHBondContact O-CG 3.49Å; P316-R320 PolarHBondContact O-N 3.28Å; S317-R320 WeakPolarHBondContact O-CB 3.28Å; S317-R320 PolarHBondContact O-N 3.4Å; Q318-R320 PolarHBondContact O-N 3.05Å; R320-L322 VanDerWaalsContact C-N 3.33Å; R320-L322 PolarHBondContact O-N 3.32Å; R320-H323 VanDerWaalsContact CA-CD2 3.42Å; R320-H323 WeakPolarHBondContact CA-CD2 3.36Å; R320-H323 PolarHBondContact O-CD2 2.92Å; R320-H323 PolarHBondContact O-N 3.32Å; R320-E324 VanDerWaalsContact O-CG 3.3Å; R320-E324 WeakPolarHBondContact O-CG 3.38Å; R320-E324 PolarHBondContact O-N 2.84Å; R320-V342 HydrophobicContact CG-CG1 4.36Å; R320-V342 HydrophobicContact CG-CG2 3.96Å; R320-D349 IonicContact CZ-OD2 2.69Å; R320-D349 IonicContact NH1-OD1 3.39Å; R320-D349 IonicContact NH1-OD2 3.07Å; R320-D349 PolarHBondContact NH1-OD2 2.96Å; R320-D349 IonicContact NH2-OD2 3.31Å; R320-D349 PolarHBondContact NH2-OD2 2.84Å
321	R	93.7	Very high	91.9	Very high	104 Å²	104	38.9 Å²	38.9	39%	0.392	21%	0.214	S	C	.	.	H	α-helix	trans	-58.8	-43.1	176.6	-65.3	-62.2	-176	-145.8	3.3	112.2	L224 L227 L239 S317 Q318 E324 A325	L224-R321 HydrophobicContact CD2-CG 4.18Å; L227-R321 HydrophobicContact CD1-CB 4.27Å; L239-R321 HydrophobicContact CD1-CB 4.29Å; L239-R321 HydrophobicContact CD2-CB 4.36Å; S317-R321 WeakPolarHBondContact O-CG 3.1Å; S317-R321 PolarHBondContact O-N 2.95Å; Q318-R321 PolarHBondContact O-N 3.19Å; R321-E324 IonicContact NH1-OE2 3.44Å; R321-E324 PolarHBondContact NH1-OE2 2.96Å; R321-E324 PolarHBondContact O-N 2.99Å; R321-A325 VanDerWaalsContact O-CB 3.28Å; R321-A325 WeakPolarHBondContact O-CB 3.3Å; R321-A325 PolarHBondContact O-N 3.49Å
322	L	97.4	Very high	92.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-47.7	178.2	-81.4	166.2	0	0	0	112.1	L236 L239 L243 Q318 L319 R320 E324 A325 H326 N338	L236-L322 HydrophobicContact CD2-CD2 4.32Å; L239-L322 HydrophobicContact CB-CD2 3.52Å; L239-L322 HydrophobicContact CB-CG 3.97Å; L243-L322 HydrophobicContact CB-CD1 4.18Å; L243-L322 HydrophobicContact CD2-CD1 3.61Å; Q318-L322 WeakPolarHBondContact O-CB 3.09Å; Q318-L322 WeakPolarHBondContact O-CG 3.3Å; Q318-L322 PolarHBondContact O-N 2.9Å; L319-L322 PolarHBondContact O-N 3.41Å; R320-L322 VanDerWaalsContact C-N 3.33Å; R320-L322 PolarHBondContact O-N 3.32Å; L322-E324 VanDerWaalsContact C-N 3.35Å; L322-E324 PolarHBondContact O-N 2.82Å; L322-A325 PolarHBondContact O-N 2.9Å; L322-H326 WeakPolarHBondContact O-CB 3.46Å; L322-H326 PolarHBondContact O-CD2 3.05Å; L322-H326 PolarHBondContact O-N 3.37Å; L322-N338 HydrophobicContact CB-CB 4.46Å
323	H	95.6	Very high	93.6	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.046	19%	0.194	C	C	.	.	H	α-helix	trans	-68.3	-36.1	-179.1	78.4	65.3	0	0	0	112.7	L319 R320 A327 A335 N338 V339	L319-H323 PolarHBondContact O-CD2 3.22Å; L319-H323 PolarHBondContact O-N 2.94Å; R320-H323 VanDerWaalsContact CA-CD2 3.42Å; R320-H323 WeakPolarHBondContact CA-CD2 3.36Å; R320-H323 PolarHBondContact O-CD2 2.92Å; R320-H323 PolarHBondContact O-N 3.32Å; H323-A327 WeakPolarHBondContact O-CB 3.42Å; H323-A327 PolarHBondContact O-N 3.45Å; H323-A335 WeakPolarHBondContact CB-O 3.27Å; H323-N338 HydrophobicContact CB-CB 3.67Å; H323-V339 HydrophobicContact CB-CG2 3.64Å; H323-V339 VanDerWaalsContact CD2-CG2 3.48Å; H323-V339 WeakPolarHBondContact CD2-CG2 3.3Å
324	E	93.2	Very high	94.1	Very high	72 Å²	72	37.9 Å²	37.9	34%	0.336	20%	0.202	S	C	.	.	H	α-helix	trans	-61.3	-48.7	174.3	-72.9	169	-178.8	0	0	110.4	R320 R321 L322 A327 Q328	R320-E324 VanDerWaalsContact O-CG 3.3Å; R320-E324 WeakPolarHBondContact O-CG 3.38Å; R320-E324 PolarHBondContact O-N 2.84Å; R321-E324 IonicContact NH1-OE2 3.44Å; R321-E324 PolarHBondContact NH1-OE2 2.96Å; R321-E324 PolarHBondContact O-N 2.99Å; L322-E324 VanDerWaalsContact C-N 3.35Å; L322-E324 PolarHBondContact O-N 2.82Å; E324-A327 PolarHBondContact O-N 3.18Å; E324-Q328 WeakPolarHBondContact O-CG 3.46Å; E324-Q328 PolarHBondContact O-N 2.96Å
325	A	95.4	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-42.2	178.9	0	0	0	0	0	112.4	L227 A232 L236 L239 R321 L322 A327 Q328 V329	L227-A325 HydrophobicContact CD2-CB 3.96Å; A232-A325 HydrophobicContact CB-CB 4.46Å; L236-A325 HydrophobicContact CD2-CB 3.56Å; L236-A325 HydrophobicContact CG-CB 4.06Å; L239-A325 HydrophobicContact CD1-CB 4.22Å; R321-A325 VanDerWaalsContact O-CB 3.28Å; R321-A325 WeakPolarHBondContact O-CB 3.3Å; R321-A325 PolarHBondContact O-N 3.49Å; L322-A325 PolarHBondContact O-N 2.9Å; A325-A327 VanDerWaalsContact C-N 3.33Å; A325-A327 PolarHBondContact O-N 2.68Å; A325-Q328 PolarHBondContact O-N 2.91Å; A325-V329 WeakPolarHBondContact O-CG2 3.24Å; A325-V329 PolarHBondContact O-N 3.25Å
326	H	96.8	Very high	94.4	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.056	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-40.5	175.7	-80.8	-58.6	0	0	0	112.1	L236 L322 V329 G330 N331 Q334 A335	L236-H326 VanDerWaalsContact CD2-CE1 3.45Å; L236-H326 WeakPolarHBondContact CD2-CE1 3.47Å; L322-H326 WeakPolarHBondContact O-CB 3.46Å; L322-H326 PolarHBondContact O-CD2 3.05Å; L322-H326 PolarHBondContact O-N 3.37Å; H326-V329 PolarHBondContact O-N 3.43Å; H326-G330 PolarHBondContact O-N 3.27Å; H326-G330 VanDerWaalsContact O-N 3.15Å; H326-N331 HydrophobicContact CB-CB 4.3Å; H326-N331 PolarHBondContact O-N 2.87Å; H326-Q334 HydrophobicContact CB-CB 4.36Å; H326-Q334 PolarHBondContact CE1-OE1 3.15Å; H326-Q334 PolarHBondContact ND1-OE1 3.37Å; H326-Q334 VanDerWaalsContact ND1-OE1 3.15Å; H326-A335 HydrophobicContact CB-CB 3.88Å
327	A	94.3	Very high	94.5	Very high	26 Å²	26	40.5 Å²	40.5	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-41.6	176.8	0	0	0	0	0	111.9	H323 E324 A325 V329 G330 A335 Y359	H323-A327 WeakPolarHBondContact O-CB 3.42Å; H323-A327 PolarHBondContact O-N 3.45Å; E324-A327 PolarHBondContact O-N 3.18Å; A325-A327 VanDerWaalsContact C-N 3.33Å; A325-A327 PolarHBondContact O-N 2.68Å; A327-V329 VanDerWaalsContact C-N 3.27Å; A327-V329 PolarHBondContact O-N 2.9Å; A327-G330 PolarHBondContact O-N 3.03Å; A327-G330 VanDerWaalsContact O-N 3.09Å; A327-A335 HydrophobicContact CB-CB 4.23Å; A327-Y359 HydrophobicContact CB-CD1 4.37Å; A327-Y359 HydrophobicContact CB-CE1 3.52Å; A327-Y359 HydrophobicContact CB-CE2 4.38Å; A327-Y359 WeakPolarHBondContact CB-OH 3.48Å
328	Q	93.8	Very high	94.8	Very high	128 Å²	128	39.4 Å²	39.4	60%	0.598	21%	0.206	S	C	*	.	H	α-helix	trans	-60.4	-35.3	176.7	-71.3	174.3	24.9	0	0	112.9	A232 E324 A325 G330	A232-Q328 HydrophobicContact CB-CB 4.08Å; E324-Q328 WeakPolarHBondContact O-CG 3.46Å; E324-Q328 PolarHBondContact O-N 2.96Å; A325-Q328 PolarHBondContact O-N 2.91Å; Q328-G330 VanDerWaalsContact C-N 3.34Å
329	V	94.6	Very high	94.8	Very high	66 Å²	66	39.4 Å²	39.4	40%	0.4	21%	0.206	S	C	.	.	H	α-helix	trans	-85.5	-7.2	179.1	-178	0	0	0	0	112.3	A232 L236 A325 H326 A327	A232-V329 HydrophobicContact CB-CG2 3.87Å; L236-V329 HydrophobicContact CD1-CB 4.33Å; L236-V329 HydrophobicContact CD1-CG2 4Å; A325-V329 WeakPolarHBondContact O-CG2 3.24Å; A325-V329 PolarHBondContact O-N 3.25Å; H326-V329 PolarHBondContact O-N 3.43Å; A327-V329 VanDerWaalsContact C-N 3.27Å; A327-V329 PolarHBondContact O-N 2.9Å
330	G	92.4	Very high	94.8	Very high	50 Å²	50	41.1 Å²	41.1	52%	0.515	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	9	-179.2	0	0	0	0	0	114.5	H326 A327 Q328 L332	H326-G330 PolarHBondContact O-N 3.27Å; H326-G330 VanDerWaalsContact O-N 3.15Å; A327-G330 PolarHBondContact O-N 3.03Å; A327-G330 VanDerWaalsContact O-N 3.09Å; Q328-G330 VanDerWaalsContact C-N 3.34Å; G330-L332 PolarHBondContact O-N 2.95Å
331	N	93.6	Very high	95	Very high	71 Å²	71	38.2 Å²	38.2	38%	0.38	20%	0.204	S	C	.	.			trans	-83.4	63.3	178.6	-73.1	-8.4	0	0	0	111.2	H326 S333 Q334 A335	H326-N331 HydrophobicContact CB-CB 4.3Å; H326-N331 PolarHBondContact O-N 2.87Å; N331-S333 VanDerWaalsContact C-N 3.3Å; N331-S333 PolarHBondContact O-N 3.3Å; N331-Q334 PolarHBondContact O-N 2.84Å; N331-Q334 VanDerWaalsContact O-N 3.16Å; N331-A335 PolarHBondContact O-N 3.31Å
332	L	92.7	Very high	95.1	Very high	26 Å²	26	33.2 Å²	33.2	14%	0.136	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-34	-171.7	-65.1	-179.2	0	0	0	114.3	G330 Q334 A335 I336 Y359 Q362 L363	G330-L332 PolarHBondContact O-N 2.95Å; L332-Q334 PolarHBondContact O-N 3.05Å; L332-A335 PolarHBondContact O-N 3.44Å; L332-I336 VanDerWaalsContact O-CG1 3.3Å; L332-I336 WeakPolarHBondContact O-CG1 3.44Å; L332-I336 PolarHBondContact O-N 3.08Å; L332-Y359 HydrophobicContact CD2-CD1 4.06Å; L332-Y359 HydrophobicContact CD2-CG 4.4Å; L332-Q362 HydrophobicContact CD1-CB 3.59Å; L332-L363 HydrophobicContact CB-CD1 3.76Å; L332-L363 HydrophobicContact CD1-CD1 4.33Å
333	S	92.4	Very high	95.1	Very high	33 Å²	33	34.6 Å²	34.6	23%	0.231	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-46.2	177	-56.4	0	0	0	0	112.1	N331 I336 E337	N331-S333 VanDerWaalsContact C-N 3.3Å; N331-S333 PolarHBondContact O-N 3.3Å; S333-I336 PolarHBondContact O-N 2.86Å; S333-E337 PolarHBondContact O-N 3.31Å; S333-E337 VanDerWaalsContact O-N 3.09Å
334	Q	94.1	Very high	95.1	Very high	90 Å²	90	36.8 Å²	36.8	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-73.3	-32.3	177.8	-71.2	-175.4	-39.8	0	0	111.5	H326 N331 L332 E337 N338	H326-Q334 HydrophobicContact CB-CB 4.36Å; H326-Q334 PolarHBondContact CE1-OE1 3.15Å; H326-Q334 PolarHBondContact ND1-OE1 3.37Å; H326-Q334 VanDerWaalsContact ND1-OE1 3.15Å; N331-Q334 PolarHBondContact O-N 2.84Å; N331-Q334 VanDerWaalsContact O-N 3.16Å; L332-Q334 PolarHBondContact O-N 3.05Å; Q334-E337 PolarHBondContact O-N 3.14Å; Q334-N338 PolarHBondContact O-N 2.95Å; Q334-N338 VanDerWaalsContact O-N 3.08Å; Q334-N338 PolarHBondContact O-ND2 3.06Å
335	A	95.4	Very high	95.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-45.9	171.9	0	0	0	0	0	111.3	H323 H326 A327 N331 L332 N338 V339 Y359	H323-A335 WeakPolarHBondContact CB-O 3.27Å; H326-A335 HydrophobicContact CB-CB 3.88Å; A327-A335 HydrophobicContact CB-CB 4.23Å; N331-A335 PolarHBondContact O-N 3.31Å; L332-A335 PolarHBondContact O-N 3.44Å; A335-N338 PolarHBondContact O-N 3.4Å; A335-V339 WeakPolarHBondContact O-CG2 3.42Å; A335-V339 PolarHBondContact O-N 3.04Å; A335-Y359 HydrophobicContact CB-CD2 3.84Å; A335-Y359 HydrophobicContact CB-CE2 3.83Å; A335-Y359 HydrophobicContact CB-CG 4.45Å
336	I	95	Very high	95.1	Very high	4 Å²	4	36 Å²	36	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-46.2	176.5	-71.3	166.4	0	0	0	111.1	L332 S333 N338 V339 L340 L356 Y359 Q360 L363	L332-I336 VanDerWaalsContact O-CG1 3.3Å; L332-I336 WeakPolarHBondContact O-CG1 3.44Å; L332-I336 PolarHBondContact O-N 3.08Å; S333-I336 PolarHBondContact O-N 2.86Å; I336-N338 VanDerWaalsContact C-N 3.34Å; I336-N338 PolarHBondContact O-N 3.13Å; I336-V339 PolarHBondContact O-N 3.19Å; I336-L340 HydrophobicContact CG2-CD1 3.73Å; I336-L340 HydrophobicContact CG2-CG 4.23Å; I336-L340 WeakPolarHBondContact O-CB 3.39Å; I336-L340 VanDerWaalsContact O-CG 3.28Å; I336-L340 WeakPolarHBondContact O-CG 3.44Å; I336-L340 PolarHBondContact O-N 3.43Å; I336-L356 HydrophobicContact CG1-CD1 4.4Å; I336-L356 HydrophobicContact CG2-CD1 3.9Å; I336-Y359 HydrophobicContact CG1-CD2 4.42Å; I336-Q360 HydrophobicContact CD1-CG 4.21Å; I336-L363 HydrophobicContact CD1-CD2 4.03Å
337	E	95.6	Very high	94.9	Very high	69 Å²	69	39.4 Å²	39.4	32%	0.322	22%	0.222	S	C	.	.	H	α-helix	trans	-57.3	-46	179	-166.7	-177.5	162	0	0	111.9	S333 Q334 S341 G371 R373	S333-E337 PolarHBondContact O-N 3.31Å; S333-E337 VanDerWaalsContact O-N 3.09Å; Q334-E337 PolarHBondContact O-N 3.14Å; E337-S341 PolarHBondContact O-N 3.16Å; E337-S341 PolarHBondContact O-OG 3Å; E337-G371 WeakPolarHBondContact CG-O 3.34Å; E337-R373 HydrophobicContact CG-CB 4.46Å; E337-R373 HydrophobicContact CG-CG 3.67Å; E337-R373 WeakPolarHBondContact OE1-CG 3.44Å
338	N	96.9	Very high	94.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-70.7	-38.2	178.5	-74.9	-79	0	0	0	112.7	L319 L322 H323 Q334 A335 I336 S341 V342 R373	L319-N338 WeakPolarHBondContact CD2-OD1 3.35Å; L322-N338 HydrophobicContact CB-CB 4.46Å; H323-N338 HydrophobicContact CB-CB 3.67Å; Q334-N338 PolarHBondContact O-N 2.95Å; Q334-N338 VanDerWaalsContact O-N 3.08Å; Q334-N338 PolarHBondContact O-ND2 3.06Å; A335-N338 PolarHBondContact O-N 3.4Å; I336-N338 VanDerWaalsContact C-N 3.34Å; I336-N338 PolarHBondContact O-N 3.13Å; N338-S341 WeakPolarHBondContact O-CB 3.35Å; N338-S341 PolarHBondContact O-N 2.97Å; N338-V342 PolarHBondContact O-N 2.9Å; N338-R373 WeakPolarHBondContact OD1-CD 3.5Å; N338-R373 PolarHBondContact OD1-NH1 2.97Å
339	V	96.9	Very high	94.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-43.6	174	172.7	0	0	0	0	111.3	H323 A335 I336 S341 V342 L343 A352 A355 L356 Y359	H323-V339 HydrophobicContact CB-CG2 3.64Å; H323-V339 VanDerWaalsContact CD2-CG2 3.48Å; H323-V339 WeakPolarHBondContact CD2-CG2 3.3Å; A335-V339 WeakPolarHBondContact O-CG2 3.42Å; A335-V339 PolarHBondContact O-N 3.04Å; I336-V339 PolarHBondContact O-N 3.19Å; V339-S341 PolarHBondContact O-N 3.07Å; V339-V342 WeakPolarHBondContact O-CB 3.13Å; V339-V342 PolarHBondContact O-N 2.94Å; V339-V342 VanDerWaalsContact O-N 3.08Å; V339-L343 HydrophobicContact CG1-CD1 4.38Å; V339-L343 PolarHBondContact O-N 3.01Å; V339-A352 HydrophobicContact CG1-CB 4.18Å; V339-A352 VanDerWaalsContact CG1-O 3.25Å; V339-A352 WeakPolarHBondContact CG1-O 3.46Å; V339-A355 HydrophobicContact CG2-CB 4.35Å; V339-L356 HydrophobicContact CG1-CB 3.76Å; V339-L356 HydrophobicContact CG1-CD1 4.37Å; V339-Y359 HydrophobicContact CG2-CD2 4.06Å; V339-Y359 HydrophobicContact CG2-CE2 3.62Å
340	L	96.7	Very high	94.6	Very high	37 Å²	37	41.7 Å²	41.7	19%	0.194	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-36.8	175.1	-72.4	171.8	0	0	0	111.2	I336 L343 L344 L356 P372	I336-L340 HydrophobicContact CG2-CD1 3.73Å; I336-L340 HydrophobicContact CG2-CG 4.23Å; I336-L340 WeakPolarHBondContact O-CB 3.39Å; I336-L340 VanDerWaalsContact O-CG 3.28Å; I336-L340 WeakPolarHBondContact O-CG 3.44Å; I336-L340 PolarHBondContact O-N 3.43Å; L340-L343 HydrophobicContact CD2-CD1 4.49Å; L340-L343 PolarHBondContact O-N 2.96Å; L340-L344 PolarHBondContact O-N 3.3Å; L340-L356 HydrophobicContact CD2-CD1 4.02Å; L340-L356 HydrophobicContact CD2-CD2 3.72Å; L340-L356 HydrophobicContact CG-CD1 4.06Å; L340-P372 HydrophobicContact CB-CB 4.06Å
341	S	97.6	Very high	94.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-36.9	172.2	-72.3	0	0	0	0	113.4	E337 N338 V339 L343 L344 F345 R373	E337-S341 PolarHBondContact O-N 3.16Å; E337-S341 PolarHBondContact O-OG 3Å; N338-S341 WeakPolarHBondContact O-CB 3.35Å; N338-S341 PolarHBondContact O-N 2.97Å; V339-S341 PolarHBondContact O-N 3.07Å; S341-L343 VanDerWaalsContact C-N 3.31Å; S341-L343 PolarHBondContact O-N 3.49Å; S341-L344 WeakPolarHBondContact O-CB 3.46Å; S341-L344 PolarHBondContact O-N 2.81Å; S341-F345 VanDerWaalsContact O-CD2 3.26Å; S341-F345 WeakPolarHBondContact O-CD2 3.37Å; S341-R373 WeakPolarHBondContact OG-CB 3.48Å; S341-R373 WeakPolarHBondContact OG-CG 3.36Å; S341-R373 PolarHBondContact OG-N 2.84Å
342	V	97.1	Very high	94.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-41.3	172	174.4	0	0	0	0	110.7	L319 R320 N338 V339 L344 F345 Y346 A352	L319-V342 HydrophobicContact CB-CG2 3.63Å; R320-V342 HydrophobicContact CG-CG1 4.36Å; R320-V342 HydrophobicContact CG-CG2 3.96Å; N338-V342 PolarHBondContact O-N 2.9Å; V339-V342 WeakPolarHBondContact O-CB 3.13Å; V339-V342 PolarHBondContact O-N 2.94Å; V339-V342 VanDerWaalsContact O-N 3.08Å; V342-L344 PolarHBondContact O-N 3.44Å; V342-F345 WeakPolarHBondContact O-CB 3.49Å; V342-F345 PolarHBondContact O-N 2.9Å; V342-Y346 PolarHBondContact O-N 3.25Å; V342-A352 HydrophobicContact CG1-CB 4.15Å
343	L	96.3	Very high	94.6	Very high	28 Å²	28	39.9 Å²	39.9	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-14.1	178.9	-66.5	172.1	0	0	0	113.8	V339 L340 S341 F345 Y346 P347 D349 A352 K353 L356	V339-L343 HydrophobicContact CG1-CD1 4.38Å; V339-L343 PolarHBondContact O-N 3.01Å; L340-L343 HydrophobicContact CD2-CD1 4.49Å; L340-L343 PolarHBondContact O-N 2.96Å; S341-L343 VanDerWaalsContact C-N 3.31Å; S341-L343 PolarHBondContact O-N 3.49Å; L343-F345 VanDerWaalsContact C-N 3.32Å; L343-Y346 WeakPolarHBondContact CD2-O 3.42Å; L343-P347 WeakPolarHBondContact O-CA 3.48Å; L343-D349 HydrophobicContact CD2-CB 4.47Å; L343-A352 HydrophobicContact CD2-CB 3.72Å; L343-A352 HydrophobicContact CG-CB 4.11Å; L343-K353 HydrophobicContact CD2-CG 4.08Å; L343-L356 HydrophobicContact CD1-CD2 3.81Å
344	L	95.8	Very high	94.7	Very high	57 Å²	57	46.4 Å²	46.4	30%	0.298	23%	0.231	S	C	.	.	H	α-helix	trans	-69	-31.7	168.4	-68	179.6	0	0	0	112.4	L340 S341 V342 P372 I376 Q377	L340-L344 PolarHBondContact O-N 3.3Å; S341-L344 WeakPolarHBondContact O-CB 3.46Å; S341-L344 PolarHBondContact O-N 2.81Å; V342-L344 PolarHBondContact O-N 3.44Å; L344-P372 HydrophobicContact CD1-CB 3.59Å; L344-P372 HydrophobicContact CD1-CG 3.91Å; L344-P372 HydrophobicContact CD2-CB 4.45Å; L344-P372 HydrophobicContact CD2-CG 4.17Å; L344-P372 HydrophobicContact CG-CB 3.97Å; L344-P372 HydrophobicContact CG-CG 4.23Å; L344-I376 HydrophobicContact CD1-CG2 4.09Å; L344-Q377 HydrophobicContact CD1-CB 4.11Å; L344-Q377 HydrophobicContact CD1-CG 4.48Å
345	F	94.5	Very high	94.7	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.022	22%	0.216	C	C	.	.	H	α-helix	trans	-84.9	-47.3	176.2	-62.1	-83.5	0	0	0	110.9	L315 P316 L319 S341 V342 L343 P347 I376 F379 W407	L315-F345 HydrophobicContact CB-CZ 4.46Å; P316-F345 HydrophobicContact CG-CB 4.18Å; P316-F345 HydrophobicContact CG-CD1 4.06Å; P316-F345 HydrophobicContact CG-CD2 4.02Å; P316-F345 HydrophobicContact CG-CE1 4.45Å; P316-F345 HydrophobicContact CG-CE2 4.41Å; P316-F345 HydrophobicContact CG-CG 3.83Å; L319-F345 HydrophobicContact CD1-CD2 4.31Å; L319-F345 HydrophobicContact CD1-CE2 3.66Å; S341-F345 VanDerWaalsContact O-CD2 3.26Å; S341-F345 WeakPolarHBondContact O-CD2 3.37Å; V342-F345 WeakPolarHBondContact O-CB 3.49Å; V342-F345 PolarHBondContact O-N 2.9Å; L343-F345 VanDerWaalsContact C-N 3.32Å; F345-P347 WeakPolarHBondContact O-CD 3.22Å; F345-I376 HydrophobicContact CE2-CG2 3.48Å; F345-I376 VanDerWaalsContact CE2-CG2 3.48Å; F345-I376 HydrophobicContact CZ-CG2 3.82Å; F345-F379 HydrophobicContact CE1-CD1 4.2Å; F345-F379 AromaticContact CE1-CE1 3.96Å; F345-F379 HydrophobicContact CE1-CE1 3.96Å; F345-F379 HydrophobicContact CZ-CD1 4.17Å; F345-F379 HydrophobicContact CZ-CE1 4.28Å; F345-W407 HydrophobicContact CB-CB 4.13Å; F345-W407 HydrophobicContact CB-CG 4.23Å; F345-W407 AromaticContact CD1-CD1 3.92Å; F345-W407 AromaticContact CD1-CD2 3.53Å; F345-W407 HydrophobicContact CD1-CD2 3.53Å; F345-W407 AromaticContact CD1-CE2 3.58Å; F345-W407 AromaticContact CD1-CE3 3.95Å; F345-W407 HydrophobicContact CD1-CE3 3.95Å; F345-W407 AromaticContact CD1-CG 3.78Å; F345-W407 HydrophobicContact CD1-CG 3.78Å; F345-W407 HydrophobicContact CD1-CH2 4.46Å; F345-W407 HydrophobicContact CD1-CZ2 4.09Å; F345-W407 HydrophobicContact CD1-CZ3 4.39Å; F345-W407 AromaticContact CD1-NE1 3.82Å; F345-W407 HydrophobicContact CE1-CD2 4.23Å; F345-W407 AromaticContact CE1-CE2 3.83Å; F345-W407 HydrophobicContact CE1-CH2 4.36Å; F345-W407 AromaticContact CE1-CZ2 3.93Å; F345-W407 HydrophobicContact CE1-CZ2 3.93Å
346	Y	93.7	Very high	94.6	Very high	51 Å²	51	43.6 Å²	43.6	20%	0.2	22%	0.221	C	C	.	.			trans	-127	83.7	-175.8	-63.1	-68.8	0	0	0	110.9	D313 P316 V342 L343 D348 D349 P406 W407	D313-Y346 PolarHBondContact OD1-OH 2.58Å; D313-Y346 WeakPolarHBondContact OD2-CE2 3.35Å; D313-Y346 PolarHBondContact OD2-OH 3.29Å; P316-Y346 HydrophobicContact CB-CE2 4.36Å; P316-Y346 HydrophobicContact CG-CE2 4.23Å; V342-Y346 PolarHBondContact O-N 3.25Å; L343-Y346 WeakPolarHBondContact CD2-O 3.42Å; Y346-D348 PolarHBondContact O-N 3.01Å; Y346-D348 VanDerWaalsContact O-N 3.12Å; Y346-D349 WeakPolarHBondContact O-CB 3.3Å; Y346-D349 PolarHBondContact O-N 2.97Å; Y346-D349 VanDerWaalsContact O-N 3.15Å; Y346-P406 WeakPolarHBondContact OH-CG 3.46Å; Y346-W407 HydrophobicContact CD1-CB 4.25Å; Y346-W407 HydrophobicContact CE1-CB 3.63Å; Y346-W407 HydrophobicContact CE2-CB 4.16Å
347	P	93.5	Very high	94.6	Very high	83 Å²	83	48.2 Å²	48.2	54%	0.539	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.1	-179.2	-25	34.5	0	0	0	113.6	L343 F345 K353	L343-P347 WeakPolarHBondContact O-CA 3.48Å; F345-P347 WeakPolarHBondContact O-CD 3.22Å; P347-K353 WeakPolarHBondContact O-CE 3.38Å
348	D	91	Very high	94.5	Very high	127 Å²	127	50 Å²	50	68%	0.679	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	9.5	-177.4	-65.9	-46.8	0	0	0	114.8	Y346 E350 K353	Y346-D348 PolarHBondContact O-N 3.01Å; Y346-D348 VanDerWaalsContact O-N 3.12Å; D348-E350 PolarHBondContact O-N 3.45Å; D348-K353 IonicContact OD1-NZ 2.9Å; D348-K353 PolarHBondContact OD1-NZ 3.45Å
349	D	91.6	Very high	94.3	Very high	29 Å²	29	50.8 Å²	50.8	16%	0.155	26%	0.257	C	S	.	.			trans	-68.3	104.4	178.2	-170.7	-53.5	0	0	0	111.8	R320 L343 Y346 A351 A352 K353	R320-D349 IonicContact CZ-OD2 2.69Å; R320-D349 IonicContact NH1-OD1 3.39Å; R320-D349 IonicContact NH1-OD2 3.07Å; R320-D349 PolarHBondContact NH1-OD2 2.96Å; R320-D349 IonicContact NH2-OD2 3.31Å; R320-D349 PolarHBondContact NH2-OD2 2.84Å; L343-D349 HydrophobicContact CD2-CB 4.47Å; Y346-D349 WeakPolarHBondContact O-CB 3.3Å; Y346-D349 PolarHBondContact O-N 2.97Å; Y346-D349 VanDerWaalsContact O-N 3.15Å; D349-A351 VanDerWaalsContact C-N 3.28Å; D349-A351 PolarHBondContact O-N 3.14Å; D349-A351 WeakPolarHBondContact OD1-CA 3.4Å; D349-A351 WeakPolarHBondContact OD1-CB 3.46Å; D349-A351 PolarHBondContact OD1-N 2.75Å; D349-A352 HydrophobicContact CB-CB 3.92Å; D349-A352 PolarHBondContact O-N 3.22Å; D349-A352 PolarHBondContact OD1-N 3.13Å; D349-K353 WeakPolarHBondContact O-CG 3.26Å; D349-K353 PolarHBondContact O-N 2.82Å
350	E	93.6	Very high	94	Very high	112 Å²	112	55.2 Å²	55.2	52%	0.523	28%	0.278	S	S	.	.	H	α-helix	trans	-66.8	-24.3	-178	-66.6	-56.6	134.3	0	0	113.7	D348 K353 R354	D348-E350 PolarHBondContact O-N 3.45Å; E350-K353 IonicContact OE1-NZ 3.11Å; E350-K353 PolarHBondContact OE1-NZ 3.33Å; E350-R354 WeakPolarHBondContact O-CB 3.23Å; E350-R354 WeakPolarHBondContact O-CG 3.29Å; E350-R354 PolarHBondContact O-N 3.17Å; E350-R354 PolarHBondContact O-NE 3.2Å
351	A	91.4	Very high	93.7	Very high	50 Å²	50	57.4 Å²	57.4	41%	0.413	30%	0.301	S	S	.	.	H	α-helix	trans	-73.7	-44.9	174.1	0	0	0	0	0	110.5	D349 R354 A355	D349-A351 VanDerWaalsContact C-N 3.28Å; D349-A351 PolarHBondContact O-N 3.14Å; D349-A351 WeakPolarHBondContact OD1-CA 3.4Å; D349-A351 WeakPolarHBondContact OD1-CB 3.46Å; D349-A351 PolarHBondContact OD1-N 2.75Å; A351-R354 PolarHBondContact O-N 2.96Å; A351-A355 WeakPolarHBondContact O-CB 3.48Å; A351-A355 PolarHBondContact O-N 3.17Å
352	A	91.9	Very high	93.3	Very high	2 Å²	2	62.9 Å²	62.9	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-44.5	176.5	0	0	0	0	0	111.8	V339 V342 L343 D349 R354 A355 L356	V339-A352 HydrophobicContact CG1-CB 4.18Å; V339-A352 VanDerWaalsContact CG1-O 3.25Å; V339-A352 WeakPolarHBondContact CG1-O 3.46Å; V342-A352 HydrophobicContact CG1-CB 4.15Å; L343-A352 HydrophobicContact CD2-CB 3.72Å; L343-A352 HydrophobicContact CG-CB 4.11Å; D349-A352 HydrophobicContact CB-CB 3.92Å; D349-A352 PolarHBondContact O-N 3.22Å; D349-A352 PolarHBondContact OD1-N 3.13Å; A352-R354 PolarHBondContact O-N 3.41Å; A352-A355 PolarHBondContact O-N 3.32Å; A352-L356 WeakPolarHBondContact O-CB 3.45Å; A352-L356 PolarHBondContact O-N 3.28Å
353	K	94.9	Very high	92.8	Very high	57 Å²	57	65.1 Å²	65.1	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-43.8	174.9	-70.8	175.7	-169.7	168.7	0	112.2	L343 P347 D348 D349 E350 L356 N357	L343-K353 HydrophobicContact CD2-CG 4.08Å; P347-K353 WeakPolarHBondContact O-CE 3.38Å; D348-K353 IonicContact OD1-NZ 2.9Å; D348-K353 PolarHBondContact OD1-NZ 3.45Å; D349-K353 WeakPolarHBondContact O-CG 3.26Å; D349-K353 PolarHBondContact O-N 2.82Å; E350-K353 IonicContact OE1-NZ 3.11Å; E350-K353 PolarHBondContact OE1-NZ 3.33Å; K353-L356 PolarHBondContact O-N 2.92Å; K353-N357 VanDerWaalsContact O-CG 3.31Å; K353-N357 PolarHBondContact O-N 2.67Å; K353-N357 PolarHBondContact O-ND2 3.35Å
354	R	95.3	Very high	91.8	Very high	169 Å²	169	66.8 Å²	66.8	64%	0.638	36%	0.362	S	S	*	.	H	α-helix	trans	-63.4	-45.9	176.8	-77.9	-176.8	-66.5	163.4	-0.9	111.9	E350 A351 A352 L356 N357 Q358	E350-R354 WeakPolarHBondContact O-CB 3.23Å; E350-R354 WeakPolarHBondContact O-CG 3.29Å; E350-R354 PolarHBondContact O-N 3.17Å; E350-R354 PolarHBondContact O-NE 3.2Å; A351-R354 PolarHBondContact O-N 2.96Å; A352-R354 PolarHBondContact O-N 3.41Å; R354-L356 VanDerWaalsContact C-N 3.35Å; R354-L356 PolarHBondContact O-N 3Å; R354-N357 PolarHBondContact O-N 3.38Å; R354-Q358 WeakPolarHBondContact O-CB 3.39Å; R354-Q358 PolarHBondContact O-N 3.12Å
355	A	94.1	Very high	90.5	Very high	12 Å²	12	71.8 Å²	71.8	10%	0.099	38%	0.384	C	S	.	.	H	α-helix	trans	-60.8	-43.6	176.3	0	0	0	0	0	111.6	V339 A351 A352 N357 Q358 Y359	V339-A355 HydrophobicContact CG2-CB 4.35Å; A351-A355 WeakPolarHBondContact O-CB 3.48Å; A351-A355 PolarHBondContact O-N 3.17Å; A352-A355 PolarHBondContact O-N 3.32Å; A355-N357 PolarHBondContact O-N 2.89Å; A355-Q358 WeakPolarHBondContact O-CB 3.37Å; A355-Q358 PolarHBondContact O-N 2.92Å; A355-Y359 HydrophobicContact CB-CE2 4.03Å; A355-Y359 VanDerWaalsContact O-CD2 3.31Å; A355-Y359 WeakPolarHBondContact O-CD2 3.31Å; A355-Y359 PolarHBondContact O-N 2.87Å
356	L	94.2	Very high	89	Confident	19 Å²	19	77.5 Å²	77.5	10%	0.099	42%	0.421	C	S	.	.	H	α-helix	trans	-57.5	-51.4	176.7	-177.1	61.3	0	0	0	111.7	I336 V339 L340 L343 A352 K353 R354 Q358 Y359 Q360	I336-L356 HydrophobicContact CG1-CD1 4.4Å; I336-L356 HydrophobicContact CG2-CD1 3.9Å; V339-L356 HydrophobicContact CG1-CB 3.76Å; V339-L356 HydrophobicContact CG1-CD1 4.37Å; L340-L356 HydrophobicContact CD2-CD1 4.02Å; L340-L356 HydrophobicContact CD2-CD2 3.72Å; L340-L356 HydrophobicContact CG-CD1 4.06Å; L343-L356 HydrophobicContact CD1-CD2 3.81Å; A352-L356 WeakPolarHBondContact O-CB 3.45Å; A352-L356 PolarHBondContact O-N 3.28Å; K353-L356 PolarHBondContact O-N 2.92Å; R354-L356 VanDerWaalsContact C-N 3.35Å; R354-L356 PolarHBondContact O-N 3Å; L356-Q358 VanDerWaalsContact C-N 3.29Å; L356-Q358 PolarHBondContact O-N 3.03Å; L356-Y359 PolarHBondContact O-N 3.08Å; L356-Q360 HydrophobicContact CD1-CG 4.26Å; L356-Q360 HydrophobicContact CG-CG 4.47Å; L356-Q360 WeakPolarHBondContact O-CB 3.22Å; L356-Q360 VanDerWaalsContact O-CG 3.28Å; L356-Q360 WeakPolarHBondContact O-CG 3.09Å; L356-Q360 PolarHBondContact O-N 2.89Å
357	N	93	Very high	87.6	Confident	101 Å²	101	82.6 Å²	82.6	54%	0.54	44%	0.44	S	S	.	.	H	α-helix	trans	-60.8	-40.1	179.2	-70.6	-24.1	0	0	0	111.4	K353 R354 A355 A361	K353-N357 VanDerWaalsContact O-CG 3.31Å; K353-N357 PolarHBondContact O-N 2.67Å; K353-N357 PolarHBondContact O-ND2 3.35Å; R354-N357 PolarHBondContact O-N 3.38Å; A355-N357 PolarHBondContact O-N 2.89Å; N357-A361 WeakPolarHBondContact O-CB 3.43Å; N357-A361 PolarHBondContact O-N 3.13Å
358	Q	93.6	Very high	86.1	Confident	108 Å²	108	85 Å²	85	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-62.7	-48.5	176.2	-178.5	179.3	-1.3	0	0	111.7	R354 A355 L356 A361 Q362	R354-Q358 WeakPolarHBondContact O-CB 3.39Å; R354-Q358 PolarHBondContact O-N 3.12Å; A355-Q358 WeakPolarHBondContact O-CB 3.37Å; A355-Q358 PolarHBondContact O-N 2.92Å; L356-Q358 VanDerWaalsContact C-N 3.29Å; L356-Q358 PolarHBondContact O-N 3.03Å; Q358-A361 PolarHBondContact O-N 3.41Å; Q358-Q362 WeakPolarHBondContact O-CG 3.32Å; Q358-Q362 PolarHBondContact O-N 2.99Å; Q358-Q362 VanDerWaalsContact O-N 3.11Å
359	Y	93.3	Very high	85	Confident	20 Å²	20	82.9 Å²	82.9	8%	0.078	46%	0.464	C	S	.	.	H	α-helix	trans	-66.3	-39.2	-179.9	-57.5	-24.7	0	0	0	112	A327 L332 A335 I336 V339 A355 L356 Q362 L363	A327-Y359 HydrophobicContact CB-CD1 4.37Å; A327-Y359 HydrophobicContact CB-CE1 3.52Å; A327-Y359 HydrophobicContact CB-CE2 4.38Å; A327-Y359 WeakPolarHBondContact CB-OH 3.48Å; L332-Y359 HydrophobicContact CD2-CD1 4.06Å; L332-Y359 HydrophobicContact CD2-CG 4.4Å; A335-Y359 HydrophobicContact CB-CD2 3.84Å; A335-Y359 HydrophobicContact CB-CE2 3.83Å; A335-Y359 HydrophobicContact CB-CG 4.45Å; I336-Y359 HydrophobicContact CG1-CD2 4.42Å; V339-Y359 HydrophobicContact CG2-CD2 4.06Å; V339-Y359 HydrophobicContact CG2-CE2 3.62Å; A355-Y359 HydrophobicContact CB-CE2 4.03Å; A355-Y359 VanDerWaalsContact O-CD2 3.31Å; A355-Y359 WeakPolarHBondContact O-CD2 3.31Å; A355-Y359 PolarHBondContact O-N 2.87Å; L356-Y359 PolarHBondContact O-N 3.08Å; Y359-Q362 PolarHBondContact O-N 3.4Å; Y359-L363 WeakPolarHBondContact O-CB 3.4Å; Y359-L363 PolarHBondContact O-N 2.9Å
360	Q	90.8	Very high	84.6	Confident	93 Å²	93	84.2 Å²	84.2	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-63.2	-43.5	175.5	-74.5	176.1	-16.7	0	0	111.9	I336 L356 Q362 L363 G364	I336-Q360 HydrophobicContact CD1-CG 4.21Å; L356-Q360 HydrophobicContact CD1-CG 4.26Å; L356-Q360 HydrophobicContact CG-CG 4.47Å; L356-Q360 WeakPolarHBondContact O-CB 3.22Å; L356-Q360 VanDerWaalsContact O-CG 3.28Å; L356-Q360 WeakPolarHBondContact O-CG 3.09Å; L356-Q360 PolarHBondContact O-N 2.89Å; Q360-Q362 VanDerWaalsContact C-N 3.3Å; Q360-Q362 PolarHBondContact O-N 3.28Å; Q360-L363 PolarHBondContact O-N 3.5Å; Q360-G364 PolarHBondContact O-N 3.48Å
361	A	90.1	Very high	84.4	Confident	83 Å²	83	80.2 Å²	80.2	69%	0.686	46%	0.46	S	S	*	.	H	α-helix	trans	-62.6	-36.8	176.7	0	0	0	0	0	112.4	N357 Q358	N357-A361 WeakPolarHBondContact O-CB 3.43Å; N357-A361 PolarHBondContact O-N 3.13Å; Q358-A361 PolarHBondContact O-N 3.41Å
362	Q	90.2	Very high	84.6	Confident	115 Å²	115	79.5 Å²	79.5	54%	0.537	45%	0.451	S	S	.	.	H	α-helix	trans	-74.3	-29.4	177.3	-69.9	176.2	7.2	0	0	113.3	L332 Q358 Y359 Q360 G364	L332-Q362 HydrophobicContact CD1-CB 3.59Å; Q358-Q362 WeakPolarHBondContact O-CG 3.32Å; Q358-Q362 PolarHBondContact O-N 2.99Å; Q358-Q362 VanDerWaalsContact O-N 3.11Å; Y359-Q362 PolarHBondContact O-N 3.4Å; Q360-Q362 VanDerWaalsContact C-N 3.3Å; Q360-Q362 PolarHBondContact O-N 3.28Å; Q362-G364 VanDerWaalsContact C-N 3.34Å
363	L	85.3	Confident	84.8	Confident	47 Å²	47	80.2 Å²	80.2	25%	0.246	45%	0.453	C	S	.	.	H	α-helix	trans	-74.3	-25.1	179.1	-159.2	79.1	0	0	0	112.6	L332 I336 Y359 Q360 E365 R367 L370	L332-L363 HydrophobicContact CB-CD1 3.76Å; L332-L363 HydrophobicContact CD1-CD1 4.33Å; I336-L363 HydrophobicContact CD1-CD2 4.03Å; Y359-L363 WeakPolarHBondContact O-CB 3.4Å; Y359-L363 PolarHBondContact O-N 2.9Å; Q360-L363 PolarHBondContact O-N 3.5Å; L363-E365 VanDerWaalsContact C-N 3.34Å; L363-E365 PolarHBondContact O-N 3.44Å; L363-R367 HydrophobicContact CD2-CG 4.5Å; L363-L370 HydrophobicContact CD2-CD1 3.94Å
364	G	76.1	Confident	84.7	Confident	62 Å²	62	83.6 Å²	83.6	64%	0.639	47%	0.47	S	S	*	.			trans	78.3	-67.6	175.1	0	0	0	0	0	114.2	Q360 Q362	Q360-G364 PolarHBondContact O-N 3.48Å; Q362-G364 VanDerWaalsContact C-N 3.34Å
365	E	69.5	Low	84.7	Confident	163 Å²	163	77.2 Å²	77.2	76%	0.762	45%	0.449	S	S	*	.	S	Bend	trans	-94.8	131.1	-179.5	-71.9	-165.9	168.4	0	0	112.3	L363 R367	L363-E365 VanDerWaalsContact C-N 3.34Å; L363-E365 PolarHBondContact O-N 3.44Å; E365-R367 PolarHBondContact O-N 2.86Å
366	P	61.3	Low	84.8	Confident	125 Å²	125	76.7 Å²	76.7	81%	0.812	44%	0.444	S	S	*	.			trans	-66.9	109.5	173.3	25.7	-30.4	0	0	0	109.3	P368	P366-P368 VanDerWaalsContact O-CD 3.28Å; P366-P368 WeakPolarHBondContact O-CD 3.31Å
367	R	66	Low	84.9	Confident	158 Å²	158	79.8 Å²	79.8	60%	0.596	46%	0.458	S	S	*	.			trans	-75.7	117.8	172.2	-67.2	-173	175.6	-171.7	-0.4	109.3	L363 E365 G369 L370	L363-R367 HydrophobicContact CD2-CG 4.5Å; E365-R367 PolarHBondContact O-N 2.86Å; R367-G369 PolarHBondContact O-N 3.46Å; R367-L370 HydrophobicContact CB-CD1 3.76Å; R367-L370 HydrophobicContact CB-CG 4.21Å; R367-L370 HydrophobicContact CG-CD1 4.44Å; R367-L370 PolarHBondContact O-N 2.98Å
368	P	61.2	Low	84.8	Confident	133 Å²	133	81.8 Å²	81.8	86%	0.864	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	127.8	173.3	24	-30.4	0	0	0	109.4	P366	P366-P368 VanDerWaalsContact O-CD 3.28Å; P366-P368 WeakPolarHBondContact O-CD 3.31Å
369	G	68.8	Low	84.9	Confident	83 Å²	83	77.1 Å²	77.1	86%	0.856	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.4	0.9	178	0	0	0	0	0	116.4	R367 G371	R367-G369 PolarHBondContact O-N 3.46Å; G369-G371 PolarHBondContact O-N 3.31Å
370	L	82.9	Confident	84.9	Confident	56 Å²	56	76.5 Å²	76.5	29%	0.293	43%	0.434	S	S	.	.			trans	-73.2	104.2	167.5	-79.3	166.3	0	0	0	109.6	L363 R367	L363-L370 HydrophobicContact CD2-CD1 3.94Å; R367-L370 HydrophobicContact CB-CD1 3.76Å; R367-L370 HydrophobicContact CB-CG 4.21Å; R367-L370 HydrophobicContact CG-CD1 4.44Å; R367-L370 PolarHBondContact O-N 2.98Å
371	G	89.7	Confident	84.9	Confident	28 Å²	28	77.6 Å²	77.6	29%	0.289	44%	0.443	S	S	.	.			trans	-120.6	-176.9	174.8	0	0	0	0	0	111.6	E337 G369	E337-G371 WeakPolarHBondContact CG-O 3.34Å; G369-G371 PolarHBondContact O-N 3.31Å
372	P	94.5	Very high	85	Confident	36 Å²	36	77.3 Å²	77.3	23%	0.234	42%	0.424	C	S	.	.	S	Bend	trans	-65.5	156.9	165.9	30.5	-34.9	0	0	0	110.6	L340 L344 E374	L340-P372 HydrophobicContact CB-CB 4.06Å; L344-P372 HydrophobicContact CD1-CB 3.59Å; L344-P372 HydrophobicContact CD1-CG 3.91Å; L344-P372 HydrophobicContact CD2-CB 4.45Å; L344-P372 HydrophobicContact CD2-CG 4.17Å; L344-P372 HydrophobicContact CG-CB 3.97Å; L344-P372 HydrophobicContact CG-CG 4.23Å; P372-E374 PolarHBondContact O-N 3.24Å
373	R	95.9	Very high	85.1	Confident	16 Å²	16	72 Å²	72	6%	0.06	40%	0.399	C	S	.	.			trans	-55.2	136.2	175.8	-55.6	172.7	58.4	128.8	9	111.7	E240 L243 E337 N338 S341 D375 I376 Q377	E240-R373 IonicContact OE1-CZ 3.72Å; E240-R373 IonicContact OE1-NH1 2.59Å; E240-R373 PolarHBondContact OE1-NH1 3.4Å; E240-R373 IonicContact OE1-NH2 3.93Å; E240-R373 PolarHBondContact OE1-NH2 2.89Å; E240-R373 IonicContact OE2-CZ 2.81Å; E240-R373 IonicContact OE2-NH1 3.73Å; E240-R373 PolarHBondContact OE2-NH1 3.11Å; E240-R373 IonicContact OE2-NH2 2.89Å; L243-R373 VanDerWaalsContact CD2-CZ 3.45Å; E337-R373 HydrophobicContact CG-CB 4.46Å; E337-R373 HydrophobicContact CG-CG 3.67Å; E337-R373 WeakPolarHBondContact OE1-CG 3.44Å; N338-R373 WeakPolarHBondContact OD1-CD 3.5Å; N338-R373 PolarHBondContact OD1-NH1 2.97Å; S341-R373 WeakPolarHBondContact OG-CB 3.48Å; S341-R373 WeakPolarHBondContact OG-CG 3.36Å; S341-R373 PolarHBondContact OG-N 2.84Å; R373-D375 WeakPolarHBondContact CB-OD1 3.4Å; R373-D375 IonicContact CZ-OD2 3.31Å; R373-D375 IonicContact NE-OD1 3.02Å; R373-D375 PolarHBondContact NE-OD1 3.22Å; R373-D375 IonicContact NE-OD2 2.98Å; R373-D375 IonicContact NH2-OD1 3.86Å; R373-D375 IonicContact NH2-OD2 2.79Å; R373-D375 PolarHBondContact NH2-OD2 3.34Å; R373-D375 PolarHBondContact O-N 2.71Å; R373-I376 HydrophobicContact CB-CB 4.32Å; R373-I376 HydrophobicContact CB-CG1 4.07Å; R373-I376 PolarHBondContact O-N 3.45Å; R373-Q377 WeakPolarHBondContact O-CB 3.34Å; R373-Q377 PolarHBondContact O-N 3.21Å
374	E	94.1	Very high	85.5	Confident	128 Å²	128	71.6 Å²	71.6	60%	0.598	40%	0.397	S	S	*	.	H	α-helix	trans	-65.1	-37.8	-176.6	-165.2	-166.5	160.2	0	0	112.6	P372 Q377 R378	P372-E374 PolarHBondContact O-N 3.24Å; E374-Q377 PolarHBondContact O-N 2.91Å; E374-R378 VanDerWaalsContact CD-NH2 3.35Å; E374-R378 VanDerWaalsContact O-CB 3.31Å; E374-R378 WeakPolarHBondContact O-CB 3.29Å; E374-R378 PolarHBondContact O-N 3.37Å; E374-R378 IonicContact OE1-CZ 3.86Å; E374-R378 IonicContact OE1-NH2 3.86Å; E374-R378 PolarHBondContact OE1-NH2 2.93Å
375	D	94.4	Very high	86.1	Confident	36 Å²	36	70 Å²	70	19%	0.193	38%	0.381	C	S	.	.	H	α-helix	trans	-62.3	-45	177.8	53.3	5.1	0	0	0	111.9	Q244 L247 R373 R378 F379	Q244-D375 PolarHBondContact NE2-OD2 3.01Å; L247-D375 HydrophobicContact CD1-CB 4.11Å; R373-D375 WeakPolarHBondContact CB-OD1 3.4Å; R373-D375 IonicContact CZ-OD2 3.31Å; R373-D375 IonicContact NE-OD1 3.02Å; R373-D375 PolarHBondContact NE-OD1 3.22Å; R373-D375 IonicContact NE-OD2 2.98Å; R373-D375 IonicContact NH2-OD1 3.86Å; R373-D375 IonicContact NH2-OD2 2.79Å; R373-D375 PolarHBondContact NH2-OD2 3.34Å; R373-D375 PolarHBondContact O-N 2.71Å; D375-R378 PolarHBondContact O-N 3.19Å; D375-F379 WeakPolarHBondContact O-CB 3.43Å; D375-F379 PolarHBondContact O-N 3.13Å
376	I	96.9	Very high	87.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-68.6	-40.8	175.6	-57.8	-53.9	0	0	0	111.6	L243 L247 L319 L344 F345 R373 R378 F379 T380	L243-I376 HydrophobicContact CD1-CD1 4.3Å; L247-I376 HydrophobicContact CD1-CD1 4.22Å; L319-I376 HydrophobicContact CD1-CD1 4.15Å; L319-I376 HydrophobicContact CD1-CG1 4.09Å; L319-I376 HydrophobicContact CD1-CG2 4.2Å; L319-I376 HydrophobicContact CD2-CD1 4.32Å; L319-I376 HydrophobicContact CD2-CG1 4.04Å; L344-I376 HydrophobicContact CD1-CG2 4.09Å; F345-I376 HydrophobicContact CE2-CG2 3.48Å; F345-I376 VanDerWaalsContact CE2-CG2 3.48Å; F345-I376 HydrophobicContact CZ-CG2 3.82Å; R373-I376 HydrophobicContact CB-CB 4.32Å; R373-I376 HydrophobicContact CB-CG1 4.07Å; R373-I376 PolarHBondContact O-N 3.45Å; I376-R378 VanDerWaalsContact C-N 3.34Å; I376-R378 PolarHBondContact O-N 3.49Å; I376-F379 PolarHBondContact O-N 3.38Å; I376-T380 WeakPolarHBondContact O-CB 3.34Å; I376-T380 PolarHBondContact O-N 3.04Å; I376-T380 PolarHBondContact O-OG1 3.46Å
377	Q	94.8	Very high	88.6	Confident	85 Å²	85	56.8 Å²	56.8	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-45.5	176.5	-169.6	178.5	37	0	0	111	L344 R373 E374 F379 T380 L381	L344-Q377 HydrophobicContact CD1-CB 4.11Å; L344-Q377 HydrophobicContact CD1-CG 4.48Å; R373-Q377 WeakPolarHBondContact O-CB 3.34Å; R373-Q377 PolarHBondContact O-N 3.21Å; E374-Q377 PolarHBondContact O-N 2.91Å; Q377-F379 PolarHBondContact O-N 2.68Å; Q377-T380 PolarHBondContact O-N 3.44Å; Q377-L381 HydrophobicContact CG-CD1 4.03Å; Q377-L381 WeakPolarHBondContact O-CB 3.44Å; Q377-L381 VanDerWaalsContact O-CG 3.31Å; Q377-L381 WeakPolarHBondContact O-CG 3.32Å; Q377-L381 PolarHBondContact O-N 3.03Å
378	R	92.2	Very high	89.8	Confident	142 Å²	142	57.8 Å²	57.8	54%	0.536	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-42.1	176.4	-168.5	-176	-59.1	137.3	-0.4	111.9	E374 D375 I376 R382	E374-R378 VanDerWaalsContact CD-NH2 3.35Å; E374-R378 VanDerWaalsContact O-CB 3.31Å; E374-R378 WeakPolarHBondContact O-CB 3.29Å; E374-R378 PolarHBondContact O-N 3.37Å; E374-R378 IonicContact OE1-CZ 3.86Å; E374-R378 IonicContact OE1-NH2 3.86Å; E374-R378 PolarHBondContact OE1-NH2 2.93Å; D375-R378 PolarHBondContact O-N 3.19Å; I376-R378 VanDerWaalsContact C-N 3.34Å; I376-R378 PolarHBondContact O-N 3.49Å; R378-R382 VanDerWaalsContact O-CB 3.29Å; R378-R382 WeakPolarHBondContact O-CB 3.42Å; R378-R382 PolarHBondContact O-N 2.98Å; R378-R382 VanDerWaalsContact O-N 3.15Å
379	F	94.1	Very high	91.2	Very high	10 Å²	10	55.5 Å²	55.5	4%	0.044	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-52	175.4	172	-92.6	0	0	0	111.4	L247 M250 V298 L315 F345 D375 I376 Q377 R382 S383 W407	L247-F379 HydrophobicContact CD2-CD2 4.21Å; L247-F379 HydrophobicContact CD2-CG 4.43Å; M250-F379 HydrophobicContact SD-CE2 3.72Å; M250-F379 HydrophobicContact SD-CZ 4.29Å; V298-F379 HydrophobicContact CG2-CE2 4.31Å; V298-F379 HydrophobicContact CG2-CZ 3.99Å; L315-F379 HydrophobicContact CD1-CD1 4.21Å; L315-F379 HydrophobicContact CD1-CD2 4.48Å; L315-F379 HydrophobicContact CD1-CE1 3.78Å; L315-F379 HydrophobicContact CD1-CE2 4.07Å; L315-F379 HydrophobicContact CD1-CZ 3.71Å; F345-F379 HydrophobicContact CE1-CD1 4.2Å; F345-F379 AromaticContact CE1-CE1 3.96Å; F345-F379 HydrophobicContact CE1-CE1 3.96Å; F345-F379 HydrophobicContact CZ-CD1 4.17Å; F345-F379 HydrophobicContact CZ-CE1 4.28Å; D375-F379 WeakPolarHBondContact O-CB 3.43Å; D375-F379 PolarHBondContact O-N 3.13Å; I376-F379 PolarHBondContact O-N 3.38Å; Q377-F379 PolarHBondContact O-N 2.68Å; F379-R382 PolarHBondContact O-N 3.45Å; F379-S383 WeakPolarHBondContact O-CB 3.47Å; F379-S383 PolarHBondContact O-N 2.99Å; F379-W407 HydrophobicContact CE1-CH2 4.3Å; F379-W407 AromaticContact CE1-CZ2 3.94Å; F379-W407 HydrophobicContact CE1-CZ2 3.94Å
380	T	93.9	Very high	92.2	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.043	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-49.8	-175.4	-51.4	0	0	0	0	110.9	I376 Q377 R382 S383 L384 W407	I376-T380 WeakPolarHBondContact O-CB 3.34Å; I376-T380 PolarHBondContact O-N 3.04Å; I376-T380 PolarHBondContact O-OG1 3.46Å; Q377-T380 PolarHBondContact O-N 3.44Å; T380-R382 VanDerWaalsContact C-N 3.33Å; T380-R382 PolarHBondContact O-N 3.03Å; T380-S383 PolarHBondContact O-N 3.21Å; T380-L384 HydrophobicContact CG2-CD1 3.97Å; T380-L384 HydrophobicContact CG2-CG 4.41Å; T380-L384 WeakPolarHBondContact O-CB 3.44Å; T380-L384 VanDerWaalsContact O-CG 3.31Å; T380-L384 WeakPolarHBondContact O-CG 3.28Å; T380-L384 PolarHBondContact O-N 3.45Å; T380-W407 HydrophobicContact CG2-CH2 4.49Å; T380-W407 HydrophobicContact CG2-CZ3 4.01Å
381	L	92	Very high	92.6	Very high	117 Å²	117	49.2 Å²	49.2	61%	0.613	24%	0.237	S	C	*	.	H	α-helix	trans	-58.4	-44.5	178.9	-73.4	172.1	0	0	0	112	Q377 G385	Q377-L381 HydrophobicContact CG-CD1 4.03Å; Q377-L381 WeakPolarHBondContact O-CB 3.44Å; Q377-L381 VanDerWaalsContact O-CG 3.31Å; Q377-L381 WeakPolarHBondContact O-CG 3.32Å; Q377-L381 PolarHBondContact O-N 3.03Å; L381-G385 PolarHBondContact O-N 2.8Å
382	R	91.4	Very high	92.6	Very high	76 Å²	76	54.6 Å²	54.6	29%	0.287	25%	0.249	S	C	.	.	H	α-helix	trans	-67.2	-45.5	178.6	-175.2	-179.8	60.6	-175.5	-3.1	111.5	E251 R378 F379 T380 G385 E386	E251-R382 IonicContact OE1-CZ 3.9Å; E251-R382 IonicContact OE1-NH1 3.96Å; E251-R382 PolarHBondContact OE1-NH1 3.13Å; E251-R382 IonicContact OE1-NH2 3.95Å; E251-R382 PolarHBondContact OE1-NH2 3.18Å; E251-R382 IonicContact OE2-NH1 3.9Å; E251-R382 PolarHBondContact OE2-NH1 3.18Å; R378-R382 VanDerWaalsContact O-CB 3.29Å; R378-R382 WeakPolarHBondContact O-CB 3.42Å; R378-R382 PolarHBondContact O-N 2.98Å; R378-R382 VanDerWaalsContact O-N 3.15Å; F379-R382 PolarHBondContact O-N 3.45Å; T380-R382 VanDerWaalsContact C-N 3.33Å; T380-R382 PolarHBondContact O-N 3.03Å; R382-G385 PolarHBondContact O-N 3.19Å; R382-E386 WeakPolarHBondContact O-CG 3.45Å; R382-E386 PolarHBondContact O-N 3.29Å
383	S	92.9	Very high	92.3	Very high	3 Å²	3	53 Å²	53	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-46.6	-179.6	-177.7	0	0	0	0	111.3	Q295 F379 T380 G385 E386 K387	Q295-S383 PolarHBondContact OE1-OG 3.34Å; F379-S383 WeakPolarHBondContact O-CB 3.47Å; F379-S383 PolarHBondContact O-N 2.99Å; T380-S383 PolarHBondContact O-N 3.21Å; S383-G385 PolarHBondContact O-N 3.25Å; S383-E386 PolarHBondContact O-N 3.16Å; S383-K387 WeakPolarHBondContact O-CG 3.47Å; S383-K387 PolarHBondContact O-N 3.05Å; S383-K387 WeakPolarHBondContact OG-CE 3.47Å
384	L	93.3	Very high	92	Very high	39 Å²	39	53.8 Å²	53.8	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-42.1	175.4	-66.5	175.8	0	0	0	112.1	T380 E386 K387 R388 W407 P409 L412	T380-L384 HydrophobicContact CG2-CD1 3.97Å; T380-L384 HydrophobicContact CG2-CG 4.41Å; T380-L384 WeakPolarHBondContact O-CB 3.44Å; T380-L384 VanDerWaalsContact O-CG 3.31Å; T380-L384 WeakPolarHBondContact O-CG 3.28Å; T380-L384 PolarHBondContact O-N 3.45Å; L384-E386 VanDerWaalsContact C-N 3.34Å; L384-E386 PolarHBondContact O-N 2.86Å; L384-K387 PolarHBondContact O-N 2.61Å; L384-R388 WeakPolarHBondContact O-CB 3.24Å; L384-R388 PolarHBondContact O-N 3.31Å; L384-W407 HydrophobicContact CD2-CE3 4.48Å; L384-W407 HydrophobicContact CD2-CZ3 3.78Å; L384-W407 HydrophobicContact CG-CZ3 4.07Å; L384-P409 VanDerWaalsContact CD2-CD 3.46Å; L384-P409 HydrophobicContact CD2-CG 4.26Å; L384-L412 HydrophobicContact CB-CD1 4Å; L384-L412 HydrophobicContact CD2-CD1 3.97Å; L384-L412 WeakPolarHBondContact O-CD1 3.06Å
385	G	87.7	Confident	91.7	Very high	30 Å²	30	51.8 Å²	51.8	31%	0.309	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-35.9	176.6	0	0	0	0	0	113.9	L381 R382 S383 Q389	L381-G385 PolarHBondContact O-N 2.8Å; R382-G385 PolarHBondContact O-N 3.19Å; S383-G385 PolarHBondContact O-N 3.25Å; G385-Q389 PolarHBondContact O-NE2 3.41Å
386	E	90.9	Very high	91.4	Very high	10 Å²	10	55 Å²	55	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-71.6	-45.1	174.7	-70.6	-177.1	159	0	0	111.5	R254 L291 R294 Q295 R382 S383 L384 R388 Q389 L390	R254-E386 IonicContact CZ-OE1 2.81Å; R254-E386 IonicContact CZ-OE2 3.4Å; R254-E386 IonicContact NH1-OE1 3.5Å; R254-E386 IonicContact NH1-OE2 3.43Å; R254-E386 PolarHBondContact NH1-OE2 3.11Å; R254-E386 VanDerWaalsContact NH2-CD 3.27Å; R254-E386 IonicContact NH2-OE1 3.42Å; R254-E386 PolarHBondContact NH2-OE1 3.43Å; R254-E386 IonicContact NH2-OE2 2.75Å; R254-E386 PolarHBondContact NH2-OE2 2.93Å; R254-E386 VanDerWaalsContact NH2-OE2 3.11Å; L291-E386 HydrophobicContact CD2-CB 4.01Å; L291-E386 HydrophobicContact CD2-CG 3.64Å; R294-E386 IonicContact NH1-OE1 3.5Å; R294-E386 PolarHBondContact NH1-OE1 3.11Å; Q295-E386 PolarHBondContact NE2-OE2 3.47Å; R382-E386 WeakPolarHBondContact O-CG 3.45Å; R382-E386 PolarHBondContact O-N 3.29Å; S383-E386 PolarHBondContact O-N 3.16Å; L384-E386 VanDerWaalsContact C-N 3.34Å; L384-E386 PolarHBondContact O-N 2.86Å; E386-R388 VanDerWaalsContact C-N 3.29Å; E386-R388 PolarHBondContact O-N 2.8Å; E386-Q389 WeakPolarHBondContact O-CB 3.4Å; E386-Q389 PolarHBondContact O-N 2.85Å; E386-Q389 VanDerWaalsContact O-N 3.14Å; E386-L390 PolarHBondContact O-N 3.21Å; E386-L390 VanDerWaalsContact O-N 3.08Å
387	K	92.8	Very high	90.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-39.6	175.7	-72.3	174.5	-175.3	172.5	0	112	S383 L384 Q389 L390 Y391 F401 D403 D405 T408 L412	S383-K387 WeakPolarHBondContact O-CG 3.47Å; S383-K387 PolarHBondContact O-N 3.05Å; S383-K387 WeakPolarHBondContact OG-CE 3.47Å; L384-K387 PolarHBondContact O-N 2.61Å; K387-Q389 VanDerWaalsContact C-N 3.25Å; K387-Q389 PolarHBondContact O-N 3.46Å; K387-L390 PolarHBondContact O-N 3.42Å; K387-Y391 HydrophobicContact CB-CD2 4.24Å; K387-Y391 HydrophobicContact CB-CE2 4.15Å; K387-Y391 WeakPolarHBondContact O-CD2 3.27Å; K387-Y391 PolarHBondContact O-N 2.83Å; K387-F401 HydrophobicContact CG-CE1 4.31Å; K387-F401 HydrophobicContact CG-CZ 4.18Å; K387-D403 VanDerWaalsContact CE-OD1 3.26Å; K387-D403 WeakPolarHBondContact CE-OD1 3.4Å; K387-D403 IonicContact NZ-OD1 2.62Å; K387-D403 PolarHBondContact NZ-OD1 3.23Å; K387-D405 WeakPolarHBondContact CE-OD2 3.48Å; K387-D405 IonicContact NZ-OD2 3.45Å; K387-D405 PolarHBondContact NZ-OD2 3.48Å; K387-T408 HydrophobicContact CD-CG2 4.07Å; K387-T408 WeakPolarHBondContact CD-OG1 3.39Å; K387-T408 WeakPolarHBondContact CE-OG1 3.47Å; K387-T408 PolarHBondContact NZ-OG1 2.69Å; K387-L412 HydrophobicContact CB-CD2 4Å
388	R	91.9	Very high	90.2	Very high	178 Å²	178	59 Å²	59	67%	0.672	29%	0.29	S	S	*	.	H	α-helix	trans	-56.8	-41.4	176.5	-166	-180	-149.7	174.2	7.4	112	L384 E386 Y392 L412	L384-R388 WeakPolarHBondContact O-CB 3.24Å; L384-R388 PolarHBondContact O-N 3.31Å; E386-R388 VanDerWaalsContact C-N 3.29Å; E386-R388 PolarHBondContact O-N 2.8Å; R388-Y392 WeakPolarHBondContact O-CB 3.37Å; R388-Y392 PolarHBondContact O-N 3.42Å; R388-Y392 VanDerWaalsContact O-N 3.11Å; R388-L412 HydrophobicContact CB-CD1 4.38Å; R388-L412 HydrophobicContact CB-CD2 4.42Å; R388-L412 HydrophobicContact CB-CG 4.41Å
389	Q	89.7	Confident	89.9	Confident	86 Å²	86	54.2 Å²	54.2	40%	0.402	28%	0.276	S	S	.	.	H	α-helix	trans	-68.6	-38.4	176	-70.4	167.5	69.6	0	0	111.8	L291 G385 E386 K387 Y392 A393	L291-Q389 HydrophobicContact CD1-CB 3.81Å; G385-Q389 PolarHBondContact O-NE2 3.41Å; E386-Q389 WeakPolarHBondContact O-CB 3.4Å; E386-Q389 PolarHBondContact O-N 2.85Å; E386-Q389 VanDerWaalsContact O-N 3.14Å; K387-Q389 VanDerWaalsContact C-N 3.25Å; K387-Q389 PolarHBondContact O-N 3.46Å; Q389-Y392 PolarHBondContact O-N 2.9Å; Q389-A393 WeakPolarHBondContact O-CB 3.3Å; Q389-A393 PolarHBondContact O-N 3.02Å
390	L	90.7	Very high	89.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-44.4	178.5	-70.1	171.3	0	0	0	112.5	I288 L291 Q292 Q295 E386 K387 Y392 A393 M394 F401	I288-L390 HydrophobicContact CG2-CD2 4.09Å; L291-L390 HydrophobicContact CB-CD1 4.11Å; L291-L390 HydrophobicContact CB-CD2 3.68Å; L291-L390 HydrophobicContact CB-CG 3.96Å; L291-L390 HydrophobicContact CD1-CD2 4.47Å; L291-L390 HydrophobicContact CD1-CG 4.46Å; Q292-L390 HydrophobicContact CG-CD2 3.67Å; Q295-L390 HydrophobicContact CB-CD1 4.41Å; Q295-L390 HydrophobicContact CG-CD1 3.67Å; E386-L390 PolarHBondContact O-N 3.21Å; E386-L390 VanDerWaalsContact O-N 3.08Å; K387-L390 PolarHBondContact O-N 3.42Å; L390-Y392 VanDerWaalsContact C-N 3.32Å; L390-Y392 PolarHBondContact O-N 2.97Å; L390-A393 CarbonylContact O-C 3.49Å; L390-A393 WeakPolarHBondContact O-CB 3.36Å; L390-A393 PolarHBondContact O-N 3.13Å; L390-A393 VanDerWaalsContact O-N 3.13Å; L390-M394 WeakPolarHBondContact O-CG 3.3Å; L390-M394 PolarHBondContact O-N 3.07Å; L390-F401 HydrophobicContact CB-CB 4.38Å; L390-F401 HydrophobicContact CB-CD1 3.8Å; L390-F401 HydrophobicContact CB-CD2 4.42Å; L390-F401 HydrophobicContact CB-CE1 4.15Å; L390-F401 HydrophobicContact CB-CG 3.94Å; L390-F401 HydrophobicContact CD1-CD1 4.3Å; L390-F401 HydrophobicContact CD1-CD2 3.72Å; L390-F401 HydrophobicContact CD1-CE1 4.13Å; L390-F401 HydrophobicContact CD1-CE2 3.54Å; L390-F401 HydrophobicContact CD1-CG 4.1Å; L390-F401 HydrophobicContact CD1-CZ 3.75Å
391	Y	90.6	Very high	89	Confident	6 Å²	6	58.6 Å²	58.6	2%	0.024	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-37	175.2	-75.2	-64.8	0	0	0	112.2	K387 A393 M394 E395 F401 D403 T408 L412 I413 L417 L421	K387-Y391 HydrophobicContact CB-CD2 4.24Å; K387-Y391 HydrophobicContact CB-CE2 4.15Å; K387-Y391 WeakPolarHBondContact O-CD2 3.27Å; K387-Y391 PolarHBondContact O-N 2.83Å; Y391-A393 VanDerWaalsContact C-N 3.31Å; Y391-A393 PolarHBondContact O-N 3.41Å; Y391-M394 HydrophobicContact CD1-SD 3.81Å; Y391-M394 HydrophobicContact CE1-SD 4.13Å; Y391-M394 WeakPolarHBondContact O-CB 3.22Å; Y391-M394 PolarHBondContact O-N 3.15Å; Y391-E395 PolarHBondContact O-N 2.84Å; Y391-F401 HydrophobicContact CE1-CD1 4.27Å; Y391-F401 HydrophobicContact CE2-CD1 4.49Å; Y391-F401 HydrophobicContact CE2-CE1 4.05Å; Y391-D403 VanDerWaalsContact OH-CB 3.27Å; Y391-D403 WeakPolarHBondContact OH-CB 3.41Å; Y391-D403 PolarHBondContact OH-OD2 2.76Å; Y391-T408 HydrophobicContact CE2-CG2 4.16Å; Y391-L412 HydrophobicContact CD2-CD2 3.46Å; Y391-L412 VanDerWaalsContact CD2-CD2 3.46Å; Y391-L412 HydrophobicContact CE2-CD2 3.8Å; Y391-I413 HydrophobicContact CD1-CG2 4.17Å; Y391-I413 HydrophobicContact CD2-CG1 4.46Å; Y391-I413 HydrophobicContact CE1-CD1 4.42Å; Y391-I413 HydrophobicContact CE1-CG1 4.1Å; Y391-I413 HydrophobicContact CE1-CG2 4.03Å; Y391-I413 HydrophobicContact CE2-CG1 3.95Å; Y391-L417 HydrophobicContact CD1-CD1 4.32Å; Y391-L421 HydrophobicContact CE1-CD1 3.93Å
392	Y	89.9	Confident	88.7	Confident	141 Å²	141	60.6 Å²	60.6	55%	0.553	31%	0.311	S	S	*	.	H	α-helix	trans	-59.6	-43.2	170.5	-178.8	-87.2	0	0	0	111.6	R388 Q389 L390 E395 H396	R388-Y392 WeakPolarHBondContact O-CB 3.37Å; R388-Y392 PolarHBondContact O-N 3.42Å; R388-Y392 VanDerWaalsContact O-N 3.11Å; Q389-Y392 PolarHBondContact O-N 2.9Å; L390-Y392 VanDerWaalsContact C-N 3.32Å; L390-Y392 PolarHBondContact O-N 2.97Å; Y392-E395 PolarHBondContact O-N 2.95Å; Y392-H396 AromaticContact CD2-CD2 3.51Å; Y392-H396 AromaticContact CD2-NE2 3.96Å; Y392-H396 HydrophobicContact CE1-CB 4.48Å; Y392-H396 AromaticContact CE1-CD2 4Å; Y392-H396 AromaticContact CE2-CD2 3.29Å; Y392-H396 WeakPolarHBondContact CE2-CD2 3.42Å; Y392-H396 AromaticContact CE2-NE2 3.68Å; Y392-H396 AromaticContact CG-CD2 3.95Å; Y392-H396 AromaticContact CZ-CD2 3.55Å; Y392-H396 PolarHBondContact O-CD2 2.78Å; Y392-H396 PolarHBondContact O-N 2.87Å
393	A	88.7	Confident	88.5	Confident	2 Å²	2	58.2 Å²	58.2	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-31.8	176.2	0	0	0	0	0	113.2	I288 Q389 L390 Y391 L397 G398 T399	I288-A393 HydrophobicContact CD1-CB 3.63Å; I288-A393 HydrophobicContact CG1-CB 3.79Å; Q389-A393 WeakPolarHBondContact O-CB 3.3Å; Q389-A393 PolarHBondContact O-N 3.02Å; L390-A393 CarbonylContact O-C 3.49Å; L390-A393 WeakPolarHBondContact O-CB 3.36Å; L390-A393 PolarHBondContact O-N 3.13Å; L390-A393 VanDerWaalsContact O-N 3.13Å; Y391-A393 VanDerWaalsContact C-N 3.31Å; Y391-A393 PolarHBondContact O-N 3.41Å; A393-L397 HydrophobicContact CB-CB 4.47Å; A393-L397 HydrophobicContact CB-CD1 4.04Å; A393-L397 CarbonylContact O-C 3.56Å; A393-L397 VanDerWaalsContact O-CA 3.32Å; A393-L397 WeakPolarHBondContact O-CA 3.5Å; A393-L397 VanDerWaalsContact O-CB 3.28Å; A393-L397 WeakPolarHBondContact O-CB 3.45Å; A393-L397 PolarHBondContact O-N 3.36Å; A393-G398 PolarHBondContact O-N 2.82Å; A393-T399 WeakPolarHBondContact CB-OG1 3.34Å; A393-T399 PolarHBondContact O-N 2.96Å; A393-T399 PolarHBondContact O-OG1 3.31Å
394	M	88.9	Confident	88.2	Confident	34 Å²	34	60.4 Å²	60.4	17%	0.167	32%	0.318	C	S	.	.	H	α-helix	trans	-65.4	-45.4	172.5	-71.3	-178.3	78.6	0	0	111.1	L390 Y391 T399 F401 L417	L390-M394 WeakPolarHBondContact O-CG 3.3Å; L390-M394 PolarHBondContact O-N 3.07Å; Y391-M394 HydrophobicContact CD1-SD 3.81Å; Y391-M394 HydrophobicContact CE1-SD 4.13Å; Y391-M394 WeakPolarHBondContact O-CB 3.22Å; Y391-M394 PolarHBondContact O-N 3.15Å; M394-T399 WeakPolarHBondContact CA-O 3.41Å; M394-T399 WeakPolarHBondContact CG-O 3.23Å; M394-T399 PolarHBondContact N-OG1 3.08Å; M394-F401 HydrophobicContact CG-CB 3.89Å; M394-F401 HydrophobicContact SD-CB 3.65Å; M394-F401 HydrophobicContact SD-CD1 4.22Å; M394-F401 HydrophobicContact SD-CG 4.45Å; M394-L417 HydrophobicContact CB-CD1 3.74Å; M394-L417 HydrophobicContact SD-CD1 4.38Å
395	E	88.5	Confident	88	Confident	85 Å²	85	59.3 Å²	59.3	40%	0.397	31%	0.312	S	S	.	.	H	α-helix	trans	-68.8	-40.7	-176.7	-174	172.6	-158.6	0	0	112.5	Y391 Y392 P414 L417	Y391-E395 PolarHBondContact O-N 2.84Å; Y392-E395 PolarHBondContact O-N 2.95Å; E395-P414 HydrophobicContact CB-CG 4.49Å; E395-P414 VanDerWaalsContact OE2-CB 3.27Å; E395-P414 WeakPolarHBondContact OE2-CB 3.32Å; E395-P414 VanDerWaalsContact OE2-CG 3.26Å; E395-P414 WeakPolarHBondContact OE2-CG 3.46Å; E395-L417 HydrophobicContact CB-CD1 4.27Å
396	H	87.4	Confident	87.8	Confident	104 Å²	104	62 Å²	62	48%	0.481	33%	0.325	S	S	.	.	H	α-helix	trans	-113	-20	-168.6	-60.8	-57.1	0	0	0	115.4	Y392	Y392-H396 AromaticContact CD2-CD2 3.51Å; Y392-H396 AromaticContact CD2-NE2 3.96Å; Y392-H396 HydrophobicContact CE1-CB 4.48Å; Y392-H396 AromaticContact CE1-CD2 4Å; Y392-H396 AromaticContact CE2-CD2 3.29Å; Y392-H396 WeakPolarHBondContact CE2-CD2 3.42Å; Y392-H396 AromaticContact CE2-NE2 3.68Å; Y392-H396 AromaticContact CG-CD2 3.95Å; Y392-H396 AromaticContact CZ-CD2 3.55Å; Y392-H396 PolarHBondContact O-CD2 2.78Å; Y392-H396 PolarHBondContact O-N 2.87Å
397	L	86.2	Confident	87.8	Confident	95 Å²	95	62.2 Å²	62.2	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-116.5	7.4	-173.3	-53.8	175.6	0	0	0	113.1	I288 A393 T399	I288-L397 HydrophobicContact CD1-CD1 3.7Å; A393-L397 HydrophobicContact CB-CB 4.47Å; A393-L397 HydrophobicContact CB-CD1 4.04Å; A393-L397 CarbonylContact O-C 3.56Å; A393-L397 VanDerWaalsContact O-CA 3.32Å; A393-L397 WeakPolarHBondContact O-CA 3.5Å; A393-L397 VanDerWaalsContact O-CB 3.28Å; A393-L397 WeakPolarHBondContact O-CB 3.45Å; A393-L397 PolarHBondContact O-N 3.36Å; L397-T399 VanDerWaalsContact C-N 3.26Å; L397-T399 HydrophobicContact CB-CG2 4.3Å; L397-T399 PolarHBondContact O-N 3.49Å
398	G	81.7	Confident	87.7	Confident	75 Å²	75	62.9 Å²	62.9	77%	0.773	33%	0.329	S	S	*	.			trans	66.6	24.7	175.3	0	0	0	0	0	114.3	A393	A393-G398 PolarHBondContact O-N 2.82Å
399	T	84	Confident	87.6	Confident	40 Å²	40	57.3 Å²	57.3	25%	0.245	32%	0.316	C	S	.	.			trans	-90.4	158	-179.3	64.4	0	0	0	0	112.3	I288 A393 M394 L397	I288-T399 HydrophobicContact CD1-CG2 4.08Å; I288-T399 HydrophobicContact CG2-CG2 4.17Å; A393-T399 WeakPolarHBondContact CB-OG1 3.34Å; A393-T399 PolarHBondContact O-N 2.96Å; A393-T399 PolarHBondContact O-OG1 3.31Å; M394-T399 WeakPolarHBondContact CA-O 3.41Å; M394-T399 WeakPolarHBondContact CG-O 3.23Å; M394-T399 PolarHBondContact N-OG1 3.08Å; L397-T399 VanDerWaalsContact C-N 3.26Å; L397-T399 HydrophobicContact CB-CG2 4.3Å; L397-T399 PolarHBondContact O-N 3.49Å
400	S	84	Confident	87.5	Confident	98 Å²	98	56.2 Å²	56.2	69%	0.685	32%	0.321	S	S	*	.			trans	-104.6	132.1	173.1	178	0	0	0	0	110.4	Q292	Q292-S400 PolarHBondContact NE2-O 3.46Å
401	F	87	Confident	87.3	Confident	11 Å²	11	60.4 Å²	60.4	5%	0.048	36%	0.356	C	S	.	.			trans	-136.2	126.3	172.5	166.4	-117	0	0	0	110	Q292 Q295 K387 L390 Y391 M394 D403	Q292-F401 HydrophobicContact CG-CD2 4.4Å; Q295-F401 HydrophobicContact CB-CE2 3.91Å; Q295-F401 HydrophobicContact CB-CZ 4.29Å; Q295-F401 HydrophobicContact CG-CE2 4.25Å; Q295-F401 HydrophobicContact CG-CZ 4.31Å; K387-F401 HydrophobicContact CG-CE1 4.31Å; K387-F401 HydrophobicContact CG-CZ 4.18Å; L390-F401 HydrophobicContact CB-CB 4.38Å; L390-F401 HydrophobicContact CB-CD1 3.8Å; L390-F401 HydrophobicContact CB-CD2 4.42Å; L390-F401 HydrophobicContact CB-CE1 4.15Å; L390-F401 HydrophobicContact CB-CG 3.94Å; L390-F401 HydrophobicContact CD1-CD1 4.3Å; L390-F401 HydrophobicContact CD1-CD2 3.72Å; L390-F401 HydrophobicContact CD1-CE1 4.13Å; L390-F401 HydrophobicContact CD1-CE2 3.54Å; L390-F401 HydrophobicContact CD1-CG 4.1Å; L390-F401 HydrophobicContact CD1-CZ 3.75Å; Y391-F401 HydrophobicContact CE1-CD1 4.27Å; Y391-F401 HydrophobicContact CE2-CD1 4.49Å; Y391-F401 HydrophobicContact CE2-CE1 4.05Å; M394-F401 HydrophobicContact CG-CB 3.89Å; M394-F401 HydrophobicContact SD-CB 3.65Å; M394-F401 HydrophobicContact SD-CD1 4.22Å; M394-F401 HydrophobicContact SD-CG 4.45Å; F401-D403 HydrophobicContact CE1-CB 3.92Å; F401-D403 HydrophobicContact CZ-CB 4.11Å
402	K	84.8	Confident	87.2	Confident	159 Å²	159	61.9 Å²	61.9	69%	0.691	36%	0.364	S	S	*	.			trans	-100.6	107.3	173.4	-175	177.5	-179	178.1	0	108.2	P404	K402-P404 WeakPolarHBondContact O-CD 3.24Å
403	D	88.1	Confident	87.1	Confident	26 Å²	26	56.4 Å²	56.4	14%	0.139	34%	0.344	C	S	.	.			trans	-66.2	119.1	176.8	-160.3	-21	0	0	0	110	K387 Y391 F401 D405 T408	K387-D403 VanDerWaalsContact CE-OD1 3.26Å; K387-D403 WeakPolarHBondContact CE-OD1 3.4Å; K387-D403 IonicContact NZ-OD1 2.62Å; K387-D403 PolarHBondContact NZ-OD1 3.23Å; Y391-D403 VanDerWaalsContact OH-CB 3.27Å; Y391-D403 WeakPolarHBondContact OH-CB 3.41Å; Y391-D403 PolarHBondContact OH-OD2 2.76Å; F401-D403 HydrophobicContact CE1-CB 3.92Å; F401-D403 HydrophobicContact CZ-CB 4.11Å; D403-D405 VanDerWaalsContact C-N 3.26Å; D403-D405 PolarHBondContact OD1-N 2.99Å; D403-D405 VanDerWaalsContact OD1-N 3.11Å; D403-T408 PolarHBondContact OD1-OG1 3.27Å; D403-T408 WeakPolarHBondContact OD2-CB 3.44Å; D403-T408 WeakPolarHBondContact OD2-CG2 3.28Å; D403-T408 PolarHBondContact OD2-OG1 3.42Å
404	P	86.1	Confident	87	Confident	49 Å²	49	57.4 Å²	57.4	32%	0.318	35%	0.351	S	S	.	.			trans	-77.1	-13.8	178.6	31.8	-35.3	0	0	0	112.9	Q295 K402	Q295-P404 WeakPolarHBondContact O-CG 3.29Å; K402-P404 WeakPolarHBondContact O-CD 3.24Å
405	D	88.3	Confident	86.8	Confident	16 Å²	16	62.9 Å²	62.9	9%	0.086	38%	0.376	C	S	.	.			trans	-110.6	120.2	-168.7	-74.4	-50.1	0	0	0	111.7	V298 K387 D403 W407 T408	V298-D405 WeakPolarHBondContact CG1-OD1 3.33Å; K387-D405 WeakPolarHBondContact CE-OD2 3.48Å; K387-D405 IonicContact NZ-OD2 3.45Å; K387-D405 PolarHBondContact NZ-OD2 3.48Å; D403-D405 VanDerWaalsContact C-N 3.26Å; D403-D405 PolarHBondContact OD1-N 2.99Å; D403-D405 VanDerWaalsContact OD1-N 3.11Å; D405-W407 VanDerWaalsContact C-N 3.25Å; D405-W407 HydrophobicContact CB-CD2 4.13Å; D405-W407 HydrophobicContact CB-CG 4.27Å; D405-W407 HydrophobicContact CB-CZ2 3.98Å; D405-W407 VanDerWaalsContact CB-NE1 3.31Å; D405-W407 VanDerWaalsContact CG-CZ2 3.45Å; D405-W407 PolarHBondContact O-N 2.81Å; D405-W407 PolarHBondContact OD1-NE1 3.27Å; D405-W407 VanDerWaalsContact OD2-CZ2 3.24Å; D405-W407 WeakPolarHBondContact OD2-CZ2 3.28Å; D405-T408 PolarHBondContact O-OG1 2.91Å
406	P	84.5	Confident	86.5	Confident	88 Å²	88	62 Å²	62	57%	0.571	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.9	176.5	25	-29.8	0	0	0	113.5	Y346 T408	Y346-P406 WeakPolarHBondContact OH-CG 3.46Å; P406-T408 VanDerWaalsContact C-N 3.28Å; P406-T408 PolarHBondContact O-N 3.48Å
407	W	90.3	Very high	86.3	Confident	13 Å²	13	58.1 Å²	58.1	5%	0.049	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.5	-179.1	55.8	-95.6	0	0	0	114.4	F345 Y346 F379 T380 L384 D405 P409	F345-W407 HydrophobicContact CB-CB 4.13Å; F345-W407 HydrophobicContact CB-CG 4.23Å; F345-W407 AromaticContact CD1-CD1 3.92Å; F345-W407 AromaticContact CD1-CD2 3.53Å; F345-W407 HydrophobicContact CD1-CD2 3.53Å; F345-W407 AromaticContact CD1-CE2 3.58Å; F345-W407 AromaticContact CD1-CE3 3.95Å; F345-W407 HydrophobicContact CD1-CE3 3.95Å; F345-W407 AromaticContact CD1-CG 3.78Å; F345-W407 HydrophobicContact CD1-CG 3.78Å; F345-W407 HydrophobicContact CD1-CH2 4.46Å; F345-W407 HydrophobicContact CD1-CZ2 4.09Å; F345-W407 HydrophobicContact CD1-CZ3 4.39Å; F345-W407 AromaticContact CD1-NE1 3.82Å; F345-W407 HydrophobicContact CE1-CD2 4.23Å; F345-W407 AromaticContact CE1-CE2 3.83Å; F345-W407 HydrophobicContact CE1-CH2 4.36Å; F345-W407 AromaticContact CE1-CZ2 3.93Å; F345-W407 HydrophobicContact CE1-CZ2 3.93Å; Y346-W407 HydrophobicContact CD1-CB 4.25Å; Y346-W407 HydrophobicContact CE1-CB 3.63Å; Y346-W407 HydrophobicContact CE2-CB 4.16Å; F379-W407 HydrophobicContact CE1-CH2 4.3Å; F379-W407 AromaticContact CE1-CZ2 3.94Å; F379-W407 HydrophobicContact CE1-CZ2 3.94Å; T380-W407 HydrophobicContact CG2-CH2 4.49Å; T380-W407 HydrophobicContact CG2-CZ3 4.01Å; L384-W407 HydrophobicContact CD2-CE3 4.48Å; L384-W407 HydrophobicContact CD2-CZ3 3.78Å; L384-W407 HydrophobicContact CG-CZ3 4.07Å; D405-W407 VanDerWaalsContact C-N 3.25Å; D405-W407 HydrophobicContact CB-CD2 4.13Å; D405-W407 HydrophobicContact CB-CG 4.27Å; D405-W407 HydrophobicContact CB-CZ2 3.98Å; D405-W407 VanDerWaalsContact CB-NE1 3.31Å; D405-W407 VanDerWaalsContact CG-CZ2 3.45Å; D405-W407 PolarHBondContact O-N 2.81Å; D405-W407 PolarHBondContact OD1-NE1 3.27Å; D405-W407 VanDerWaalsContact OD2-CZ2 3.24Å; D405-W407 WeakPolarHBondContact OD2-CZ2 3.28Å; W407-P409 VanDerWaalsContact O-CD 3.28Å; W407-P409 WeakPolarHBondContact O-CD 3.48Å
408	T	90.9	Very high	86.2	Confident	15 Å²	15	57.5 Å²	57.5	9%	0.092	36%	0.357	C	S	.	.	S	Bend	trans	-61.2	120.9	175.9	-61.9	0	0	0	0	110.2	K387 Y391 D403 D405 P406 A410 L412 I413	K387-T408 HydrophobicContact CD-CG2 4.07Å; K387-T408 WeakPolarHBondContact CD-OG1 3.39Å; K387-T408 WeakPolarHBondContact CE-OG1 3.47Å; K387-T408 PolarHBondContact NZ-OG1 2.69Å; Y391-T408 HydrophobicContact CE2-CG2 4.16Å; D403-T408 PolarHBondContact OD1-OG1 3.27Å; D403-T408 WeakPolarHBondContact OD2-CB 3.44Å; D403-T408 WeakPolarHBondContact OD2-CG2 3.28Å; D403-T408 PolarHBondContact OD2-OG1 3.42Å; D405-T408 PolarHBondContact O-OG1 2.91Å; P406-T408 VanDerWaalsContact C-N 3.28Å; P406-T408 PolarHBondContact O-N 3.48Å; T408-A410 PolarHBondContact O-N 3.34Å; T408-L412 HydrophobicContact CG2-CD2 4.21Å; T408-I413 HydrophobicContact CG2-CG1 4.45Å
409	P	90.3	Very high	85.8	Confident	60 Å²	60	59.6 Å²	59.6	39%	0.39	35%	0.347	S	S	.	.			trans	-60.8	129.8	-179.1	-24.4	34.5	0	0	0	111.5	L384 W407 A411 L412	L384-P409 VanDerWaalsContact CD2-CD 3.46Å; L384-P409 HydrophobicContact CD2-CG 4.26Å; W407-P409 VanDerWaalsContact O-CD 3.28Å; W407-P409 WeakPolarHBondContact O-CD 3.48Å; P409-A411 PolarHBondContact O-N 3.44Å; P409-A411 VanDerWaalsContact O-N 3.08Å; P409-L412 VanDerWaalsContact O-CB 3.28Å; P409-L412 WeakPolarHBondContact O-CB 3.39Å; P409-L412 PolarHBondContact O-N 3.23Å
410	A	86.6	Confident	85.3	Confident	63 Å²	63	64.4 Å²	64.4	52%	0.521	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-55.1	-32.9	179.3	0	0	0	0	0	112.6	T408 L412 I413 R418	T408-A410 PolarHBondContact O-N 3.34Å; A410-L412 PolarHBondContact O-N 3.04Å; A410-L412 VanDerWaalsContact O-N 3.16Å; A410-I413 WeakPolarHBondContact O-CB 3.43Å; A410-I413 PolarHBondContact O-N 3.12Å; A410-R418 VanDerWaalsContact O-CZ 3.23Å; A410-R418 PolarHBondContact O-NE 3.09Å; A410-R418 PolarHBondContact O-NH2 3.05Å; A410-R418 VanDerWaalsContact O-NH2 3.07Å
411	A	86.8	Confident	84.6	Confident	89 Å²	89	61.6 Å²	61.6	74%	0.736	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-58.8	-24.4	176	0	0	0	0	0	114.1	P409	P409-A411 PolarHBondContact O-N 3.44Å; P409-A411 VanDerWaalsContact O-N 3.08Å
412	L	88.1	Confident	83.6	Confident	37 Å²	37	67.8 Å²	67.8	19%	0.194	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-79.2	-25.5	177.5	-171.8	146	0	0	0	112.3	L384 K387 R388 Y391 T408 P409 A410	L384-L412 HydrophobicContact CB-CD1 4Å; L384-L412 HydrophobicContact CD2-CD1 3.97Å; L384-L412 WeakPolarHBondContact O-CD1 3.06Å; K387-L412 HydrophobicContact CB-CD2 4Å; R388-L412 HydrophobicContact CB-CD1 4.38Å; R388-L412 HydrophobicContact CB-CD2 4.42Å; R388-L412 HydrophobicContact CB-CG 4.41Å; Y391-L412 HydrophobicContact CD2-CD2 3.46Å; Y391-L412 VanDerWaalsContact CD2-CD2 3.46Å; Y391-L412 HydrophobicContact CE2-CD2 3.8Å; T408-L412 HydrophobicContact CG2-CD2 4.21Å; P409-L412 VanDerWaalsContact O-CB 3.28Å; P409-L412 WeakPolarHBondContact O-CB 3.39Å; P409-L412 PolarHBondContact O-N 3.23Å; A410-L412 PolarHBondContact O-N 3.04Å; A410-L412 VanDerWaalsContact O-N 3.16Å
413	I	87.4	Confident	82.5	Confident	25 Å²	25	65.3 Å²	65.3	13%	0.128	36%	0.355	C	S	.	.	S	Bend	trans	-82.2	126.5	179.9	-52.4	179.5	0	0	0	108.6	Y391 T408 A410 L417 R418 L421	Y391-I413 HydrophobicContact CD1-CG2 4.17Å; Y391-I413 HydrophobicContact CD2-CG1 4.46Å; Y391-I413 HydrophobicContact CE1-CD1 4.42Å; Y391-I413 HydrophobicContact CE1-CG1 4.1Å; Y391-I413 HydrophobicContact CE1-CG2 4.03Å; Y391-I413 HydrophobicContact CE2-CG1 3.95Å; T408-I413 HydrophobicContact CG2-CG1 4.45Å; A410-I413 WeakPolarHBondContact O-CB 3.43Å; A410-I413 PolarHBondContact O-N 3.12Å; I413-L417 HydrophobicContact CG2-CB 4.18Å; I413-R418 HydrophobicContact CB-CG 4.06Å; I413-R418 HydrophobicContact CG2-CG 3.85Å; I413-R418 VanDerWaalsContact O-CZ 3.29Å; I413-R418 PolarHBondContact O-NE 3.16Å; I413-R418 PolarHBondContact O-NH2 3.29Å; I413-L421 HydrophobicContact CG2-CD1 3.8Å
414	P	87.4	Confident	81	Confident	24 Å²	24	68.6 Å²	68.6	16%	0.156	37%	0.372	C	S	.	.			trans	-54.5	139	174	-26.3	34	0	0	0	112.1	E395 A416 L417 R418	E395-P414 HydrophobicContact CB-CG 4.49Å; E395-P414 VanDerWaalsContact OE2-CB 3.27Å; E395-P414 WeakPolarHBondContact OE2-CB 3.32Å; E395-P414 VanDerWaalsContact OE2-CG 3.26Å; E395-P414 WeakPolarHBondContact OE2-CG 3.46Å; P414-A416 PolarHBondContact O-N 3.06Å; P414-L417 HydrophobicContact CB-CD1 4.39Å; P414-L417 HydrophobicContact CB-CG 4.43Å; P414-L417 HydrophobicContact CG-CD1 4.16Å; P414-L417 PolarHBondContact O-N 3.21Å; P414-R418 PolarHBondContact O-N 3.07Å
415	E	83.9	Confident	79.5	Confident	149 Å²	149	71.8 Å²	71.8	70%	0.696	38%	0.383	S	S	*	.	H	α-helix	trans	-56.5	-39	-175.5	-69.1	-178.4	173.7	0	0	112.5	L417 R418	E415-L417 PolarHBondContact O-N 3.39Å; E415-L417 VanDerWaalsContact O-N 3.17Å; E415-R418 PolarHBondContact O-N 3.36Å
416	A	82.6	Confident	77.6	Confident	67 Å²	67	77.4 Å²	77.4	55%	0.554	41%	0.409	S	S	*	.	H	α-helix	trans	-61.9	-22.5	177.6	0	0	0	0	0	114.1	P414	P414-A416 PolarHBondContact O-N 3.06Å
417	L	84.2	Confident	75.8	Confident	21 Å²	21	80.1 Å²	80.1	11%	0.11	41%	0.412	C	S	.	.	H	α-helix	trans	-97.4	-21.1	179	-62.2	178.9	0	0	0	112.9	Y391 M394 E395 I413 P414 E415 E419 K420 L421	Y391-L417 HydrophobicContact CD1-CD1 4.32Å; M394-L417 HydrophobicContact CB-CD1 3.74Å; M394-L417 HydrophobicContact SD-CD1 4.38Å; E395-L417 HydrophobicContact CB-CD1 4.27Å; I413-L417 HydrophobicContact CG2-CB 4.18Å; P414-L417 HydrophobicContact CB-CD1 4.39Å; P414-L417 HydrophobicContact CB-CG 4.43Å; P414-L417 HydrophobicContact CG-CD1 4.16Å; P414-L417 PolarHBondContact O-N 3.21Å; E415-L417 PolarHBondContact O-N 3.39Å; E415-L417 VanDerWaalsContact O-N 3.17Å; L417-E419 PolarHBondContact O-N 2.85Å; L417-K420 PolarHBondContact O-N 3.36Å; L417-L421 HydrophobicContact CB-CD1 4.21Å; L417-L421 WeakPolarHBondContact O-CB 3.5Å; L417-L421 VanDerWaalsContact O-CG 3.27Å; L417-L421 WeakPolarHBondContact O-CG 3.41Å; L417-L421 PolarHBondContact O-N 2.89Å
418	R	83.4	Confident	73.4	Confident	82 Å²	82	86.2 Å²	86.2	31%	0.309	44%	0.435	S	S	.	.	H	α-helix	trans	-60.8	-47.1	-175.7	-70.5	-177.1	-167.5	153	10.8	112.7	A410 I413 P414 E415 L421 R422	A410-R418 VanDerWaalsContact O-CZ 3.23Å; A410-R418 PolarHBondContact O-NE 3.09Å; A410-R418 PolarHBondContact O-NH2 3.05Å; A410-R418 VanDerWaalsContact O-NH2 3.07Å; I413-R418 HydrophobicContact CB-CG 4.06Å; I413-R418 HydrophobicContact CG2-CG 3.85Å; I413-R418 VanDerWaalsContact O-CZ 3.29Å; I413-R418 PolarHBondContact O-NE 3.16Å; I413-R418 PolarHBondContact O-NH2 3.29Å; P414-R418 PolarHBondContact O-N 3.07Å; E415-R418 PolarHBondContact O-N 3.36Å; R418-L421 PolarHBondContact O-N 3.39Å; R418-R422 VanDerWaalsContact O-CB 3.27Å; R418-R422 WeakPolarHBondContact O-CB 3.39Å; R418-R422 PolarHBondContact O-N 3Å
419	E	73	Confident	70.9	Confident	120 Å²	120	89.3 Å²	89.3	56%	0.561	46%	0.455	S	S	*	.	H	α-helix	trans	-64.9	-44	-178.8	-65.2	-55.9	142.9	0	0	111.7	L417 L421 R422 E423	L417-E419 PolarHBondContact O-N 2.85Å; E419-L421 PolarHBondContact O-N 3.32Å; E419-R422 PolarHBondContact O-N 2.9Å; E419-E423 PolarHBondContact O-N 3.48Å
420	K	72.7	Confident	68.5	Low	140 Å²	140	90.4 Å²	90.4	61%	0.609	45%	0.452	S	S	*	.	H	α-helix	trans	-60.6	-45.3	176.2	-68.6	-176.7	177.8	180	0	112.1	L417 R422 E423 D424	L417-K420 PolarHBondContact O-N 3.36Å; K420-R422 VanDerWaalsContact C-N 3.31Å; K420-R422 PolarHBondContact O-N 3.45Å; K420-E423 PolarHBondContact O-N 3.33Å; K420-D424 PolarHBondContact O-N 2.93Å
421	L	69.5	Low	66.1	Low	39 Å²	39	95.1 Å²	95.1	20%	0.204	47%	0.468	C	S	.	.	H	α-helix	trans	-68.3	-32.8	178.7	-71.7	168.2	0	0	0	112.2	Y391 I413 L417 R418 E419 D424 Q425	Y391-L421 HydrophobicContact CE1-CD1 3.93Å; I413-L421 HydrophobicContact CG2-CD1 3.8Å; L417-L421 HydrophobicContact CB-CD1 4.21Å; L417-L421 WeakPolarHBondContact O-CB 3.5Å; L417-L421 VanDerWaalsContact O-CG 3.27Å; L417-L421 WeakPolarHBondContact O-CG 3.41Å; L417-L421 PolarHBondContact O-N 2.89Å; R418-L421 PolarHBondContact O-N 3.39Å; E419-L421 PolarHBondContact O-N 3.32Å; L421-D424 PolarHBondContact O-N 3.24Å; L421-Q425 WeakPolarHBondContact O-CB 3.32Å; L421-Q425 WeakPolarHBondContact O-CG 3.34Å; L421-Q425 PolarHBondContact O-N 2.98Å
422	R	67.2	Low	63.5	Low	142 Å²	142	99.5 Å²	99.5	54%	0.536	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-46.2	175.4	-174.1	179.5	179.1	161.6	4.1	111.2	R418 E419 K420 D424 Q425 E426	R418-R422 VanDerWaalsContact O-CB 3.27Å; R418-R422 WeakPolarHBondContact O-CB 3.39Å; R418-R422 PolarHBondContact O-N 3Å; E419-R422 PolarHBondContact O-N 2.9Å; K420-R422 VanDerWaalsContact C-N 3.31Å; K420-R422 PolarHBondContact O-N 3.45Å; R422-D424 VanDerWaalsContact C-N 3.3Å; R422-D424 PolarHBondContact O-N 2.79Å; R422-Q425 PolarHBondContact O-N 3.38Å; R422-E426 HydrophobicContact CG-CG 4.38Å; R422-E426 WeakPolarHBondContact CG-OE1 3.49Å; R422-E426 IonicContact CZ-OE1 3.44Å; R422-E426 IonicContact NE-OE1 3.83Å; R422-E426 PolarHBondContact NE-OE1 3.44Å; R422-E426 IonicContact NH2-OE1 3.75Å; R422-E426 WeakPolarHBondContact O-CB 3.48Å; R422-E426 WeakPolarHBondContact O-CG 3.39Å; R422-E426 PolarHBondContact O-N 2.04Å
423	E	60.7	Low	60.7	Low	106 Å²	106	106.2 Å²	106.2	50%	0.495	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-40.5	173.3	-72.6	-178.5	-176.8	0	0	111.9	E419 K420 K427	E419-E423 PolarHBondContact O-N 3.48Å; K420-E423 PolarHBondContact O-N 3.33Å; E423-K427 WeakPolarHBondContact O-CB 3.36Å; E423-K427 WeakPolarHBondContact O-CD 3.35Å; E423-K427 WeakPolarHBondContact O-CG 3.45Å; E423-K427 PolarHBondContact O-N 3.44Å
424	D	56.9	Low	58.1	Low	95 Å²	95	109.7 Å²	109.7	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-71.6	-27.9	177.5	-72.8	-15.3	0	0	0	113.1	K420 L421 R422	K420-D424 PolarHBondContact O-N 2.93Å; L421-D424 PolarHBondContact O-N 3.24Å; R422-D424 VanDerWaalsContact C-N 3.3Å; R422-D424 PolarHBondContact O-N 2.79Å
425	Q	53.9	Low	55.5	Low	116 Å²	116	112 Å²	112	54%	0.542	54%	0.543	S	S	.	.	H	α-helix	trans	-77.6	-40.6	172.5	-81.3	-177.8	9.2	0	0	112.2	L421 R422 K427 R428	L421-Q425 WeakPolarHBondContact O-CB 3.32Å; L421-Q425 WeakPolarHBondContact O-CG 3.34Å; L421-Q425 PolarHBondContact O-N 2.98Å; R422-Q425 PolarHBondContact O-N 3.38Å; Q425-K427 PolarHBondContact O-N 3.47Å; Q425-R428 WeakPolarHBondContact O-CB 3.39Å; Q425-R428 PolarHBondContact O-N 3.28Å
426	E	49.9	Very low	52.9	Low	134 Å²	134	114.1 Å²	114.1	63%	0.626	55%	0.55	S	S	*	.	H	α-helix	trans	-67.5	-25	175.7	-72.6	175.3	-176.6	0	0	111.5	R422 R428	R422-E426 HydrophobicContact CG-CG 4.38Å; R422-E426 WeakPolarHBondContact CG-OE1 3.49Å; R422-E426 IonicContact CZ-OE1 3.44Å; R422-E426 IonicContact NE-OE1 3.83Å; R422-E426 PolarHBondContact NE-OE1 3.44Å; R422-E426 IonicContact NH2-OE1 3.75Å; R422-E426 WeakPolarHBondContact O-CB 3.48Å; R422-E426 WeakPolarHBondContact O-CG 3.39Å; R422-E426 PolarHBondContact O-N 2.04Å; E426-R428 VanDerWaalsContact C-N 3.26Å; E426-R428 PolarHBondContact O-N 3.04Å
427	K	45.6	Very low	50.7	Low	145 Å²	145	116.7 Å²	116.7	63%	0.63	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-2.8	168	-72.4	168.4	-168.4	161.8	0	114.1	E423 Q425 P429	E423-K427 WeakPolarHBondContact O-CB 3.36Å; E423-K427 WeakPolarHBondContact O-CD 3.35Å; E423-K427 WeakPolarHBondContact O-CG 3.45Å; E423-K427 PolarHBondContact O-N 3.44Å; Q425-K427 PolarHBondContact O-N 3.47Å; K427-P429 VanDerWaalsContact O-CD 3.27Å; K427-P429 WeakPolarHBondContact O-CD 3.46Å
428	R	40.6	Very low	48.4	Very low	141 Å²	141	121.3 Å²	121.3	53%	0.532	58%	0.58	S	S	.	*	S	Bend	trans	-77.4	113.1	169.4	-64.7	-178.6	-177.3	-172.3	4.1	107.7	Q425 E426	Q425-R428 WeakPolarHBondContact O-CB 3.39Å; Q425-R428 PolarHBondContact O-N 3.28Å; E426-R428 VanDerWaalsContact C-N 3.26Å; E426-R428 PolarHBondContact O-N 3.04Å
429	P	38.8	Very low	46.3	Very low	81 Å²	81	121.9 Å²	121.9	53%	0.526	59%	0.594	S	S	.	*			trans	-76.3	145.2	177.9	33.9	-30.5	0	0	0	107.7	K427	K427-P429 VanDerWaalsContact O-CD 3.27Å; K427-P429 WeakPolarHBondContact O-CD 3.46Å
430	W	40.3	Very low	44.7	Very low	82 Å²	82	122.1 Å²	122.1	31%	0.311	60%	0.599	S	S	.	*			trans	88.7	84.9	169.3	-48.2	95.8	0	0	0	116.6	Y606 A676 H679	W430-Y606 HydrophobicContact CZ2-CG 4.47Å; W430-A676 HydrophobicContact CH2-CB 3.67Å; W430-A676 HydrophobicContact CZ2-CB 3.8Å; W430-H679 AromaticContact CZ2-CD2 3.84Å
431	D	34.6	Very low	43.3	Very low	163 Å²	163	121.3 Å²	121.3	87%	0.872	61%	0.606	S	S	*	*			trans	-163.8	85.8	138.3	-88.6	-29.3	0	0	0	110.1
432	H	33.6	Very low	41.8	Very low	180 Å²	180	125.1 Å²	125.1	83%	0.833	62%	0.618	S	S	*	*			trans	-123.7	122.7	161.8	-75.1	-33	0	0	0	109
433	E	27.6	Very low	40.5	Very low	179 Å²	179	120.5 Å²	120.5	84%	0.836	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-53	137.7	177.1	-79.8	-177.9	140.5	0	0	111.5
434	P	32.8	Very low	39.5	Very low	98 Å²	98	124.6 Å²	124.6	64%	0.636	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-67.5	137.3	174	25.9	-31	0	0	0	110.7
435	P	33.7	Very low	38.7	Very low	73 Å²	73	127 Å²	127	47%	0.474	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-69.4	144.3	178.3	27.9	-31.9	0	0	0	111.2
436	K	30.4	Very low	37.9	Very low	192 Å²	192	124.2 Å²	124.2	84%	0.835	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-64.8	140.4	-178.3	-65	179.2	-179.5	177	0	111.9
437	P	34.3	Very low	37.8	Very low	122 Å²	122	120.9 Å²	120.9	79%	0.792	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-68.7	137.1	-177.8	25.2	-32.3	0	0	0	112.8
438	K	37.7	Very low	37.9	Very low	118 Å²	118	121.8 Å²	121.8	51%	0.513	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-93.6	157.9	178.7	-73.7	-178.4	-179	175.3	0	112.9	E553	K438-E553 IonicContact NZ-OE1 2.59Å; K438-E553 PolarHBondContact NZ-OE1 3.35Å; K438-E553 IonicContact NZ-OE2 3.36Å; K438-E553 PolarHBondContact NZ-OE2 3.3Å
439	P	39.3	Very low	38.4	Very low	94 Å²	94	117.9 Å²	117.9	61%	0.61	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-68.4	155.2	-172.1	-16.3	30.1	0	0	0	115	T441 Y442 W443	P439-T441 PolarHBondContact O-N 2.04Å; P439-Y442 PolarHBondContact O-N 2.98Å; P439-W443 PolarHBondContact O-NE1 3.45Å
440	L	39.6	Very low	39.1	Very low	124 Å²	124	123 Å²	123	65%	0.649	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-58.1	-18.5	-174.5	-150.1	82.5	0	0	0	115.1	Y442	L440-Y442 VanDerWaalsContact C-N 3.33Å; L440-Y442 PolarHBondContact O-N 2.95Å
441	T	42.9	Very low	40.4	Very low	124 Å²	124	122.1 Å²	122.1	76%	0.761	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-76.4	-15.5	-175.1	46.1	0	0	0	0	114.3	P439 W443	P439-T441 PolarHBondContact O-N 2.04Å; T441-W443 VanDerWaalsContact C-N 3.35Å
442	Y	37.1	Very low	42.4	Very low	118 Å²	118	115.8 Å²	115.8	46%	0.463	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-76.3	-20.6	176.9	-175.1	-104.2	0	0	0	113.3	P439 L440 V446 P552	P439-Y442 PolarHBondContact O-N 2.98Å; L440-Y442 VanDerWaalsContact C-N 3.33Å; L440-Y442 PolarHBondContact O-N 2.95Å; Y442-V446 HydrophobicContact CE1-CG2 4.38Å; Y442-P552 HydrophobicContact CE1-CB 4.49Å; Y442-P552 HydrophobicContact CE1-CG 4.21Å
443	W	40.5	Very low	44.4	Very low	45 Å²	45	111.1 Å²	111.1	17%	0.17	59%	0.592	C	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-5.7	-164.5	-50.3	99.4	0	0	0	115.5	P439 T441 D445 A548 Y549 P552	P439-W443 PolarHBondContact O-NE1 3.45Å; T441-W443 VanDerWaalsContact C-N 3.35Å; W443-D445 PolarHBondContact O-N 2.95Å; W443-A548 WeakPolarHBondContact CZ3-O 3.23Å; W443-Y549 VanDerWaalsContact CH2-O 3.27Å; W443-Y549 WeakPolarHBondContact CH2-O 3.31Å; W443-Y549 WeakPolarHBondContact CZ3-O 3.35Å; W443-P552 VanDerWaalsContact CH2-CD 3.48Å; W443-P552 HydrophobicContact CH2-CG 3.53Å; W443-P552 HydrophobicContact CZ3-CB 4.18Å; W443-P552 HydrophobicContact CZ3-CG 3.5Å; W443-P552 VanDerWaalsContact CZ3-CG 3.5Å
444	K	38.8	Very low	46.9	Very low	193 Å²	193	106.4 Å²	106.4	84%	0.839	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-20.8	176.6	-97.6	-173.9	173.7	-176.4	0	113.2
445	D	40.1	Very low	49.5	Very low	144 Å²	144	104.1 Å²	104.1	77%	0.77	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-6.6	-173	-60.1	-27.8	0	0	0	113.5	W443	W443-D445 PolarHBondContact O-N 2.95Å
446	V	38.4	Very low	51.9	Low	59 Å²	59	103.3 Å²	103.3	36%	0.358	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-15.1	-169.3	-176	0	0	0	0	114.1	Y442 A548	Y442-V446 HydrophobicContact CE1-CG2 4.38Å; V446-A548 HydrophobicContact CG1-CB 4.27Å
447	L	46.9	Very low	54.2	Low	64 Å²	64	95.7 Å²	95.7	34%	0.335	51%	0.514	S	S	.	.			trans	-103.4	70.6	-176.6	-71.1	164.3	0	0	0	112.2	L449 L545 A548 Y549	L447-L449 PolarHBondContact O-N 3.38Å; L447-L545 HydrophobicContact CD2-CD2 3.77Å; L447-A548 HydrophobicContact CD2-CB 4.08Å; L447-Y549 HydrophobicContact CD1-CD2 4.38Å
448	L	47.3	Very low	56.4	Low	164 Å²	164	91.6 Å²	91.6	86%	0.859	49%	0.489	S	S	*	.			trans	-95.7	68.4	165.6	-83.3	161.6	0	0	0	110
449	L	52.2	Low	58.2	Low	59 Å²	59	95.8 Å²	95.8	31%	0.309	50%	0.501	S	S	.	.			trans	-108.4	105.7	155.3	-87.7	160.2	0	0	0	106.6	L447 G451 V452 L545	L447-L449 PolarHBondContact O-N 3.38Å; L449-G451 PolarHBondContact O-N 3.27Å; L449-V452 HydrophobicContact CB-CB 4.38Å; L449-V452 HydrophobicContact CB-CG2 3.96Å; L449-V452 PolarHBondContact O-N 3.01Å; L449-L545 HydrophobicContact CB-CD2 4.48Å; L449-L545 HydrophobicContact CD1-CD1 3.95Å; L449-L545 HydrophobicContact CD1-CD2 3.36Å; L449-L545 HydrophobicContact CD1-CG 3.36Å; L449-L545 HydrophobicContact CG-CD2 4.49Å
450	E	54.1	Low	60	Low	189 Å²	189	97 Å²	97	88%	0.883	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	128.2	178.6	-71.1	-173.9	159.7	0	0	110.1
451	G	65.8	Low	62.3	Low	62 Å²	62	91.2 Å²	91.2	64%	0.639	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-7.1	177.3	0	0	0	0	0	116.5	L449	L449-G451 PolarHBondContact O-N 3.27Å
452	V	76.6	Confident	64.5	Low	30 Å²	30	90.8 Å²	90.8	18%	0.182	46%	0.461	C	S	.	.			trans	-93.6	129.6	177.8	-176.1	0	0	0	0	111.5	L449 L469 D470 L472 L545	L449-V452 HydrophobicContact CB-CB 4.38Å; L449-V452 HydrophobicContact CB-CG2 3.96Å; L449-V452 PolarHBondContact O-N 3.01Å; V452-L469 HydrophobicContact CG1-CB 4.05Å; V452-L469 HydrophobicContact CG1-CD2 3.99Å; V452-D470 CarbonylContact C-O 3.5Å; V452-D470 WeakPolarHBondContact CA-O 3.48Å; V452-L472 HydrophobicContact CG2-CD1 4.09Å; V452-L545 HydrophobicContact CG1-CD1 4.2Å; V452-L545 HydrophobicContact CG1-CD2 4.44Å; V452-L545 HydrophobicContact CG2-CD1 4.39Å
453	T	77.4	Confident	66.7	Low	83 Å²	83	86.7 Å²	86.7	51%	0.509	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.9	179.4	59.6	0	0	0	0	111.9	T455 L469 D470	T453-T455 PolarHBondContact O-N 3.05Å; T453-L469 CarbonylContact O-C 3.58Å; T453-L469 WeakPolarHBondContact O-CA 3.27Å; T453-D470 PolarHBondContact N-O 3.49Å; T453-D470 PolarHBondContact O-N 3.03Å
454	L	79.4	Confident	68.7	Low	80 Å²	80	87.2 Å²	87.2	42%	0.419	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	111.2	168.2	179.6	67.5	0	0	0	109.4	D457 A467 L469 Y549	L454-D457 HydrophobicContact CD2-CB 4.39Å; L454-A467 HydrophobicContact CD1-CB 3.99Å; L454-L469 HydrophobicContact CD1-CG 4.24Å; L454-Y549 HydrophobicContact CD1-CE2 3.94Å; L454-Y549 HydrophobicContact CD2-CE2 4.08Å
455	T	86.9	Confident	70.8	Confident	50 Å²	50	81.5 Å²	81.5	31%	0.307	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-38	-175.4	-56.4	0	0	0	0	112.3	T453 V468 D470	T453-T455 PolarHBondContact O-N 3.05Å; T455-V468 PolarHBondContact N-O 3.31Å; T455-D470 WeakPolarHBondContact CB-OD2 3.48Å; T455-D470 WeakPolarHBondContact CG2-OD2 3.35Å; T455-D470 PolarHBondContact OG1-OD2 2.9Å
456	Q	84.4	Confident	73.3	Confident	56 Å²	56	74.8 Å²	74.8	26%	0.262	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	126.7	175.6	-55	179	-55.5	0	0	110.3	Q460 L461 A467 V468	Q456-Q460 VanDerWaalsContact CA-OE1 3.3Å; Q456-Q460 HydrophobicContact CB-CB 4.32Å; Q456-L461 HydrophobicContact CB-CD1 4.28Å; Q456-L461 HydrophobicContact CB-CD2 4.07Å; Q456-L461 HydrophobicContact CB-CG 3.94Å; Q456-A467 WeakPolarHBondContact O-CA 3.5Å; Q456-V468 HydrophobicContact CB-CB 3.98Å; Q456-V468 HydrophobicContact CB-CG2 4.23Å; Q456-V468 HydrophobicContact CG-CB 4.39Å; Q456-V468 PolarHBondContact N-O 3.17Å; Q456-V468 PolarHBondContact O-N 3.41Å
457	D	78.4	Confident	75.6	Confident	31 Å²	31	72 Å²	72	17%	0.166	39%	0.389	C	S	.	.			trans	-90.7	178.9	171.7	70.9	23.5	0	0	0	112.2	L454 R459 Q460 L461	L454-D457 HydrophobicContact CD2-CB 4.39Å; D457-R459 VanDerWaalsContact C-N 3.26Å; D457-R459 PolarHBondContact O-N 3.05Å; D457-R459 WeakPolarHBondContact OD1-CA 3.5Å; D457-R459 WeakPolarHBondContact OD1-CB 3.36Å; D457-R459 PolarHBondContact OD1-N 3.33Å; D457-Q460 PolarHBondContact O-N 3.41Å; D457-Q460 WeakPolarHBondContact OD1-CG 3.29Å; D457-Q460 PolarHBondContact OD1-N 3.43Å; D457-L461 WeakPolarHBondContact O-CB 3.39Å; D457-L461 VanDerWaalsContact O-CG 3.31Å; D457-L461 WeakPolarHBondContact O-CG 3.35Å; D457-L461 PolarHBondContact O-N 3.48Å
458	S	80.1	Confident	77.9	Confident	37 Å²	37	68.9 Å²	68.9	26%	0.259	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-32.6	-177.7	59.9	0	0	0	0	113.2	L461 N462 G463 R466	S458-L461 CarbonylContact O-C 2.98Å; S458-L461 PolarHBondContact O-N 2.87Å; S458-N462 PolarHBondContact O-N 3.18Å; S458-N462 VanDerWaalsContact O-N 3.14Å; S458-G463 CarbonylContact C-O 3.46Å; S458-G463 WeakPolarHBondContact CB-O 3.3Å; S458-G463 PolarHBondContact O-N 2.92Å; S458-R466 VanDerWaalsContact CA-O 3.27Å; S458-R466 WeakPolarHBondContact CA-O 3.48Å; S458-R466 WeakPolarHBondContact CB-O 3.3Å; S458-R466 PolarHBondContact N-O 3.02Å
459	R	75.6	Confident	79.8	Confident	206 Å²	206	61.3 Å²	61.3	78%	0.777	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-46	177.5	-63.2	179.3	175.8	177.7	-1.2	110.7	D457 L461 N462	D457-R459 VanDerWaalsContact C-N 3.26Å; D457-R459 PolarHBondContact O-N 3.05Å; D457-R459 WeakPolarHBondContact OD1-CA 3.5Å; D457-R459 WeakPolarHBondContact OD1-CB 3.36Å; D457-R459 PolarHBondContact OD1-N 3.33Å; R459-L461 PolarHBondContact O-N 2.9Å; R459-N462 PolarHBondContact O-N 3.38Å; R459-N462 VanDerWaalsContact O-N 3.09Å
460	Q	77.8	Confident	81.6	Confident	119 Å²	119	59 Å²	59	56%	0.556	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.6	177.1	-66.6	173.4	-57.2	0	0	112.3	Q456 D457	Q456-Q460 VanDerWaalsContact CA-OE1 3.3Å; Q456-Q460 HydrophobicContact CB-CB 4.32Å; D457-Q460 PolarHBondContact O-N 3.41Å; D457-Q460 WeakPolarHBondContact OD1-CG 3.29Å; D457-Q460 PolarHBondContact OD1-N 3.43Å
461	L	87.5	Confident	83	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7	174	-64.9	167.9	0	0	0	113.1	Q456 D457 S458 R459 G463 R466 V468 A636 V638	Q456-L461 HydrophobicContact CB-CD1 4.28Å; Q456-L461 HydrophobicContact CB-CD2 4.07Å; Q456-L461 HydrophobicContact CB-CG 3.94Å; D457-L461 WeakPolarHBondContact O-CB 3.39Å; D457-L461 VanDerWaalsContact O-CG 3.31Å; D457-L461 WeakPolarHBondContact O-CG 3.35Å; D457-L461 PolarHBondContact O-N 3.48Å; S458-L461 CarbonylContact O-C 2.98Å; S458-L461 PolarHBondContact O-N 2.87Å; R459-L461 PolarHBondContact O-N 2.9Å; L461-G463 VanDerWaalsContact C-N 3.33Å; L461-G463 PolarHBondContact O-N 3.18Å; L461-R466 HydrophobicContact CB-CG 3.98Å; L461-R466 HydrophobicContact CD1-CB 4.29Å; L461-R466 HydrophobicContact CD1-CG 3.93Å; L461-R466 PolarHBondContact O-NE 2.86Å; L461-R466 PolarHBondContact O-NH2 3.46Å; L461-V468 HydrophobicContact CD1-CG2 4.04Å; L461-V468 HydrophobicContact CD2-CG2 4.16Å; L461-A636 HydrophobicContact CB-CB 4.33Å; L461-A636 HydrophobicContact CD2-CB 4.21Å; L461-A636 WeakPolarHBondContact O-CB 3.46Å; L461-V638 HydrophobicContact CD2-CG2 3.98Å
462	N	88.4	Confident	84.2	Confident	115 Å²	115	48.8 Å²	48.8	62%	0.615	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	44.2	-179.5	-64.5	-26.8	0	0	0	114.6	S458 R459 R466 T635	S458-N462 PolarHBondContact O-N 3.18Å; S458-N462 VanDerWaalsContact O-N 3.14Å; R459-N462 PolarHBondContact O-N 3.38Å; R459-N462 VanDerWaalsContact O-N 3.09Å; N462-R466 VanDerWaalsContact C-NH2 3.27Å; N462-R466 PolarHBondContact O-NH2 3.04Å; N462-T635 PolarHBondContact ND2-O 3.43Å; N462-T635 VanDerWaalsContact ND2-O 3.14Å
463	G	84.9	Confident	85	Confident	32 Å²	32	47.8 Å²	47.8	33%	0.33	26%	0.26	S	S	.	.	S	Bend	trans	-159.5	-171.4	177.2	0	0	0	0	0	113.3	S458 L461	S458-G463 CarbonylContact C-O 3.46Å; S458-G463 WeakPolarHBondContact CB-O 3.3Å; S458-G463 PolarHBondContact O-N 2.92Å; L461-G463 VanDerWaalsContact C-N 3.33Å; L461-G463 PolarHBondContact O-N 3.18Å
464	S	82.1	Confident	85.7	Confident	57 Å²	57	47.2 Å²	47.2	40%	0.399	26%	0.257	S	S	.	.	S	Bend	trans	-107.9	151.1	174.7	51.7	0	0	0	0	111.1	R466 N654	S464-R466 VanDerWaalsContact C-N 3.26Å; S464-R466 PolarHBondContact O-N 3.41Å; S464-R466 VanDerWaalsContact O-N 3.09Å; S464-N654 PolarHBondContact O-ND2 3.19Å; S464-N654 PolarHBondContact O-OD1 3.44Å
465	E	83.5	Confident	86.5	Confident	72 Å²	72	48.7 Å²	48.7	34%	0.336	27%	0.271	S	S	.	.	S	Bend	trans	46.8	45	171.7	-63.3	-164.3	94.3	0	0	114.8	F550 Y609 F648 S649	E465-F550 HydrophobicContact CB-CD1 4.27Å; E465-F550 HydrophobicContact CB-CE1 4.11Å; E465-F550 WeakPolarHBondContact O-CE1 3.25Å; E465-Y609 PolarHBondContact OE1-OH 3.15Å; E465-F648 CarbonylContact O-C 3.54Å; E465-F648 WeakPolarHBondContact O-CA 3.5Å; E465-S649 PolarHBondContact O-N 2.86Å
466	R	91.4	Very high	86.9	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.011	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.5	172.5	58.4	171.5	172.6	-133.5	18.7	111.9	S458 L461 N462 S464 F626 T635 A647 F648 N654	S458-R466 VanDerWaalsContact CA-O 3.27Å; S458-R466 WeakPolarHBondContact CA-O 3.48Å; S458-R466 WeakPolarHBondContact CB-O 3.3Å; S458-R466 PolarHBondContact N-O 3.02Å; L461-R466 HydrophobicContact CB-CG 3.98Å; L461-R466 HydrophobicContact CD1-CB 4.29Å; L461-R466 HydrophobicContact CD1-CG 3.93Å; L461-R466 PolarHBondContact O-NE 2.86Å; L461-R466 PolarHBondContact O-NH2 3.46Å; N462-R466 VanDerWaalsContact C-NH2 3.27Å; N462-R466 PolarHBondContact O-NH2 3.04Å; S464-R466 VanDerWaalsContact C-N 3.26Å; S464-R466 PolarHBondContact O-N 3.41Å; S464-R466 VanDerWaalsContact O-N 3.09Å; R466-F626 VanDerWaalsContact NH1-CB 3.31Å; R466-T635 PolarHBondContact NH2-OG1 2.97Å; R466-A647 CarbonylContact C-O 3.59Å; R466-A647 WeakPolarHBondContact CA-O 3.29Å; R466-F648 HydrophobicContact CB-CB 3.61Å; R466-N654 WeakPolarHBondContact CD-OD1 3.19Å; R466-N654 PolarHBondContact NH1-OD1 2.86Å
467	A	87.5	Confident	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	151.9	-177.8	0	0	0	0	0	112.2	L454 Q456 L469 Y549 F550 V646 A647	L454-A467 HydrophobicContact CD1-CB 3.99Å; Q456-A467 WeakPolarHBondContact O-CA 3.5Å; A467-L469 HydrophobicContact CB-CD1 4.19Å; A467-Y549 HydrophobicContact CB-CD1 4.25Å; A467-Y549 HydrophobicContact CB-CE1 3.65Å; A467-Y549 HydrophobicContact CB-CE2 4.32Å; A467-F550 HydrophobicContact CB-CZ 4.21Å; A467-V646 WeakPolarHBondContact O-CA 3.47Å; A467-A647 PolarHBondContact N-O 3.33Å; A467-A647 PolarHBondContact O-N 3.44Å
468	V	94.4	Very high	88.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.4	170	179.7	0	0	0	0	108.9	T455 Q456 L461 V638 R644 L645 V646	T455-V468 PolarHBondContact N-O 3.31Å; Q456-V468 HydrophobicContact CB-CB 3.98Å; Q456-V468 HydrophobicContact CB-CG2 4.23Å; Q456-V468 HydrophobicContact CG-CB 4.39Å; Q456-V468 PolarHBondContact N-O 3.17Å; Q456-V468 PolarHBondContact O-N 3.41Å; L461-V468 HydrophobicContact CD1-CG2 4.04Å; L461-V468 HydrophobicContact CD2-CG2 4.16Å; V468-V638 HydrophobicContact CG1-CG1 4.33Å; V468-V638 HydrophobicContact CG2-CG1 3.84Å; V468-V638 HydrophobicContact CG2-CG2 3.79Å; V468-R644 HydrophobicContact CG1-CG 3.78Å; V468-L645 CarbonylContact C-O 3.46Å; V468-L645 WeakPolarHBondContact CA-O 3.48Å; V468-V646 HydrophobicContact CG2-CG1 4.25Å; V468-V646 HydrophobicContact CG2-CG2 4.28Å
469	L	86.9	Confident	89.2	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.2	176.1	-55.6	98	0	0	0	109.6	V452 T453 L454 A467 R644 L645	V452-L469 HydrophobicContact CG1-CB 4.05Å; V452-L469 HydrophobicContact CG1-CD2 3.99Å; T453-L469 CarbonylContact O-C 3.58Å; T453-L469 WeakPolarHBondContact O-CA 3.27Å; L454-L469 HydrophobicContact CD1-CG 4.24Å; A467-L469 HydrophobicContact CB-CD1 4.19Å; L469-R644 CarbonylContact O-C 3.58Å; L469-R644 WeakPolarHBondContact O-CA 3.49Å; L469-L645 HydrophobicContact CB-CB 4.47Å; L469-L645 HydrophobicContact CD1-CD2 4.35Å; L469-L645 PolarHBondContact N-O 3.26Å; L469-L645 PolarHBondContact O-N 3.3Å
470	D	89.9	Confident	90.2	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.048	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	158.5	178.7	-70.1	-69	0	0	0	111.1	V452 T453 T455 R641 R644	V452-D470 CarbonylContact C-O 3.5Å; V452-D470 WeakPolarHBondContact CA-O 3.48Å; T453-D470 PolarHBondContact N-O 3.49Å; T453-D470 PolarHBondContact O-N 3.03Å; T455-D470 WeakPolarHBondContact CB-OD2 3.48Å; T455-D470 WeakPolarHBondContact CG2-OD2 3.35Å; T455-D470 PolarHBondContact OG1-OD2 2.9Å; D470-R641 IonicContact OD1-CZ 3.56Å; D470-R641 IonicContact OD1-NE 2.77Å; D470-R641 PolarHBondContact OD1-NE 3.44Å; D470-R641 IonicContact OD1-NH2 3.56Å; D470-R641 PolarHBondContact OD1-NH2 3.12Å; D470-R641 IonicContact OD2-CZ 3.67Å; D470-R641 IonicContact OD2-NE 3.44Å; D470-R641 IonicContact OD2-NH2 2.99Å; D470-R641 PolarHBondContact OD2-NH2 2.91Å; D470-R644 WeakPolarHBondContact OD1-CB 3.37Å; D470-R644 WeakPolarHBondContact OD1-CG 3.41Å; D470-R644 IonicContact OD1-CZ 3.14Å; D470-R644 IonicContact OD1-NE 2.9Å; D470-R644 PolarHBondContact OD1-NE 3.44Å; D470-R644 IonicContact OD1-NH2 2.69Å; D470-R644 IonicContact OD2-CZ 2.74Å; D470-R644 IonicContact OD2-NE 3.75Å; D470-R644 PolarHBondContact OD2-NE 3.18Å; D470-R644 IonicContact OD2-NH2 2.7Å; D470-R644 PolarHBondContact OD2-NH2 3.5Å
471	G	85.2	Confident	91.1	Very high	38 Å²	38	34 Å²	34	39%	0.392	23%	0.227	S	C	.	.			trans	84	14.7	180	0	0	0	0	0	114.1	L473 G643	G471-L473 VanDerWaalsContact C-N 3.32Å; G471-G643 PolarHBondContact N-O 3.29Å
472	L	89.4	Confident	91.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-68.7	-33.4	176.9	-172.8	56.9	0	0	0	112.5	V452 R541 V542 L545 L613 G643 L645	V452-L472 HydrophobicContact CG2-CD1 4.09Å; L472-R541 HydrophobicContact CD1-CB 4.27Å; L472-R541 VanDerWaalsContact O-CZ 3.29Å; L472-R541 PolarHBondContact O-NH2 3.41Å; L472-V542 HydrophobicContact CD2-CG2 3.53Å; L472-L545 HydrophobicContact CD1-CD1 3.31Å; L472-L545 HydrophobicContact CD2-CD1 4.09Å; L472-L545 HydrophobicContact CG-CD1 4.27Å; L472-L613 HydrophobicContact CB-CD1 4.14Å; L472-L613 HydrophobicContact CD2-CD1 3.9Å; L472-L613 HydrophobicContact CD2-CD2 3.93Å; L472-L613 HydrophobicContact CD2-CG 4.47Å; L472-L613 HydrophobicContact CG-CD1 4.38Å; L472-G643 PolarHBondContact N-O 2.87Å; L472-G643 VanDerWaalsContact N-O 3.08Å; L472-L645 HydrophobicContact CD2-CB 4.13Å; L472-L645 HydrophobicContact CD2-CD2 4.01Å
473	L	93.1	Very high	91.9	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.042	23%	0.227	C	C	.	.	S	Bend	trans	-123.6	142.9	174.3	-58.6	179.6	0	0	0	110.2	G471 E477 L481 V538 L613 L615	G471-L473 VanDerWaalsContact C-N 3.32Å; L473-E477 HydrophobicContact CB-CB 4.26Å; L473-E477 HydrophobicContact CD2-CB 4.23Å; L473-L481 HydrophobicContact CD1-CD1 4Å; L473-V538 HydrophobicContact CD1-CG1 4.46Å; L473-V538 HydrophobicContact CD2-CB 4.34Å; L473-V538 HydrophobicContact CD2-CG1 3.9Å; L473-V538 HydrophobicContact CD2-CG2 3.43Å; L473-V538 VanDerWaalsContact CD2-CG2 3.43Å; L473-L613 HydrophobicContact CD1-CD1 4.38Å; L473-L613 HydrophobicContact CD1-CD2 3.72Å; L473-L613 HydrophobicContact CD1-CG 4.1Å; L473-L613 HydrophobicContact CD2-CD2 4.39Å; L473-L613 HydrophobicContact CG-CD1 4.38Å; L473-L613 HydrophobicContact CG-CD2 3.97Å; L473-L615 HydrophobicContact CD1-CD2 3.6Å
474	T	93.1	Very high	92.3	Very high	71 Å²	71	33.1 Å²	33.1	44%	0.436	21%	0.212	S	C	.	.			trans	-74.5	157.7	165.4	63.3	0	0	0	0	110.6	A476 E477 C478	T474-A476 PolarHBondContact O-N 3.02Å; T474-E477 WeakPolarHBondContact CB-OE2 3.49Å; T474-E477 WeakPolarHBondContact CG2-OE2 3.36Å; T474-E477 PolarHBondContact N-OE2 3.01Å; T474-E477 PolarHBondContact O-N 3.34Å; T474-E477 VanDerWaalsContact O-N 3.17Å; T474-E477 WeakPolarHBondContact OG1-CG 3.42Å; T474-E477 PolarHBondContact OG1-N 2.91Å; T474-E477 PolarHBondContact OG1-OE2 3.44Å; T474-C478 PolarHBondContact O-N 2.89Å
475	P	95.3	Very high	92.9	Very high	112 Å²	112	30.8 Å²	30.8	73%	0.727	20%	0.197	S	C	*	.	H	α-helix	trans	-55.7	-31.3	173.4	-27.4	36	0	0	0	113.8	G479	P475-G479 PolarHBondContact O-N 3.24Å
476	A	95.8	Very high	93.2	Very high	73 Å²	73	33.1 Å²	33.1	60%	0.603	21%	0.206	S	C	*	.	H	α-helix	trans	-68.4	-47.6	176.6	0	0	0	0	0	111.8	T474 C478 G479 V480	T474-A476 PolarHBondContact O-N 3.02Å; A476-C478 PolarHBondContact O-N 3.05Å; A476-G479 WeakPolarHBondContact O-CA 3.42Å; A476-G479 PolarHBondContact O-N 2.56Å; A476-G479 VanDerWaalsContact O-N 3.11Å; A476-V480 WeakPolarHBondContact O-CG2 3.49Å; A476-V480 PolarHBondContact O-N 3.46Å
477	E	96.4	Very high	93.2	Very high	38 Å²	38	35.9 Å²	35.9	18%	0.178	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-42.7	175.9	-72.2	164.6	121.9	0	0	111.8	L473 T474 G479 V480 L481 L534 R541	L473-E477 HydrophobicContact CB-CB 4.26Å; L473-E477 HydrophobicContact CD2-CB 4.23Å; T474-E477 WeakPolarHBondContact CB-OE2 3.49Å; T474-E477 WeakPolarHBondContact CG2-OE2 3.36Å; T474-E477 PolarHBondContact N-OE2 3.01Å; T474-E477 PolarHBondContact O-N 3.34Å; T474-E477 VanDerWaalsContact O-N 3.17Å; T474-E477 WeakPolarHBondContact OG1-CG 3.42Å; T474-E477 PolarHBondContact OG1-N 2.91Å; T474-E477 PolarHBondContact OG1-OE2 3.44Å; E477-G479 VanDerWaalsContact C-N 3.29Å; E477-G479 PolarHBondContact O-N 3.17Å; E477-V480 PolarHBondContact O-N 3.04Å; E477-L481 PolarHBondContact O-N 3.09Å; E477-L481 VanDerWaalsContact O-N 3.07Å; E477-L534 HydrophobicContact CB-CD2 3.97Å; E477-L534 HydrophobicContact CG-CD1 4.08Å; E477-L534 HydrophobicContact CG-CD2 4.16Å; E477-R541 IonicContact OE1-NH1 3.71Å; E477-R541 PolarHBondContact OE1-NH1 2.89Å
478	C	97.4	Very high	93.3	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.02	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-44.9	171.9	-73.4	0	0	0	0	111.4	T474 A476 V480 L481 L482 L615 C642	T474-C478 PolarHBondContact O-N 2.89Å; A476-C478 PolarHBondContact O-N 3.05Å; C478-V480 PolarHBondContact O-N 3.32Å; C478-L481 PolarHBondContact O-N 3.17Å; C478-L482 WeakPolarHBondContact O-CB 3.29Å; C478-L482 WeakPolarHBondContact O-CG 3.43Å; C478-L482 PolarHBondContact O-N 3.27Å; C478-L615 WeakPolarHBondContact CB-O 3.39Å; C478-C642 HydrophobicContact CB-CB 4.01Å; C478-C642 WeakPolarHBondContact CB-SG 3.25Å; C478-C642 VanDerWaalsContact SG-CA 3.6Å; C478-C642 WeakPolarHBondContact SG-CB 3.42Å; C478-C642 CovalentContact SG-SG 2.04Å; C478-C642 PolarHBondContact SG-SG 3.36Å
479	G	96.8	Very high	92.8	Very high	35 Å²	35	36.8 Å²	36.8	36%	0.361	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-43.9	177	0	0	0	0	0	113.2	P475 A476 E477 L482 Q483	P475-G479 PolarHBondContact O-N 3.24Å; A476-G479 WeakPolarHBondContact O-CA 3.42Å; A476-G479 PolarHBondContact O-N 2.56Å; A476-G479 VanDerWaalsContact O-N 3.11Å; E477-G479 VanDerWaalsContact C-N 3.29Å; E477-G479 PolarHBondContact O-N 3.17Å; G479-L482 PolarHBondContact O-N 3.15Å; G479-Q483 WeakPolarHBondContact O-CB 3.39Å; G479-Q483 PolarHBondContact O-N 2.74Å
480	V	97.5	Very high	92.4	Very high	40 Å²	40	39.9 Å²	39.9	24%	0.242	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-47.3	177	172.9	0	0	0	0	111.2	A476 E477 C478 Q483 L484 L534	A476-V480 WeakPolarHBondContact O-CG2 3.49Å; A476-V480 PolarHBondContact O-N 3.46Å; E477-V480 PolarHBondContact O-N 3.04Å; C478-V480 PolarHBondContact O-N 3.32Å; V480-Q483 PolarHBondContact O-N 3.45Å; V480-L484 PolarHBondContact O-N 3.15Å; V480-L534 HydrophobicContact CB-CD2 3.82Å; V480-L534 HydrophobicContact CG1-CD2 3.75Å
481	L	97.3	Very high	91.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-34.9	179.6	-66.4	179	0	0	0	112.9	L473 E477 C478 Q483 L484 A485 L534 L535 V538 L615	L473-L481 HydrophobicContact CD1-CD1 4Å; E477-L481 PolarHBondContact O-N 3.09Å; E477-L481 VanDerWaalsContact O-N 3.07Å; C478-L481 PolarHBondContact O-N 3.17Å; L481-Q483 VanDerWaalsContact C-N 3.34Å; L481-L484 HydrophobicContact CD2-CD2 4.38Å; L481-L484 PolarHBondContact O-N 3.26Å; L481-A485 PolarHBondContact O-N 2.93Å; L481-L534 HydrophobicContact CD2-CB 4.29Å; L481-L534 HydrophobicContact CD2-CD2 4.1Å; L481-L534 HydrophobicContact CD2-CG 4.07Å; L481-L534 HydrophobicContact CG-CD2 3.91Å; L481-L534 HydrophobicContact CG-CG 4.26Å; L481-L535 HydrophobicContact CD2-CB 4.05Å; L481-L535 HydrophobicContact CD2-CD1 4.36Å; L481-V538 HydrophobicContact CD1-CG2 4.43Å; L481-L615 HydrophobicContact CB-CD1 3.83Å; L481-L615 HydrophobicContact CB-CD2 4.33Å; L481-L615 HydrophobicContact CD1-CD2 3.83Å
482	L	96.4	Very high	90.8	Very high	40 Å²	40	42.4 Å²	42.4	21%	0.209	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-39.2	174	-73.6	169.1	0	0	0	111.8	C478 G479 A485 K486 L615 N616 R665 C667	C478-L482 WeakPolarHBondContact O-CB 3.29Å; C478-L482 WeakPolarHBondContact O-CG 3.43Å; C478-L482 PolarHBondContact O-N 3.27Å; G479-L482 PolarHBondContact O-N 3.15Å; L482-A485 PolarHBondContact O-N 3.44Å; L482-K486 WeakPolarHBondContact O-CB 3.39Å; L482-K486 PolarHBondContact O-N 3.37Å; L482-L615 HydrophobicContact CD2-CB 3.9Å; L482-L615 HydrophobicContact CD2-CD1 4.44Å; L482-L615 HydrophobicContact CG-CB 4.09Å; L482-N616 HydrophobicContact CD1-CB 4.05Å; L482-N616 HydrophobicContact CD2-CB 4.29Å; L482-R665 PolarHBondContact O-NH2 3.16Å; L482-C667 HydrophobicContact CD2-CB 3.61Å
483	Q	94.9	Very high	89.5	Confident	86 Å²	86	43 Å²	43	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-45.8	176.2	-172.4	56.4	41.3	0	0	110.7	G479 V480 L481 A485 K486 D487	G479-Q483 WeakPolarHBondContact O-CB 3.39Å; G479-Q483 PolarHBondContact O-N 2.74Å; V480-Q483 PolarHBondContact O-N 3.45Å; L481-Q483 VanDerWaalsContact C-N 3.34Å; Q483-A485 VanDerWaalsContact C-N 3.32Å; Q483-A485 PolarHBondContact O-N 2.83Å; Q483-K486 WeakPolarHBondContact O-CB 3.19Å; Q483-K486 PolarHBondContact O-N 2.75Å; Q483-D487 PolarHBondContact NE2-OD1 3.45Å; Q483-D487 PolarHBondContact NE2-OD2 3.02Å; Q483-D487 PolarHBondContact O-N 3.47Å
484	L	95.2	Very high	88.1	Confident	5 Å²	5	49 Å²	49	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-51.9	-49.5	171.8	176.2	69.5	0	0	0	111.8	V480 L481 K486 D487 A488 L513 V527 G531 L535 L563	V480-L484 PolarHBondContact O-N 3.15Å; L481-L484 HydrophobicContact CD2-CD2 4.38Å; L481-L484 PolarHBondContact O-N 3.26Å; L484-K486 VanDerWaalsContact C-N 3.29Å; L484-K486 PolarHBondContact O-N 2.9Å; L484-D487 PolarHBondContact O-N 3.47Å; L484-A488 VanDerWaalsContact O-CB 3.3Å; L484-A488 WeakPolarHBondContact O-CB 3.29Å; L484-A488 PolarHBondContact O-N 3.11Å; L484-L513 HydrophobicContact CD1-CD2 4.4Å; L484-L513 HydrophobicContact CD2-CD2 4.14Å; L484-L513 HydrophobicContact CG-CD2 3.92Å; L484-V527 HydrophobicContact CD1-CB 3.82Å; L484-V527 HydrophobicContact CD1-CG1 4.32Å; L484-V527 HydrophobicContact CD1-CG2 3.62Å; L484-G531 WeakPolarHBondContact CD2-O 3.37Å; L484-L535 HydrophobicContact CD2-CB 4.24Å; L484-L535 HydrophobicContact CD2-CD2 4.17Å; L484-L563 HydrophobicContact CD2-CD2 4.3Å
485	A	93	Very high	86.5	Confident	9 Å²	9	47.1 Å²	47.1	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-37.6	178.5	0	0	0	0	0	112.5	L481 L482 Q483 A489 L563	L481-A485 PolarHBondContact O-N 2.93Å; L482-A485 PolarHBondContact O-N 3.44Å; Q483-A485 VanDerWaalsContact C-N 3.32Å; Q483-A485 PolarHBondContact O-N 2.83Å; A485-A489 VanDerWaalsContact O-CB 3.29Å; A485-A489 WeakPolarHBondContact O-CB 3.3Å; A485-A489 PolarHBondContact O-N 3.18Å; A485-A489 VanDerWaalsContact O-N 3.12Å; A485-L563 HydrophobicContact CB-CD2 3.89Å; A485-L563 HydrophobicContact CB-CG 4.34Å
486	K	91.6	Very high	84.4	Confident	121 Å²	121	43.2 Å²	43.2	53%	0.526	28%	0.282	S	S	.	.	H	α-helix	trans	-69	-45.3	179	-174.3	-176.6	175.9	-172.9	0	111.7	L482 Q483 L484 A489 G490	L482-K486 WeakPolarHBondContact O-CB 3.39Å; L482-K486 PolarHBondContact O-N 3.37Å; Q483-K486 WeakPolarHBondContact O-CB 3.19Å; Q483-K486 PolarHBondContact O-N 2.75Å; L484-K486 VanDerWaalsContact C-N 3.29Å; L484-K486 PolarHBondContact O-N 2.9Å; K486-A489 PolarHBondContact O-N 2.9Å; K486-G490 PolarHBondContact O-N 3.4Å
487	D	91	Very high	82.3	Confident	60 Å²	60	45.3 Å²	45.3	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-68.6	-42.8	-178.3	-64.7	-24.5	0	0	0	111	Q483 L484 A489 G490 A491 V527	Q483-D487 PolarHBondContact NE2-OD1 3.45Å; Q483-D487 PolarHBondContact NE2-OD2 3.02Å; Q483-D487 PolarHBondContact O-N 3.47Å; L484-D487 PolarHBondContact O-N 3.47Å; D487-A489 VanDerWaalsContact C-N 3.35Å; D487-A489 PolarHBondContact O-N 3.3Å; D487-G490 PolarHBondContact O-N 2.96Å; D487-G490 VanDerWaalsContact O-N 3.17Å; D487-A491 PolarHBondContact O-N 2.97Å; D487-V527 HydrophobicContact CB-CG1 3.89Å
488	A	88.1	Confident	80.3	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-60.1	-42.6	173.9	0	0	0	0	0	112.4	L484 G490 A491 G492 A493 L513 L521 V527	L484-A488 VanDerWaalsContact O-CB 3.3Å; L484-A488 WeakPolarHBondContact O-CB 3.29Å; L484-A488 PolarHBondContact O-N 3.11Å; A488-G490 VanDerWaalsContact C-N 3.34Å; A488-G490 PolarHBondContact O-N 2.98Å; A488-A491 PolarHBondContact O-N 2.98Å; A488-G492 PolarHBondContact O-N 3.01Å; A488-A493 HydrophobicContact CB-CB 4.39Å; A488-A493 WeakPolarHBondContact O-CB 3.41Å; A488-A493 PolarHBondContact O-N 3.31Å; A488-A493 VanDerWaalsContact O-N 3.08Å; A488-L513 HydrophobicContact CB-CD1 3.93Å; A488-L513 HydrophobicContact CB-CD2 3.74Å; A488-L513 HydrophobicContact CB-CG 4.37Å; A488-L521 HydrophobicContact CB-CD1 3.95Å; A488-V527 HydrophobicContact CB-CG1 4.27Å
489	A	84.3	Confident	78.3	Confident	18 Å²	18	57 Å²	57	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-37	176.1	0	0	0	0	0	112.6	A485 K486 D487 A491 G492 E511	A485-A489 VanDerWaalsContact O-CB 3.29Å; A485-A489 WeakPolarHBondContact O-CB 3.3Å; A485-A489 PolarHBondContact O-N 3.18Å; A485-A489 VanDerWaalsContact O-N 3.12Å; K486-A489 PolarHBondContact O-N 2.9Å; D487-A489 VanDerWaalsContact C-N 3.35Å; D487-A489 PolarHBondContact O-N 3.3Å; A489-A491 VanDerWaalsContact C-N 3.34Å; A489-G492 PolarHBondContact O-N 3Å; A489-E511 HydrophobicContact CB-CG 4.28Å
490	G	78.9	Confident	76.4	Confident	71 Å²	71	62.4 Å²	62.4	73%	0.732	34%	0.337	S	S	*	.	H	α-helix	trans	-64.9	-36.1	174	0	0	0	0	0	113.1	K486 D487 A488 G492	K486-G490 PolarHBondContact O-N 3.4Å; D487-G490 PolarHBondContact O-N 2.96Å; D487-G490 VanDerWaalsContact O-N 3.17Å; A488-G490 VanDerWaalsContact C-N 3.34Å; A488-G490 PolarHBondContact O-N 2.98Å; G490-G492 PolarHBondContact O-N 2.98Å
491	A	73.9	Confident	74.8	Confident	50 Å²	50	67.9 Å²	67.9	41%	0.413	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	2.6	175.4	0	0	0	0	0	114.2	D487 A488 A489 A493 T526	D487-A491 PolarHBondContact O-N 2.97Å; A488-A491 PolarHBondContact O-N 2.98Å; A489-A491 VanDerWaalsContact C-N 3.34Å; A491-A493 PolarHBondContact O-N 2.75Å; A491-T526 HydrophobicContact CB-CG2 3.42Å; A491-T526 VanDerWaalsContact CB-CG2 3.42Å
492	G	68.1	Low	73.3	Confident	50 Å²	50	69.7 Å²	69.7	52%	0.515	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	11.4	179.9	0	0	0	0	0	114.3	A488 A489 G490 R494	A488-G492 PolarHBondContact O-N 3.01Å; A489-G492 PolarHBondContact O-N 3Å; G490-G492 PolarHBondContact O-N 2.98Å; G492-R494 PolarHBondContact O-N 3.4Å
493	A	60.8	Low	71.9	Confident	13 Å²	13	69 Å²	69	11%	0.107	36%	0.364	C	S	.	.			trans	-70.7	102.9	173.8	0	0	0	0	0	109.3	A488 A491 K517 L521	A488-A493 HydrophobicContact CB-CB 4.39Å; A488-A493 WeakPolarHBondContact O-CB 3.41Å; A488-A493 PolarHBondContact O-N 3.31Å; A488-A493 VanDerWaalsContact O-N 3.08Å; A491-A493 PolarHBondContact O-N 2.75Å; A493-K517 HydrophobicContact CB-CG 4.27Å; A493-L521 HydrophobicContact CB-CD1 3.55Å; A493-L521 HydrophobicContact CB-CD2 4.48Å
494	R	64.8	Low	70.9	Confident	132 Å²	132	67.8 Å²	67.8	50%	0.498	36%	0.358	S	S	.	.			trans	-117.2	109.5	173.5	-60.9	-176.7	-168.7	168.5	7.3	108.2	G492	G492-R494 PolarHBondContact O-N 3.4Å
495	S	58.4	Low	70.2	Confident	32 Å²	32	67.9 Å²	67.9	22%	0.224	36%	0.359	C	S	.	.			trans	-99.6	147	168.2	-165.8	0	0	0	0	110.5	G512 T514	S495-G512 PolarHBondContact N-O 3.23Å; S495-T514 VanDerWaalsContact OG-CG2 3.22Å; S495-T514 WeakPolarHBondContact OG-CG2 3.37Å
496	G	51.2	Low	69.8	Low	30 Å²	30	71.5 Å²	71.5	31%	0.309	38%	0.382	S	S	.	.	S	Bend	trans	88.9	147.6	-179.4	0	0	0	0	0	115.5	R498 G499	G496-R498 VanDerWaalsContact C-N 3.34Å; G496-R498 PolarHBondContact O-N 2.88Å; G496-G499 PolarHBondContact O-N 3.36Å
497	Y	52.3	Low	69.5	Low	117 Å²	117	68.3 Å²	68.3	46%	0.459	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	50.8	38.8	174.3	-60.9	-78.9	0	0	0	116.6	G499 R500 P503 H504 F510	Y497-G499 PolarHBondContact O-N 3.28Å; Y497-G499 VanDerWaalsContact O-N 3.12Å; Y497-R500 WeakPolarHBondContact O-CB 3.45Å; Y497-R500 WeakPolarHBondContact O-CG 3.33Å; Y497-R500 PolarHBondContact O-N 3.39Å; Y497-P503 HydrophobicContact CD1-CB 3.86Å; Y497-P503 HydrophobicContact CD2-CB 3.88Å; Y497-P503 HydrophobicContact CD2-CG 3.82Å; Y497-P503 HydrophobicContact CE1-CB 4.47Å; Y497-P503 HydrophobicContact CE2-CB 4.47Å; Y497-P503 HydrophobicContact CE2-CG 4.34Å; Y497-P503 HydrophobicContact CG-CB 3.54Å; Y497-P503 HydrophobicContact CG-CG 4Å; Y497-H504 AromaticContact CE2-NE2 3.89Å; Y497-H504 AromaticContact CZ-CE1 3.57Å; Y497-H504 AromaticContact CZ-NE2 3.74Å; Y497-H504 PolarHBondContact OH-CE1 3.35Å; Y497-H504 VanDerWaalsContact OH-CE1 3.32Å; Y497-F510 HydrophobicContact CD2-CD1 4.47Å; Y497-F510 AromaticContact CD2-CE1 3.83Å; Y497-F510 HydrophobicContact CD2-CE1 3.83Å; Y497-F510 HydrophobicContact CD2-CZ 4.04Å; Y497-F510 HydrophobicContact CE2-CE1 4.5Å; Y497-F510 HydrophobicContact CE2-CZ 4.25Å
498	R	54.8	Low	69.4	Low	254 Å²	254	65.6 Å²	65.6	96%	0.958	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	52.5	34.1	176.1	-57.7	-177.2	-178.3	-179	-0.2	113.4	G496 R500	G496-R498 VanDerWaalsContact C-N 3.34Å; G496-R498 PolarHBondContact O-N 2.88Å; R498-R500 VanDerWaalsContact C-N 3.27Å; R498-R500 PolarHBondContact O-N 2.94Å
499	G	54.4	Low	69.5	Low	34 Å²	34	69.2 Å²	69.2	35%	0.351	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	72.9	11.3	178.6	0	0	0	0	0	115.5	G496 Y497 R501	G496-G499 PolarHBondContact O-N 3.36Å; Y497-G499 PolarHBondContact O-N 3.28Å; Y497-G499 VanDerWaalsContact O-N 3.12Å; G499-R501 PolarHBondContact O-N 3.45Å
500	R	58.3	Low	69.7	Low	148 Å²	148	68.8 Å²	68.8	56%	0.558	36%	0.362	S	S	*	.			trans	-60.9	132.7	175.2	-75.6	-175.7	176.5	-173.5	-0.1	110.9	Y497 R498 S502	Y497-R500 WeakPolarHBondContact O-CB 3.45Å; Y497-R500 WeakPolarHBondContact O-CG 3.33Å; Y497-R500 PolarHBondContact O-N 3.39Å; R498-R500 VanDerWaalsContact C-N 3.27Å; R498-R500 PolarHBondContact O-N 2.94Å; R500-S502 VanDerWaalsContact C-N 3.26Å; R500-S502 PolarHBondContact O-N 3.22Å
501	R	63	Low	70.2	Confident	155 Å²	155	66.5 Å²	66.5	59%	0.585	33%	0.332	S	S	*	.	S	Bend	trans	-64.8	-29.1	-179	-158.5	178.9	-162.4	-170.3	3.1	113.2	G499 R509 F510	G499-R501 PolarHBondContact O-N 3.45Å; R501-R509 HydrophobicContact CG-CG 4.42Å; R501-F510 PolarHBondContact O-N 3.41Å
502	S	65.9	Low	71	Confident	38 Å²	38	64.3 Å²	64.3	27%	0.266	32%	0.315	S	S	.	.			trans	-151.4	71.6	-164.5	-67.5	0	0	0	0	110.7	R500 H504 T505 E508	R500-S502 VanDerWaalsContact C-N 3.26Å; R500-S502 PolarHBondContact O-N 3.22Å; S502-H504 PolarHBondContact O-N 2.8Å; S502-T505 VanDerWaalsContact CB-O 3.22Å; S502-T505 WeakPolarHBondContact CB-O 3.05Å; S502-E508 WeakPolarHBondContact CB-O 3.1Å; S502-E508 PolarHBondContact OG-O 3.22Å
503	P	66.8	Low	72.2	Confident	26 Å²	26	62.2 Å²	62.2	17%	0.169	29%	0.292	C	S	.	.	S	Bend	trans	-74.1	-19.3	-167.8	28.3	-35	0	0	0	115.3	Y497 F510	Y497-P503 HydrophobicContact CD1-CB 3.86Å; Y497-P503 HydrophobicContact CD2-CB 3.88Å; Y497-P503 HydrophobicContact CD2-CG 3.82Å; Y497-P503 HydrophobicContact CE1-CB 4.47Å; Y497-P503 HydrophobicContact CE2-CB 4.47Å; Y497-P503 HydrophobicContact CE2-CG 4.34Å; Y497-P503 HydrophobicContact CG-CB 3.54Å; Y497-P503 HydrophobicContact CG-CG 4Å; P503-F510 HydrophobicContact CG-CB 4.03Å; P503-F510 HydrophobicContact CG-CD1 3.97Å; P503-F510 HydrophobicContact CG-CG 3.96Å
504	H	75.2	Confident	73.7	Confident	59 Å²	59	61.9 Å²	61.9	27%	0.273	29%	0.289	S	S	.	.	S	Bend	trans	-118.3	-31.9	-179.3	-55.2	-55.4	0	0	0	113.8	Y497 S502 R566 H581	Y497-H504 AromaticContact CE2-NE2 3.89Å; Y497-H504 AromaticContact CZ-CE1 3.57Å; Y497-H504 AromaticContact CZ-NE2 3.74Å; Y497-H504 PolarHBondContact OH-CE1 3.35Å; Y497-H504 VanDerWaalsContact OH-CE1 3.32Å; S502-H504 PolarHBondContact O-N 2.8Å; H504-R566 PolarHBondContact CD2-NH2 3.25Å; H504-R566 PolarHBondContact NE2-NH2 3.34Å; H504-R566 VanDerWaalsContact NE2-NH2 3.2Å; H504-H581 AromaticContact CD2-CD2 3.94Å; H504-H581 AromaticContact NE2-CD2 3.69Å; H504-H581 AromaticContact NE2-NE2 3.82Å
505	T	80.4	Confident	75.2	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.043	27%	0.266	C	S	.	.			trans	-147	137.1	179.3	171	0	0	0	0	109.3	S502 H507 E508 D578	S502-T505 VanDerWaalsContact CB-O 3.22Å; S502-T505 WeakPolarHBondContact CB-O 3.05Å; T505-H507 PolarHBondContact O-N 3.41Å; T505-H507 PolarHBondContact OG1-N 2.97Å; T505-E508 HydrophobicContact CG2-CB 3.83Å; T505-E508 HydrophobicContact CG2-CG 3.83Å; T505-D578 WeakPolarHBondContact CB-OD2 3.42Å; T505-D578 PolarHBondContact OG1-OD2 3Å
506	P	82.9	Confident	76.8	Confident	85 Å²	85	55.1 Å²	55.1	55%	0.552	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.6	176	29	-35.2	0	0	0	112.9	E508 I569	P506-E508 VanDerWaalsContact C-N 3.33Å; P506-E508 PolarHBondContact O-N 3.44Å; P506-I569 VanDerWaalsContact O-CD1 3.27Å; P506-I569 WeakPolarHBondContact O-CD1 3.43Å
507	H	86.6	Confident	78.8	Confident	54 Å²	54	57.2 Å²	57.2	25%	0.25	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-2.1	-172.3	-55	-48.8	0	0	0	114.4	T505 I569 E572 Q573 D578	T505-H507 PolarHBondContact O-N 3.41Å; T505-H507 PolarHBondContact OG1-N 2.97Å; H507-I569 WeakPolarHBondContact O-CB 3.01Å; H507-I569 PolarHBondContact O-N 3.39Å; H507-E572 HydrophobicContact CB-CB 4.42Å; H507-E572 IonicContact CE1-OE2 3.62Å; H507-E572 IonicContact CG-OE2 3.22Å; H507-E572 PolarHBondContact ND1-O 2.69Å; H507-E572 IonicContact ND1-OE2 2.6Å; H507-E572 PolarHBondContact ND1-OE2 3.22Å; H507-Q573 PolarHBondContact O-NE2 3.34Å; H507-D578 IonicContact CD2-OD1 3.52Å; H507-D578 IonicContact CD2-OD2 3.87Å
508	E	89.1	Confident	80.8	Confident	3 Å²	3	51.7 Å²	51.7	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.2	179.3	-61.9	176.4	-163.1	0	0	110.9	S502 T505 P506 S567 R576 S580 V661	S502-E508 WeakPolarHBondContact CB-O 3.1Å; S502-E508 PolarHBondContact OG-O 3.22Å; T505-E508 HydrophobicContact CG2-CB 3.83Å; T505-E508 HydrophobicContact CG2-CG 3.83Å; P506-E508 VanDerWaalsContact C-N 3.33Å; P506-E508 PolarHBondContact O-N 3.44Å; E508-S567 CarbonylContact C-O 3.56Å; E508-S567 VanDerWaalsContact CA-O 3.29Å; E508-S567 WeakPolarHBondContact CA-O 3.48Å; E508-R576 IonicContact OE1-CZ 3.63Å; E508-R576 IonicContact OE1-NH1 3.67Å; E508-R576 PolarHBondContact OE1-NH1 3.06Å; E508-R576 IonicContact OE1-NH2 3.71Å; E508-R576 PolarHBondContact OE1-NH2 3.05Å; E508-S580 WeakPolarHBondContact OE1-CB 3.27Å; E508-S580 VanDerWaalsContact OE2-CB 3.3Å; E508-S580 WeakPolarHBondContact OE2-CB 3.29Å; E508-S580 PolarHBondContact OE2-OG 2.91Å; E508-V661 PolarHBondContact OE1-N 2.85Å
509	R	88.4	Confident	82.6	Confident	77 Å²	77	39.6 Å²	39.6	29%	0.291	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.4	170	-179.4	177.7	167.2	176.3	-7.4	109.7	R501 E511 R566 S567	R501-R509 HydrophobicContact CG-CG 4.42Å; R509-E511 IonicContact CZ-OE1 3.02Å; R509-E511 IonicContact NE-OE1 3.88Å; R509-E511 PolarHBondContact NE-OE1 3.17Å; R509-E511 IonicContact NH2-OE1 3.6Å; R509-E511 PolarHBondContact NH2-OE1 3.33Å; R509-R566 WeakPolarHBondContact O-CA 3.47Å; R509-S567 PolarHBondContact N-O 2.94Å; R509-S567 PolarHBondContact O-N 3.46Å
510	F	89.1	Confident	84.5	Confident	10 Å²	10	42 Å²	42	4%	0.044	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.1	175.4	178.6	-115.4	0	0	0	112.4	Y497 R501 P503 H562 V564 R566	Y497-F510 HydrophobicContact CD2-CD1 4.47Å; Y497-F510 AromaticContact CD2-CE1 3.83Å; Y497-F510 HydrophobicContact CD2-CE1 3.83Å; Y497-F510 HydrophobicContact CD2-CZ 4.04Å; Y497-F510 HydrophobicContact CE2-CE1 4.5Å; Y497-F510 HydrophobicContact CE2-CZ 4.25Å; R501-F510 PolarHBondContact O-N 3.41Å; P503-F510 HydrophobicContact CG-CB 4.03Å; P503-F510 HydrophobicContact CG-CD1 3.97Å; P503-F510 HydrophobicContact CG-CG 3.96Å; F510-H562 AromaticContact CZ-CE1 3.78Å; F510-V564 HydrophobicContact CD2-CG1 3.95Å; F510-V564 HydrophobicContact CE2-CB 4.39Å; F510-V564 HydrophobicContact CE2-CG1 3.43Å; F510-V564 VanDerWaalsContact CE2-CG1 3.43Å; F510-V564 HydrophobicContact CE2-CG2 4.15Å; F510-V564 HydrophobicContact CZ-CG1 4.44Å; F510-V564 HydrophobicContact CZ-CG2 4.44Å; F510-R566 VanDerWaalsContact CB-NH1 3.3Å
511	E	89.4	Confident	86.1	Confident	22 Å²	22	35.7 Å²	35.7	10%	0.103	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.3	172.4	-62.2	177	158.8	0	0	107.9	A489 R509 V564 C565 R665	A489-E511 HydrophobicContact CB-CG 4.28Å; R509-E511 IonicContact CZ-OE1 3.02Å; R509-E511 IonicContact NE-OE1 3.88Å; R509-E511 PolarHBondContact NE-OE1 3.17Å; R509-E511 IonicContact NH2-OE1 3.6Å; R509-E511 PolarHBondContact NH2-OE1 3.33Å; E511-V564 WeakPolarHBondContact O-CA 3.36Å; E511-C565 HydrophobicContact CB-CB 4.28Å; E511-C565 PolarHBondContact N-O 3.02Å; E511-C565 PolarHBondContact O-N 3.44Å; E511-R665 IonicContact OE2-NH1 3.42Å
512	G	90.6	Very high	87.5	Confident	5 Å²	5	28.9 Å²	28.9	5%	0.052	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.9	-175.8	0	0	0	0	0	110.9	S495 H562 L563	S495-G512 PolarHBondContact N-O 3.23Å; G512-H562 WeakPolarHBondContact CA-NE2 3.38Å; G512-L563 CarbonylContact C-O 3.49Å; G512-L563 WeakPolarHBondContact CA-O 3.3Å
513	L	92.8	Very high	88.6	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	119.2	-179.8	-178.7	65.5	0	0	0	109.7	L484 A488 K517 A518 L521 L563	L484-L513 HydrophobicContact CD1-CD2 4.4Å; L484-L513 HydrophobicContact CD2-CD2 4.14Å; L484-L513 HydrophobicContact CG-CD2 3.92Å; A488-L513 HydrophobicContact CB-CD1 3.93Å; A488-L513 HydrophobicContact CB-CD2 3.74Å; A488-L513 HydrophobicContact CB-CG 4.37Å; L513-K517 HydrophobicContact CD1-CB 4.04Å; L513-K517 HydrophobicContact CD1-CG 3.98Å; L513-A518 HydrophobicContact CD1-CB 4.27Å; L513-A518 HydrophobicContact CD2-CB 3.9Å; L513-A518 HydrophobicContact CG-CB 4.05Å; L513-L521 HydrophobicContact CD1-CD1 4.1Å; L513-L563 HydrophobicContact CB-CB 4.29Å; L513-L563 HydrophobicContact CD2-CD2 4.23Å; L513-L563 PolarHBondContact N-O 3.12Å; L513-L563 PolarHBondContact O-N 3.43Å
514	T	94.1	Very high	89.7	Confident	6 Å²	6	36.5 Å²	36.5	4%	0.037	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	159.7	172.3	57.5	0	0	0	0	110.8	S495 L516 K517 A518 F560 E683	S495-T514 VanDerWaalsContact OG-CG2 3.22Å; S495-T514 WeakPolarHBondContact OG-CG2 3.37Å; T514-L516 PolarHBondContact O-N 3.35Å; T514-K517 PolarHBondContact O-N 3.09Å; T514-A518 PolarHBondContact O-N 3.14Å; T514-F560 HydrophobicContact CG2-CE2 4.03Å; T514-F560 HydrophobicContact CG2-CZ 3.88Å; T514-E683 VanDerWaalsContact CB-OE2 3.31Å; T514-E683 WeakPolarHBondContact CB-OE2 3.4Å; T514-E683 PolarHBondContact OG1-OE2 3.1Å
515	V	94.5	Very high	90.3	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-45.6	-178.2	-69.1	0	0	0	0	112.6	K517 A518 A519 L535 L536 T561 E683 W684 A687	V515-K517 VanDerWaalsContact C-N 3.33Å; V515-K517 PolarHBondContact O-N 3.43Å; V515-A518 WeakPolarHBondContact O-CB 3.47Å; V515-A518 PolarHBondContact O-N 3.41Å; V515-A519 PolarHBondContact O-N 3.2Å; V515-L535 HydrophobicContact CG1-CD2 4.11Å; V515-L535 HydrophobicContact CG1-CG 4.16Å; V515-L536 HydrophobicContact CB-CD2 3.84Å; V515-L536 HydrophobicContact CG1-CD2 4.06Å; V515-T561 HydrophobicContact CG1-CG2 3.54Å; V515-E683 HydrophobicContact CG2-CB 4.25Å; V515-W684 HydrophobicContact CG2-CB 4.08Å; V515-A687 HydrophobicContact CB-CB 4.31Å; V515-A687 HydrophobicContact CG2-CB 4.44Å
516	L	93.6	Very high	90.7	Very high	18 Å²	18	39.9 Å²	39.9	9%	0.094	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-41.6	176.7	179.9	58.9	0	0	0	111.6	T514 A518 A519 Q520 E683 E686 L690	T514-L516 PolarHBondContact O-N 3.35Å; L516-A518 VanDerWaalsContact C-N 3.33Å; L516-A518 PolarHBondContact O-N 2.87Å; L516-A519 PolarHBondContact O-N 2.94Å; L516-Q520 HydrophobicContact CD1-CG 4.39Å; L516-Q520 VanDerWaalsContact O-CG 3.29Å; L516-Q520 WeakPolarHBondContact O-CG 3.49Å; L516-Q520 PolarHBondContact O-N 3.12Å; L516-E683 HydrophobicContact CB-CB 3.82Å; L516-E683 HydrophobicContact CB-CG 4.06Å; L516-E683 HydrophobicContact CD2-CB 4.37Å; L516-E683 HydrophobicContact CD2-CG 3.92Å; L516-E686 HydrophobicContact CD1-CB 3.89Å; L516-E686 WeakPolarHBondContact CD2-OE2 3.01Å; L516-L690 HydrophobicContact CD1-CD1 3.53Å
517	K	92.4	Very high	91	Very high	75 Å²	75	36.2 Å²	36.2	33%	0.326	20%	0.199	S	C	.	.	H	α-helix	trans	-66.7	-37.2	178.5	-171.1	59.3	-180	174.6	0	111.9	A493 L513 T514 V515 L521	A493-K517 HydrophobicContact CB-CG 4.27Å; L513-K517 HydrophobicContact CD1-CB 4.04Å; L513-K517 HydrophobicContact CD1-CG 3.98Å; T514-K517 PolarHBondContact O-N 3.09Å; V515-K517 VanDerWaalsContact C-N 3.33Å; V515-K517 PolarHBondContact O-N 3.43Å; K517-L521 HydrophobicContact CG-CD1 4.26Å; K517-L521 VanDerWaalsContact O-CG 3.23Å; K517-L521 WeakPolarHBondContact O-CG 3.4Å; K517-L521 PolarHBondContact O-N 3.31Å
518	A	94	Very high	91	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-46.1	174.2	0	0	0	0	0	111.5	L513 T514 V515 L516 L521 A522 A532 L535	L513-A518 HydrophobicContact CD1-CB 4.27Å; L513-A518 HydrophobicContact CD2-CB 3.9Å; L513-A518 HydrophobicContact CG-CB 4.05Å; T514-A518 PolarHBondContact O-N 3.14Å; V515-A518 WeakPolarHBondContact O-CB 3.47Å; V515-A518 PolarHBondContact O-N 3.41Å; L516-A518 VanDerWaalsContact C-N 3.33Å; L516-A518 PolarHBondContact O-N 2.87Å; A518-L521 PolarHBondContact O-N 2.92Å; A518-A522 WeakPolarHBondContact O-CB 3.41Å; A518-A522 PolarHBondContact O-N 2.94Å; A518-A532 HydrophobicContact CB-CB 4.27Å; A518-L535 HydrophobicContact CB-CD2 3.85Å
519	A	94	Very high	91	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-45.5	176.4	0	0	0	0	0	112.4	V515 L516 L521 A522 R523 A687 L690 L691	V515-A519 PolarHBondContact O-N 3.2Å; L516-A519 PolarHBondContact O-N 2.94Å; A519-L521 VanDerWaalsContact C-N 3.35Å; A519-L521 PolarHBondContact O-N 3.03Å; A519-A522 WeakPolarHBondContact O-CB 3.06Å; A519-A522 PolarHBondContact O-N 2.92Å; A519-R523 PolarHBondContact O-N 3.46Å; A519-A687 HydrophobicContact CB-CB 3.86Å; A519-L690 HydrophobicContact CB-CB 4.48Å; A519-L691 HydrophobicContact CB-CD1 4.02Å; A519-L691 HydrophobicContact CB-CD2 4.27Å; A519-L691 HydrophobicContact CB-CG 3.85Å
520	Q	93	Very high	91.2	Very high	84 Å²	84	40.8 Å²	40.8	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-60.3	-41.6	176.2	-72.6	172.9	-4.2	0	0	112.9	L516 A522 A524 L690	L516-Q520 HydrophobicContact CD1-CG 4.39Å; L516-Q520 VanDerWaalsContact O-CG 3.29Å; L516-Q520 WeakPolarHBondContact O-CG 3.49Å; L516-Q520 PolarHBondContact O-N 3.12Å; Q520-A522 VanDerWaalsContact C-N 3.33Å; Q520-A524 WeakPolarHBondContact O-CB 3.02Å; Q520-A524 PolarHBondContact O-N 2.91Å; Q520-L690 HydrophobicContact CG-CD1 4.35Å
521	L	92.1	Very high	91.5	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-34.2	177.5	-69.6	168.9	0	0	0	111.8	A488 A493 L513 K517 A518 A519 A524 G525 T526 V527	A488-L521 HydrophobicContact CB-CD1 3.95Å; A493-L521 HydrophobicContact CB-CD1 3.55Å; A493-L521 HydrophobicContact CB-CD2 4.48Å; L513-L521 HydrophobicContact CD1-CD1 4.1Å; K517-L521 HydrophobicContact CG-CD1 4.26Å; K517-L521 VanDerWaalsContact O-CG 3.23Å; K517-L521 WeakPolarHBondContact O-CG 3.4Å; K517-L521 PolarHBondContact O-N 3.31Å; A518-L521 PolarHBondContact O-N 2.92Å; A519-L521 VanDerWaalsContact C-N 3.35Å; A519-L521 PolarHBondContact O-N 3.03Å; L521-A524 PolarHBondContact O-N 3.23Å; L521-G525 PolarHBondContact O-N 2.81Å; L521-T526 HydrophobicContact CD2-CG2 4.11Å; L521-T526 WeakPolarHBondContact O-CB 3.34Å; L521-T526 PolarHBondContact O-N 3.46Å; L521-V527 HydrophobicContact CB-CB 4.44Å; L521-V527 HydrophobicContact CB-CG1 4.08Å; L521-V527 HydrophobicContact CB-CG2 3.62Å; L521-V527 HydrophobicContact CD1-CG1 4.32Å; L521-V527 PolarHBondContact O-N 3.36Å
522	A	92.8	Very high	91.7	Very high	11 Å²	11	39.6 Å²	39.6	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-48.8	176.3	0	0	0	0	0	110.9	A518 A519 Q520 A524 G525 V527 A532 L691	A518-A522 WeakPolarHBondContact O-CB 3.41Å; A518-A522 PolarHBondContact O-N 2.94Å; A519-A522 WeakPolarHBondContact O-CB 3.06Å; A519-A522 PolarHBondContact O-N 2.92Å; Q520-A522 VanDerWaalsContact C-N 3.33Å; A522-A524 PolarHBondContact O-N 2.77Å; A522-G525 WeakPolarHBondContact O-CA 3.26Å; A522-G525 PolarHBondContact O-N 3.17Å; A522-V527 WeakPolarHBondContact CA-O 3.44Å; A522-V527 HydrophobicContact CB-CG2 4.08Å; A522-A532 HydrophobicContact CB-CB 3.8Å; A522-L691 HydrophobicContact CB-CD2 4.05Å
523	R	89.7	Confident	91.9	Very high	153 Å²	153	41.4 Å²	41.4	58%	0.577	24%	0.243	S	C	*	.	H	α-helix	trans	-59.8	-32.7	174.2	-179.2	174.6	156.6	176.8	-1	112.8	A519 G525	A519-R523 PolarHBondContact O-N 3.46Å; R523-G525 PolarHBondContact O-N 3.36Å
524	A	88.9	Confident	92.1	Very high	71 Å²	71	41.9 Å²	41.9	59%	0.587	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	4.5	173.9	0	0	0	0	0	114	Q520 L521 A522 T526	Q520-A524 WeakPolarHBondContact O-CB 3.02Å; Q520-A524 PolarHBondContact O-N 2.91Å; L521-A524 PolarHBondContact O-N 3.23Å; A522-A524 PolarHBondContact O-N 2.77Å; A524-T526 PolarHBondContact O-N 3.26Å; A524-T526 VanDerWaalsContact O-N 3.11Å; A524-T526 PolarHBondContact O-OG1 3.48Å
525	G	88.1	Confident	92.2	Very high	68 Å²	68	41.7 Å²	41.7	70%	0.701	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	12.9	-177.2	0	0	0	0	0	114.5	L521 A522 R523	L521-G525 PolarHBondContact O-N 2.81Å; A522-G525 WeakPolarHBondContact O-CA 3.26Å; A522-G525 PolarHBondContact O-N 3.17Å; R523-G525 PolarHBondContact O-N 3.36Å
526	T	88.1	Confident	92.3	Very high	69 Å²	69	42.2 Å²	42.2	42%	0.423	25%	0.247	S	C	.	.	S	Bend	trans	-85.2	-28.7	-174.8	-55.6	0	0	0	0	112	A491 L521 A524	A491-T526 HydrophobicContact CB-CG2 3.42Å; A491-T526 VanDerWaalsContact CB-CG2 3.42Å; L521-T526 HydrophobicContact CD2-CG2 4.11Å; L521-T526 WeakPolarHBondContact O-CB 3.34Å; L521-T526 PolarHBondContact O-N 3.46Å; A524-T526 PolarHBondContact O-N 3.26Å; A524-T526 VanDerWaalsContact O-N 3.11Å; A524-T526 PolarHBondContact O-OG1 3.48Å
527	V	90.1	Very high	92.3	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.055	27%	0.268	C	S	.	.	S	Bend	trans	-130.6	160	171.3	-56.2	0	0	0	0	109.1	L484 D487 A488 L521 A522	L484-V527 HydrophobicContact CD1-CB 3.82Å; L484-V527 HydrophobicContact CD1-CG1 4.32Å; L484-V527 HydrophobicContact CD1-CG2 3.62Å; D487-V527 HydrophobicContact CB-CG1 3.89Å; A488-V527 HydrophobicContact CB-CG1 4.27Å; L521-V527 HydrophobicContact CB-CB 4.44Å; L521-V527 HydrophobicContact CB-CG1 4.08Å; L521-V527 HydrophobicContact CB-CG2 3.62Å; L521-V527 HydrophobicContact CD1-CG1 4.32Å; L521-V527 PolarHBondContact O-N 3.36Å; A522-V527 WeakPolarHBondContact CA-O 3.44Å; A522-V527 HydrophobicContact CB-CG2 4.08Å
528	G	86.8	Confident	92.4	Very high	47 Å²	47	43.1 Å²	43.1	49%	0.485	25%	0.252	S	S	.	.			trans	-67.5	132.2	178.7	0	0	0	0	0	113	Q530 G531 A532	G528-Q530 VanDerWaalsContact C-N 3.28Å; G528-Q530 PolarHBondContact O-N 3Å; G528-G531 PolarHBondContact O-N 2.89Å; G528-G531 VanDerWaalsContact O-N 3.1Å; G528-A532 PolarHBondContact O-N 3.1Å
529	S	89.4	Confident	92.5	Very high	41 Å²	41	43.1 Å²	43.1	29%	0.287	25%	0.252	S	S	.	.	H	α-helix	trans	-57.9	-38.6	177.1	58.7	0	0	0	0	112.6	G531 A532 K533	S529-G531 VanDerWaalsContact C-N 3.26Å; S529-G531 PolarHBondContact O-N 3.36Å; S529-A532 PolarHBondContact O-N 3.36Å; S529-K533 WeakPolarHBondContact O-CG 3.45Å; S529-K533 PolarHBondContact O-N 3.05Å
530	Q	92.8	Very high	92.4	Very high	141 Å²	141	45.5 Å²	45.5	66%	0.659	26%	0.263	S	S	*	.	H	α-helix	trans	-54	-40.4	174.8	-171.7	-178.4	17.6	0	0	112.8	G528 L534	G528-Q530 VanDerWaalsContact C-N 3.28Å; G528-Q530 PolarHBondContact O-N 3Å; Q530-L534 VanDerWaalsContact O-CB 3.3Å; Q530-L534 WeakPolarHBondContact O-CB 3.35Å; Q530-L534 PolarHBondContact O-N 2.94Å
531	G	93.9	Very high	92.3	Very high	5 Å²	5	44.7 Å²	44.7	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-69.9	-41.6	179.8	0	0	0	0	0	112.5	L484 G528 S529 L534 L535	L484-G531 WeakPolarHBondContact CD2-O 3.37Å; G528-G531 PolarHBondContact O-N 2.89Å; G528-G531 VanDerWaalsContact O-N 3.1Å; S529-G531 VanDerWaalsContact C-N 3.26Å; S529-G531 PolarHBondContact O-N 3.36Å; G531-L534 PolarHBondContact O-N 3.2Å; G531-L535 PolarHBondContact O-N 3.15Å
532	A	94.6	Very high	92.3	Very high	2 Å²	2	44 Å²	44	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-39.7	178	0	0	0	0	0	112	A518 A522 G528 S529 L535 L536 L691	A518-A532 HydrophobicContact CB-CB 4.27Å; A522-A532 HydrophobicContact CB-CB 3.8Å; G528-A532 PolarHBondContact O-N 3.1Å; S529-A532 PolarHBondContact O-N 3.36Å; A532-L535 WeakPolarHBondContact O-CB 3.3Å; A532-L535 PolarHBondContact O-N 2.63Å; A532-L536 PolarHBondContact O-N 3.5Å; A532-L691 HydrophobicContact CB-CD1 3.93Å; A532-L691 HydrophobicContact CB-CD2 4.25Å
533	K	95.2	Very high	92.3	Very high	43 Å²	43	45.3 Å²	45.3	19%	0.187	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-49.3	173.6	-68.7	173.8	-173.2	175.9	0	111.3	S529 L535 L536 E537 L691 E695	S529-K533 WeakPolarHBondContact O-CG 3.45Å; S529-K533 PolarHBondContact O-N 3.05Å; K533-L535 PolarHBondContact O-N 2.92Å; K533-L536 PolarHBondContact O-N 3.22Å; K533-E537 PolarHBondContact O-N 3.26Å; K533-L691 HydrophobicContact CG-CB 4.48Å; K533-L691 HydrophobicContact CG-CD1 4.07Å; K533-E695 WeakPolarHBondContact CD-OE1 3.42Å; K533-E695 WeakPolarHBondContact CE-OE1 3.4Å; K533-E695 IonicContact NZ-OE1 2.78Å; K533-E695 PolarHBondContact NZ-OE1 2.87Å
534	L	96.3	Very high	92	Very high	16 Å²	16	40.9 Å²	40.9	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-36.4	176.8	-177.4	63.9	0	0	0	112.1	E477 V480 L481 Q530 G531 L536 E537 V538	E477-L534 HydrophobicContact CB-CD2 3.97Å; E477-L534 HydrophobicContact CG-CD1 4.08Å; E477-L534 HydrophobicContact CG-CD2 4.16Å; V480-L534 HydrophobicContact CB-CD2 3.82Å; V480-L534 HydrophobicContact CG1-CD2 3.75Å; L481-L534 HydrophobicContact CD2-CB 4.29Å; L481-L534 HydrophobicContact CD2-CD2 4.1Å; L481-L534 HydrophobicContact CD2-CG 4.07Å; L481-L534 HydrophobicContact CG-CD2 3.91Å; L481-L534 HydrophobicContact CG-CG 4.26Å; Q530-L534 VanDerWaalsContact O-CB 3.3Å; Q530-L534 WeakPolarHBondContact O-CB 3.35Å; Q530-L534 PolarHBondContact O-N 2.94Å; G531-L534 PolarHBondContact O-N 3.2Å; L534-L536 VanDerWaalsContact C-N 3.35Å; L534-L536 PolarHBondContact O-N 3.27Å; L534-E537 PolarHBondContact O-N 2.86Å; L534-V538 HydrophobicContact CD1-CG2 3.76Å; L534-V538 HydrophobicContact CG-CG2 4.04Å; L534-V538 VanDerWaalsContact O-CB 3.26Å; L534-V538 WeakPolarHBondContact O-CB 3.26Å; L534-V538 WeakPolarHBondContact O-CG2 3.32Å; L534-V538 PolarHBondContact O-N 3.25Å
535	L	96.7	Very high	91.6	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-42	176.1	-178.3	64	0	0	0	111.8	L481 L484 V515 A518 G531 A532 K533 S539 L563 L669	L481-L535 HydrophobicContact CD2-CB 4.05Å; L481-L535 HydrophobicContact CD2-CD1 4.36Å; L484-L535 HydrophobicContact CD2-CB 4.24Å; L484-L535 HydrophobicContact CD2-CD2 4.17Å; V515-L535 HydrophobicContact CG1-CD2 4.11Å; V515-L535 HydrophobicContact CG1-CG 4.16Å; A518-L535 HydrophobicContact CB-CD2 3.85Å; G531-L535 PolarHBondContact O-N 3.15Å; A532-L535 WeakPolarHBondContact O-CB 3.3Å; A532-L535 PolarHBondContact O-N 2.63Å; K533-L535 PolarHBondContact O-N 2.92Å; L535-S539 WeakPolarHBondContact O-CB 3.16Å; L535-S539 PolarHBondContact O-N 2.98Å; L535-S539 VanDerWaalsContact O-N 3.17Å; L535-S539 PolarHBondContact O-OG 3.28Å; L535-L563 HydrophobicContact CD1-CB 4.31Å; L535-L563 HydrophobicContact CD1-CD2 4.49Å; L535-L669 HydrophobicContact CD1-CD1 3.54Å; L535-L669 HydrophobicContact CD1-CD2 4.14Å; L535-L669 HydrophobicContact CD1-CG 4.47Å
536	L	95.3	Very high	91.5	Very high	14 Å²	14	34.5 Å²	34.5	7%	0.073	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-46.5	177.1	-67.6	179.8	0	0	0	111.9	V515 A532 K533 L534 V538 S539 E540 W684 A687 K688 L691	V515-L536 HydrophobicContact CB-CD2 3.84Å; V515-L536 HydrophobicContact CG1-CD2 4.06Å; A532-L536 PolarHBondContact O-N 3.5Å; K533-L536 PolarHBondContact O-N 3.22Å; L534-L536 VanDerWaalsContact C-N 3.35Å; L534-L536 PolarHBondContact O-N 3.27Å; L536-V538 PolarHBondContact O-N 3.48Å; L536-S539 WeakPolarHBondContact O-CB 2.88Å; L536-S539 PolarHBondContact O-N 3.31Å; L536-E540 PolarHBondContact O-N 3.44Å; L536-W684 HydrophobicContact CB-CZ2 4.31Å; L536-W684 HydrophobicContact CD2-CD2 4.24Å; L536-W684 HydrophobicContact CD2-CG 4.03Å; L536-A687 HydrophobicContact CD1-CB 4.3Å; L536-A687 HydrophobicContact CD2-CB 3.94Å; L536-K688 HydrophobicContact CD1-CB 4.09Å; L536-L691 HydrophobicContact CD1-CD1 3.73Å; L536-L691 HydrophobicContact CG-CD1 4.49Å
537	E	94.2	Very high	91.2	Very high	113 Å²	113	33.2 Å²	33.2	53%	0.528	18%	0.175	S	C	.	.	H	α-helix	trans	-59.2	-46.7	178.6	-70.3	175.7	-175.8	0	0	111.8	K533 L534 S539 E540 R541	K533-E537 PolarHBondContact O-N 3.26Å; L534-E537 PolarHBondContact O-N 2.86Å; E537-S539 VanDerWaalsContact C-N 3.27Å; E537-S539 PolarHBondContact O-N 3.42Å; E537-E540 PolarHBondContact O-N 3.29Å; E537-R541 WeakPolarHBondContact O-CG 3.5Å; E537-R541 PolarHBondContact O-N 2.85Å
538	V	95.6	Very high	90.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-34.6	179.6	169.9	0	0	0	0	111.3	L473 L481 L534 L536 R541 V542 L613 L669	L473-V538 HydrophobicContact CD1-CG1 4.46Å; L473-V538 HydrophobicContact CD2-CB 4.34Å; L473-V538 HydrophobicContact CD2-CG1 3.9Å; L473-V538 HydrophobicContact CD2-CG2 3.43Å; L473-V538 VanDerWaalsContact CD2-CG2 3.43Å; L481-V538 HydrophobicContact CD1-CG2 4.43Å; L534-V538 HydrophobicContact CD1-CG2 3.76Å; L534-V538 HydrophobicContact CG-CG2 4.04Å; L534-V538 VanDerWaalsContact O-CB 3.26Å; L534-V538 WeakPolarHBondContact O-CB 3.26Å; L534-V538 WeakPolarHBondContact O-CG2 3.32Å; L534-V538 PolarHBondContact O-N 3.25Å; L536-V538 PolarHBondContact O-N 3.48Å; V538-R541 PolarHBondContact O-N 3.47Å; V538-V542 WeakPolarHBondContact O-CG2 3.37Å; V538-V542 PolarHBondContact O-N 3.28Å; V538-L613 HydrophobicContact CG1-CD2 3.27Å; V538-L669 HydrophobicContact CG1-CD2 3.93Å
539	S	95.6	Very high	89.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-43.2	175.8	-55.2	0	0	0	0	111.8	L535 L536 E537 V542 R543 T561	L535-S539 WeakPolarHBondContact O-CB 3.16Å; L535-S539 PolarHBondContact O-N 2.98Å; L535-S539 VanDerWaalsContact O-N 3.17Å; L535-S539 PolarHBondContact O-OG 3.28Å; L536-S539 WeakPolarHBondContact O-CB 2.88Å; L536-S539 PolarHBondContact O-N 3.31Å; E537-S539 VanDerWaalsContact C-N 3.27Å; E537-S539 PolarHBondContact O-N 3.42Å; S539-V542 PolarHBondContact O-N 3.13Å; S539-R543 PolarHBondContact O-N 3.34Å; S539-T561 VanDerWaalsContact OG-CG2 3.24Å; S539-T561 WeakPolarHBondContact OG-CG2 3.45Å
540	E	91.8	Very high	89	Confident	51 Å²	51	32 Å²	32	24%	0.238	15%	0.153	C	C	.	.	H	α-helix	trans	-69.1	-34.9	174.7	-81	-65	157.9	0	0	113.3	L536 E537 R543 T544 W684	L536-E540 PolarHBondContact O-N 3.44Å; E537-E540 PolarHBondContact O-N 3.29Å; E540-R543 PolarHBondContact O-N 3.47Å; E540-R543 WeakPolarHBondContact OE2-CD 3.13Å; E540-R543 IonicContact OE2-CZ 2.83Å; E540-R543 IonicContact OE2-NE 3.71Å; E540-R543 PolarHBondContact OE2-NE 3.43Å; E540-R543 IonicContact OE2-NH2 3.94Å; E540-T544 VanDerWaalsContact O-CB 3.29Å; E540-T544 WeakPolarHBondContact O-CB 3.27Å; E540-T544 PolarHBondContact O-N 3.13Å; E540-T544 PolarHBondContact O-OG1 2.92Å; E540-W684 HydrophobicContact CG-CH2 3.87Å; E540-W684 HydrophobicContact CG-CZ2 3.36Å
541	R	89.8	Confident	87.8	Confident	67 Å²	67	25.6 Å²	25.6	25%	0.253	12%	0.123	S	C	.	.	H	α-helix	trans	-61.5	-44	172.9	-71.5	172.6	74.2	-174.6	2.5	111.3	L472 E477 E537 V538 L545	L472-R541 HydrophobicContact CD1-CB 4.27Å; L472-R541 VanDerWaalsContact O-CZ 3.29Å; L472-R541 PolarHBondContact O-NH2 3.41Å; E477-R541 IonicContact OE1-NH1 3.71Å; E477-R541 PolarHBondContact OE1-NH1 2.89Å; E537-R541 WeakPolarHBondContact O-CG 3.5Å; E537-R541 PolarHBondContact O-N 2.85Å; V538-R541 PolarHBondContact O-N 3.47Å; R541-L545 PolarHBondContact O-N 3.48Å
542	V	93.6	Very high	86.1	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-46	176.1	175.7	0	0	0	0	111.4	L472 V538 S539 T544 L545 T546 L613 L645 L671	L472-V542 HydrophobicContact CD2-CG2 3.53Å; V538-V542 WeakPolarHBondContact O-CG2 3.37Å; V538-V542 PolarHBondContact O-N 3.28Å; S539-V542 PolarHBondContact O-N 3.13Å; V542-T544 VanDerWaalsContact C-N 3.34Å; V542-T544 PolarHBondContact O-N 2.98Å; V542-L545 PolarHBondContact O-N 3.45Å; V542-T546 WeakPolarHBondContact O-CB 3.47Å; V542-T546 PolarHBondContact O-N 3Å; V542-T546 PolarHBondContact O-OG1 3.43Å; V542-L613 HydrophobicContact CG2-CB 4.3Å; V542-L613 HydrophobicContact CG2-CD2 3.86Å; V542-L645 HydrophobicContact CG1-CD1 3.73Å; V542-L645 HydrophobicContact CG1-CD2 4Å; V542-L645 HydrophobicContact CG2-CD1 4.3Å; V542-L645 HydrophobicContact CG2-CD2 4.5Å; V542-L671 HydrophobicContact CB-CD1 4.24Å; V542-L671 HydrophobicContact CB-CD2 4.11Å; V542-L671 HydrophobicContact CG1-CD1 3.93Å; V542-L671 HydrophobicContact CG1-CD2 4.33Å; V542-L671 HydrophobicContact CG2-CD1 4.14Å
543	R	92.4	Very high	84.4	Confident	39 Å²	39	33.4 Å²	33.4	15%	0.147	16%	0.162	C	C	.	.	H	α-helix	trans	-57.4	-47.6	177	-176.6	-145.7	70.4	75.8	8.3	111.4	S539 E540 L545 T546 Q547 L556 L558 H673	S539-R543 PolarHBondContact O-N 3.34Å; E540-R543 PolarHBondContact O-N 3.47Å; E540-R543 WeakPolarHBondContact OE2-CD 3.13Å; E540-R543 IonicContact OE2-CZ 2.83Å; E540-R543 IonicContact OE2-NE 3.71Å; E540-R543 PolarHBondContact OE2-NE 3.43Å; E540-R543 IonicContact OE2-NH2 3.94Å; R543-L545 PolarHBondContact O-N 3.41Å; R543-T546 PolarHBondContact O-N 3.02Å; R543-Q547 WeakPolarHBondContact O-CB 3.5Å; R543-Q547 PolarHBondContact O-N 3.43Å; R543-L556 VanDerWaalsContact CD-O 3.3Å; R543-L556 WeakPolarHBondContact CD-O 3.43Å; R543-L556 PolarHBondContact NH1-O 3.43Å; R543-L558 HydrophobicContact CB-CD2 4Å; R543-L558 HydrophobicContact CB-CG 4.09Å; R543-L558 HydrophobicContact CG-CD2 4.44Å; R543-L558 HydrophobicContact CG-CG 4.19Å; R543-H673 WeakPolarHBondContact CA-NE2 3.38Å
544	T	82.6	Confident	83.3	Confident	60 Å²	60	35.6 Å²	35.6	37%	0.368	17%	0.169	S	C	.	.	H	α-helix	trans	-61.9	-43.9	-179.9	-58	0	0	0	0	111.5	E540 V542 Q547 A548	E540-T544 VanDerWaalsContact O-CB 3.29Å; E540-T544 WeakPolarHBondContact O-CB 3.27Å; E540-T544 PolarHBondContact O-N 3.13Å; E540-T544 PolarHBondContact O-OG1 2.92Å; V542-T544 VanDerWaalsContact C-N 3.34Å; V542-T544 PolarHBondContact O-N 2.98Å; T544-Q547 PolarHBondContact O-N 3.32Å; T544-A548 VanDerWaalsContact O-CB 3.26Å; T544-A548 WeakPolarHBondContact O-CB 3.45Å; T544-A548 PolarHBondContact O-N 3.3Å
545	L	81.9	Confident	82.5	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-43.9	175.3	-83.4	172.8	0	0	0	113	L447 L449 V452 L472 R541 V542 R543 Q547 A548 Y549 L645	L447-L545 HydrophobicContact CD2-CD2 3.77Å; L449-L545 HydrophobicContact CB-CD2 4.48Å; L449-L545 HydrophobicContact CD1-CD1 3.95Å; L449-L545 HydrophobicContact CD1-CD2 3.36Å; L449-L545 HydrophobicContact CD1-CG 3.36Å; L449-L545 HydrophobicContact CG-CD2 4.49Å; V452-L545 HydrophobicContact CG1-CD1 4.2Å; V452-L545 HydrophobicContact CG1-CD2 4.44Å; V452-L545 HydrophobicContact CG2-CD1 4.39Å; L472-L545 HydrophobicContact CD1-CD1 3.31Å; L472-L545 HydrophobicContact CD2-CD1 4.09Å; L472-L545 HydrophobicContact CG-CD1 4.27Å; R541-L545 PolarHBondContact O-N 3.48Å; V542-L545 PolarHBondContact O-N 3.45Å; R543-L545 PolarHBondContact O-N 3.41Å; L545-Q547 VanDerWaalsContact C-N 3.3Å; L545-Q547 PolarHBondContact O-N 2.88Å; L545-A548 PolarHBondContact O-N 2.94Å; L545-Y549 WeakPolarHBondContact O-CB 3.44Å; L545-Y549 PolarHBondContact O-N 3.22Å; L545-L645 HydrophobicContact CB-CD2 4.43Å; L545-L645 HydrophobicContact CD1-CD2 4.37Å
546	T	85.7	Confident	82	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-42.2	179.6	-54.6	0	0	0	0	110.1	V542 R543 Y549 F550 Y609	V542-T546 WeakPolarHBondContact O-CB 3.47Å; V542-T546 PolarHBondContact O-N 3Å; V542-T546 PolarHBondContact O-OG1 3.43Å; R543-T546 PolarHBondContact O-N 3.02Å; T546-Y549 PolarHBondContact O-N 3.1Å; T546-F550 HydrophobicContact CG2-CD2 3.95Å; T546-F550 HydrophobicContact CG2-CE2 4.5Å; T546-F550 PolarHBondContact O-N 2.86Å; T546-Y609 HydrophobicContact CG2-CG 4.15Å
547	Q	80.6	Confident	81.9	Confident	42 Å²	42	39.9 Å²	39.9	20%	0.196	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-48.9	173	-169.6	-175.7	-55.8	0	0	112.5	R543 T544 L545 Y549 S551 P552 L556	R543-Q547 WeakPolarHBondContact O-CB 3.5Å; R543-Q547 PolarHBondContact O-N 3.43Å; T544-Q547 PolarHBondContact O-N 3.32Å; L545-Q547 VanDerWaalsContact C-N 3.3Å; L545-Q547 PolarHBondContact O-N 2.88Å; Q547-Y549 PolarHBondContact O-N 3.16Å; Q547-S551 VanDerWaalsContact CG-O 3.24Å; Q547-S551 WeakPolarHBondContact CG-O 3.5Å; Q547-S551 CarbonylContact O-C 3.59Å; Q547-S551 WeakPolarHBondContact O-CA 3.22Å; Q547-S551 PolarHBondContact O-N 2.7Å; Q547-P552 VanDerWaalsContact O-N 3.14Å; Q547-L556 HydrophobicContact CB-CB 4.13Å; Q547-L556 HydrophobicContact CB-CD1 4Å; Q547-L556 HydrophobicContact CG-CB 4.27Å; Q547-L556 HydrophobicContact CG-CD1 4.3Å
548	A	70.9	Confident	82	Confident	16 Å²	16	34.7 Å²	34.7	13%	0.132	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-31.9	-179.5	0	0	0	0	0	112.5	W443 V446 L447 T544 L545	W443-A548 WeakPolarHBondContact CZ3-O 3.23Å; V446-A548 HydrophobicContact CG1-CB 4.27Å; L447-A548 HydrophobicContact CD2-CB 4.08Å; T544-A548 VanDerWaalsContact O-CB 3.26Å; T544-A548 WeakPolarHBondContact O-CB 3.45Å; T544-A548 PolarHBondContact O-N 3.3Å; L545-A548 PolarHBondContact O-N 2.94Å
549	Y	72.9	Confident	81.9	Confident	30 Å²	30	35.2 Å²	35.2	12%	0.118	18%	0.175	C	C	.	.	H	α-helix	trans	-88.3	-42.1	-178	-169.8	-88.6	0	0	0	113.7	W443 L447 L454 A467 L545 T546 Q547	W443-Y549 VanDerWaalsContact CH2-O 3.27Å; W443-Y549 WeakPolarHBondContact CH2-O 3.31Å; W443-Y549 WeakPolarHBondContact CZ3-O 3.35Å; L447-Y549 HydrophobicContact CD1-CD2 4.38Å; L454-Y549 HydrophobicContact CD1-CE2 3.94Å; L454-Y549 HydrophobicContact CD2-CE2 4.08Å; A467-Y549 HydrophobicContact CB-CD1 4.25Å; A467-Y549 HydrophobicContact CB-CE1 3.65Å; A467-Y549 HydrophobicContact CB-CE2 4.32Å; L545-Y549 WeakPolarHBondContact O-CB 3.44Å; L545-Y549 PolarHBondContact O-N 3.22Å; T546-Y549 PolarHBondContact O-N 3.1Å; Q547-Y549 PolarHBondContact O-N 3.16Å
550	F	76.3	Confident	82	Confident	26 Å²	26	38 Å²	38	11%	0.114	19%	0.187	C	C	.	.	H	α-helix	trans	-107.5	-27.7	-173.7	-63.8	-68.4	0	0	0	114.5	E465 A467 T546 Y609 A647	E465-F550 HydrophobicContact CB-CD1 4.27Å; E465-F550 HydrophobicContact CB-CE1 4.11Å; E465-F550 WeakPolarHBondContact O-CE1 3.25Å; A467-F550 HydrophobicContact CB-CZ 4.21Å; T546-F550 HydrophobicContact CG2-CD2 3.95Å; T546-F550 HydrophobicContact CG2-CE2 4.5Å; T546-F550 PolarHBondContact O-N 2.86Å; F550-Y609 HydrophobicContact CB-CD1 3.95Å; F550-Y609 HydrophobicContact CB-CE1 3.37Å; F550-Y609 HydrophobicContact CB-CE2 4.02Å; F550-Y609 VanDerWaalsContact CB-CZ 3.42Å; F550-Y609 HydrophobicContact CD1-CD1 4.45Å; F550-Y609 AromaticContact CD1-CE1 3.85Å; F550-Y609 HydrophobicContact CD1-CE1 3.85Å; F550-Y609 AromaticContact CD2-CD1 3.75Å; F550-Y609 HydrophobicContact CD2-CD1 3.75Å; F550-Y609 AromaticContact CD2-CE1 3.91Å; F550-Y609 HydrophobicContact CD2-CE1 3.91Å; F550-Y609 HydrophobicContact CD2-CG 4.5Å; F550-Y609 HydrophobicContact CE2-CD1 4.36Å; F550-Y609 AromaticContact CG-CD1 3.81Å; F550-Y609 HydrophobicContact CG-CD1 3.81Å; F550-Y609 AromaticContact CG-CE1 3.44Å; F550-Y609 HydrophobicContact CG-CE1 3.44Å; F550-Y609 VanDerWaalsContact CG-CE1 3.44Å; F550-A647 HydrophobicContact CE2-CB 3.77Å; F550-A647 WeakPolarHBondContact CZ-O 3.44Å
551	S	67.5	Low	82.2	Confident	7 Å²	7	35.6 Å²	35.6	5%	0.049	18%	0.176	C	C	.	.			trans	-140.9	56.1	-168.8	-137.9	0	0	0	0	113.5	Q547 E553 R554 W675	Q547-S551 VanDerWaalsContact CG-O 3.24Å; Q547-S551 WeakPolarHBondContact CG-O 3.5Å; Q547-S551 CarbonylContact O-C 3.59Å; Q547-S551 WeakPolarHBondContact O-CA 3.22Å; Q547-S551 PolarHBondContact O-N 2.7Å; S551-E553 PolarHBondContact O-N 2.88Å; S551-E553 VanDerWaalsContact O-N 3.15Å; S551-R554 PolarHBondContact O-N 3.05Å; S551-W675 PolarHBondContact OG-NE1 3.14Å
552	P	58.1	Low	82.4	Confident	46 Å²	46	33 Å²	33	30%	0.299	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.6	-175.9	29.2	-37.8	0	0	0	112.9	Y442 W443 Q547	Y442-P552 HydrophobicContact CE1-CB 4.49Å; Y442-P552 HydrophobicContact CE1-CG 4.21Å; W443-P552 VanDerWaalsContact CH2-CD 3.48Å; W443-P552 HydrophobicContact CH2-CG 3.53Å; W443-P552 HydrophobicContact CZ3-CB 4.18Å; W443-P552 HydrophobicContact CZ3-CG 3.5Å; W443-P552 VanDerWaalsContact CZ3-CG 3.5Å; Q547-P552 VanDerWaalsContact O-N 3.14Å
553	E	59.1	Low	82.5	Confident	124 Å²	124	33.2 Å²	33.2	58%	0.579	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-8.1	-176.8	-67.8	175.4	-169.6	0	0	113.5	K438 S551	K438-E553 IonicContact NZ-OE1 2.59Å; K438-E553 PolarHBondContact NZ-OE1 3.35Å; K438-E553 IonicContact NZ-OE2 3.36Å; K438-E553 PolarHBondContact NZ-OE2 3.3Å; S551-E553 PolarHBondContact O-N 2.88Å; S551-E553 VanDerWaalsContact O-N 3.15Å
554	R	72.6	Confident	82.6	Confident	90 Å²	90	32.3 Å²	32.3	34%	0.34	17%	0.166	S	C	.	.	S	Bend	trans	-131.1	127.5	179.6	-63.9	-176.2	179.6	-176	-1	109.9	S551 L556	S551-R554 PolarHBondContact O-N 3.05Å; R554-L556 PolarHBondContact O-N 3.1Å
555	P	80.1	Confident	83.2	Confident	80 Å²	80	29.5 Å²	29.5	52%	0.519	15%	0.149	S	C	.	.			trans	-61.5	137	175.8	27.1	-33.3	0	0	0	110.3
556	L	85.3	Confident	83.7	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.151	C	C	.	.			trans	-106.9	135.7	171.4	-90.6	157.5	0	0	0	109.6	R543 Q547 R554 Y609 H673	R543-L556 VanDerWaalsContact CD-O 3.3Å; R543-L556 WeakPolarHBondContact CD-O 3.43Å; R543-L556 PolarHBondContact NH1-O 3.43Å; Q547-L556 HydrophobicContact CB-CB 4.13Å; Q547-L556 HydrophobicContact CB-CD1 4Å; Q547-L556 HydrophobicContact CG-CB 4.27Å; Q547-L556 HydrophobicContact CG-CD1 4.3Å; R554-L556 PolarHBondContact O-N 3.1Å; L556-Y609 HydrophobicContact CD1-CD2 3.85Å; L556-Y609 HydrophobicContact CD1-CE2 4.31Å; L556-Y609 HydrophobicContact CD2-CD2 3.94Å; L556-H673 HydrophobicContact CD2-CB 3.57Å
557	H	93.3	Very high	84	Confident	40 Å²	40	31.2 Å²	31.2	19%	0.185	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143.3	176.4	-58.2	-72.4	0	0	0	110.1	S559 H673 T674 R680	H557-S559 PolarHBondContact O-N 3.49Å; H557-H673 CarbonylContact O-C 3.56Å; H557-H673 WeakPolarHBondContact O-CA 3.18Å; H557-T674 HydrophobicContact CB-CG2 4.16Å; H557-T674 PolarHBondContact N-O 3.34Å; H557-T674 PolarHBondContact O-N 3.45Å; H557-R680 HydrophobicContact CB-CB 4.26Å; H557-R680 HydrophobicContact CB-CG 4.24Å
558	L	96.1	Very high	84.6	Confident	5 Å²	5	30.3 Å²	30.3	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	128	164.8	-71.8	168.8	0	0	0	108.2	R543 L671 R680 E681 W684	R543-L558 HydrophobicContact CB-CD2 4Å; R543-L558 HydrophobicContact CB-CG 4.09Å; R543-L558 HydrophobicContact CG-CD2 4.44Å; R543-L558 HydrophobicContact CG-CG 4.19Å; L558-L671 HydrophobicContact CD2-CB 4.48Å; L558-L671 HydrophobicContact CD2-CD2 3.85Å; L558-R680 CarbonylContact O-C 3.56Å; L558-R680 WeakPolarHBondContact O-CA 3.19Å; L558-E681 HydrophobicContact CB-CB 4.44Å; L558-E681 WeakPolarHBondContact O-CB 3.34Å; L558-E681 PolarHBondContact O-N 2.77Å; L558-W684 HydrophobicContact CD1-CD2 4.47Å; L558-W684 HydrophobicContact CD1-CG 4.25Å
559	S	95.1	Very high	85.4	Confident	10 Å²	10	31.7 Å²	31.7	7%	0.07	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-35.5	178.2	-172.7	0	0	0	0	112	H557 Y606 W672 H679	H557-S559 PolarHBondContact O-N 3.49Å; S559-Y606 WeakPolarHBondContact OG-CE2 3.1Å; S559-W672 WeakPolarHBondContact CB-O 3.16Å; S559-W672 PolarHBondContact N-O 3.07Å; S559-H679 WeakPolarHBondContact CA-O 3.35Å; S559-H679 PolarHBondContact OG-O 3.36Å
560	F	96.1	Very high	85.8	Confident	58 Å²	58	39.2 Å²	39.2	25%	0.254	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	141.3	171.4	-171.6	-119.7	0	0	0	110.6	T514 H562 L671 W672	T514-F560 HydrophobicContact CG2-CE2 4.03Å; T514-F560 HydrophobicContact CG2-CZ 3.88Å; F560-H562 HydrophobicContact CD1-CB 4.33Å; F560-H562 HydrophobicContact CE1-CB 3.75Å; F560-H562 AromaticContact CE1-ND1 3.98Å; F560-H562 HydrophobicContact CZ-CB 4.32Å; F560-L671 WeakPolarHBondContact O-CA 3.39Å; F560-W672 HydrophobicContact CB-CE3 4Å; F560-W672 AromaticContact CD1-CE3 3.68Å; F560-W672 HydrophobicContact CD1-CE3 3.68Å; F560-W672 HydrophobicContact CD1-CH2 4.43Å; F560-W672 AromaticContact CD1-CZ3 3.45Å; F560-W672 HydrophobicContact CD1-CZ3 3.45Å; F560-W672 VanDerWaalsContact CD1-CZ3 3.45Å; F560-W672 HydrophobicContact CE1-CZ3 4.08Å; F560-W672 HydrophobicContact CG-CE3 4.32Å; F560-W672 HydrophobicContact CG-CZ3 4.47Å; F560-W672 PolarHBondContact N-O 3.35Å; F560-W672 PolarHBondContact O-N 2.84Å
561	T	96.1	Very high	85.8	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123.8	-178.6	-58.5	0	0	0	0	110.2	V515 S539 L669 L671 E681	V515-T561 HydrophobicContact CG1-CG2 3.54Å; S539-T561 VanDerWaalsContact OG-CG2 3.24Å; S539-T561 WeakPolarHBondContact OG-CG2 3.45Å; T561-L669 HydrophobicContact CG2-CD1 3.76Å; T561-L669 HydrophobicContact CG2-CG 4.39Å; T561-L671 HydrophobicContact CG2-CD2 4.16Å; T561-L671 HydrophobicContact CG2-CG 4.39Å; T561-E681 VanDerWaalsContact CB-OE2 3.26Å; T561-E681 WeakPolarHBondContact CB-OE2 3.38Å; T561-E681 VanDerWaalsContact N-CD 3.29Å; T561-E681 PolarHBondContact N-OE1 3.29Å; T561-E681 PolarHBondContact N-OE2 2.99Å; T561-E681 PolarHBondContact OG1-OE2 3.34Å
562	H	94.4	Very high	86.3	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.065	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	113.5	-174.4	-163.1	-175.9	0	0	0	112.4	F510 G512 F560 V564 A670 W672	F510-H562 AromaticContact CZ-CE1 3.78Å; G512-H562 WeakPolarHBondContact CA-NE2 3.38Å; F560-H562 HydrophobicContact CD1-CB 4.33Å; F560-H562 HydrophobicContact CE1-CB 3.75Å; F560-H562 AromaticContact CE1-ND1 3.98Å; F560-H562 HydrophobicContact CZ-CB 4.32Å; H562-V564 HydrophobicContact CB-CG2 4.18Å; H562-V564 PolarHBondContact O-N 3.12Å; H562-A670 PolarHBondContact N-O 2.97Å; H562-A670 PolarHBondContact O-N 3.12Å; H562-W672 HydrophobicContact CB-CZ3 4.23Å
563	L	95.9	Very high	87.4	Confident	3 Å²	3	45 Å²	45	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.1	170.3	178.1	59.2	0	0	0	109.1	L484 A485 G512 L513 L535 L615 L669	L484-L563 HydrophobicContact CD2-CD2 4.3Å; A485-L563 HydrophobicContact CB-CD2 3.89Å; A485-L563 HydrophobicContact CB-CG 4.34Å; G512-L563 CarbonylContact C-O 3.49Å; G512-L563 WeakPolarHBondContact CA-O 3.3Å; L513-L563 HydrophobicContact CB-CB 4.29Å; L513-L563 HydrophobicContact CD2-CD2 4.23Å; L513-L563 PolarHBondContact N-O 3.12Å; L513-L563 PolarHBondContact O-N 3.43Å; L535-L563 HydrophobicContact CD1-CB 4.31Å; L535-L563 HydrophobicContact CD1-CD2 4.49Å; L563-L615 HydrophobicContact CD1-CD1 3.46Å; L563-L615 VanDerWaalsContact CD1-CD1 3.46Å; L563-L669 HydrophobicContact CB-CD1 4.04Å
564	V	94.1	Very high	88	Confident	20 Å²	20	47.8 Å²	47.8	12%	0.121	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.1	-170.4	172.8	0	0	0	0	111	F510 E511 H562 C667 A668	F510-V564 HydrophobicContact CD2-CG1 3.95Å; F510-V564 HydrophobicContact CE2-CB 4.39Å; F510-V564 HydrophobicContact CE2-CG1 3.43Å; F510-V564 VanDerWaalsContact CE2-CG1 3.43Å; F510-V564 HydrophobicContact CE2-CG2 4.15Å; F510-V564 HydrophobicContact CZ-CG1 4.44Å; F510-V564 HydrophobicContact CZ-CG2 4.44Å; E511-V564 WeakPolarHBondContact O-CA 3.36Å; H562-V564 HydrophobicContact CB-CG2 4.18Å; H562-V564 PolarHBondContact O-N 3.12Å; V564-C667 CarbonylContact O-C 3.5Å; V564-C667 VanDerWaalsContact O-CA 3.3Å; V564-C667 WeakPolarHBondContact O-CA 3.46Å; V564-A668 PolarHBondContact N-O 3.22Å; V564-A668 PolarHBondContact O-N 3.19Å
565	C	94.7	Very high	87.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.8	168.9	-62.1	0	0	0	0	111.8	E511 R665 R666 C667	E511-C565 HydrophobicContact CB-CB 4.28Å; E511-C565 PolarHBondContact N-O 3.02Å; E511-C565 PolarHBondContact O-N 3.44Å; C565-R665 HydrophobicContact CB-CG 4.28Å; C565-R666 CarbonylContact C-O 3.55Å; C565-R666 VanDerWaalsContact CA-O 3.23Å; C565-R666 WeakPolarHBondContact CA-O 3.34Å; C565-C667 HydrophobicContact CB-CB 4.22Å; C565-C667 WeakPolarHBondContact CB-SG 3.27Å; C565-C667 WeakPolarHBondContact SG-CB 3.49Å; C565-C667 CovalentContact SG-SG 2.05Å; C565-C667 PolarHBondContact SG-SG 3.48Å
566	R	92.9	Very high	87.4	Confident	19 Å²	19	50.3 Å²	50.3	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.3	173.1	-60	-72.9	-179.2	-173	-4.7	108.6	H504 R509 F510 V661 R665 R666	H504-R566 PolarHBondContact CD2-NH2 3.25Å; H504-R566 PolarHBondContact NE2-NH2 3.34Å; H504-R566 VanDerWaalsContact NE2-NH2 3.2Å; R509-R566 WeakPolarHBondContact O-CA 3.47Å; F510-R566 VanDerWaalsContact CB-NH1 3.3Å; R566-V661 HydrophobicContact CB-CG2 4.27Å; R566-R665 CarbonylContact O-C 3.47Å; R566-R665 WeakPolarHBondContact O-CA 3.49Å; R566-R666 PolarHBondContact N-O 2.94Å; R566-R666 PolarHBondContact O-N 3.27Å
567	S	92.6	Very high	86.7	Confident	22 Å²	22	58.8 Å²	58.8	15%	0.154	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.3	178.9	-53.8	0	0	0	0	110.7	E508 R509 R665	E508-S567 CarbonylContact C-O 3.56Å; E508-S567 VanDerWaalsContact CA-O 3.29Å; E508-S567 WeakPolarHBondContact CA-O 3.48Å; R509-S567 PolarHBondContact N-O 2.94Å; R509-S567 PolarHBondContact O-N 3.46Å; S567-R665 WeakPolarHBondContact OG-CD 3.48Å; S567-R665 VanDerWaalsContact OG-CG 3.3Å; S567-R665 WeakPolarHBondContact OG-CG 3.18Å
568	A	91.8	Very high	86.1	Confident	23 Å²	23	59.1 Å²	59.1	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.4	173.7	0	0	0	0	0	110.5	Q573 V661 G664	A568-Q573 HydrophobicContact CB-CG 4.45Å; A568-V661 HydrophobicContact CB-CG1 4.43Å; A568-V661 WeakPolarHBondContact CB-O 3.21Å; A568-G664 PolarHBondContact N-O 3.09Å; A568-G664 VanDerWaalsContact N-O 3.08Å
569	I	87.9	Confident	85.8	Confident	45 Å²	45	60.9 Å²	60.9	23%	0.231	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-86.3	124	172.4	-64.1	171.7	0	0	0	108.6	P506 H507 E572 Q573	P506-I569 VanDerWaalsContact O-CD1 3.27Å; P506-I569 WeakPolarHBondContact O-CD1 3.43Å; H507-I569 WeakPolarHBondContact O-CB 3.01Å; H507-I569 PolarHBondContact O-N 3.39Å; I569-E572 HydrophobicContact CB-CB 4.41Å; I569-E572 HydrophobicContact CG2-CB 4.33Å; I569-E572 HydrophobicContact CG2-CG 4Å; I569-E572 PolarHBondContact O-N 3.46Å; I569-Q573 WeakPolarHBondContact O-CG 3.25Å; I569-Q573 PolarHBondContact O-NE2 2.96Å
570	E	81.4	Confident	85.5	Confident	189 Å²	189	60.5 Å²	60.5	88%	0.883	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	138.2	179.9	-68	-173.8	168.2	0	0	111.5	E572	E570-E572 VanDerWaalsContact C-N 3.26Å; E570-E572 PolarHBondContact O-N 3.22Å
571	G	77.1	Confident	85.2	Confident	82 Å²	82	59.6 Å²	59.6	85%	0.845	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-8.1	-179.6	0	0	0	0	0	115.4
572	E	77	Confident	84.9	Confident	83 Å²	83	61.6 Å²	61.6	39%	0.388	33%	0.325	S	S	.	.			trans	-107.6	15.9	-178	-67.9	-163.6	-155.4	0	0	114.1	H507 I569 E570	H507-E572 HydrophobicContact CB-CB 4.42Å; H507-E572 IonicContact CE1-OE2 3.62Å; H507-E572 IonicContact CG-OE2 3.22Å; H507-E572 PolarHBondContact ND1-O 2.69Å; H507-E572 IonicContact ND1-OE2 2.6Å; H507-E572 PolarHBondContact ND1-OE2 3.22Å; I569-E572 HydrophobicContact CB-CB 4.41Å; I569-E572 HydrophobicContact CG2-CB 4.33Å; I569-E572 HydrophobicContact CG2-CG 4Å; I569-E572 PolarHBondContact O-N 3.46Å; E570-E572 VanDerWaalsContact C-N 3.26Å; E570-E572 PolarHBondContact O-N 3.22Å
573	Q	81.3	Confident	84.8	Confident	36 Å²	36	62.5 Å²	62.5	17%	0.168	33%	0.332	C	S	.	.			trans	-103.7	-11.7	-169.3	-54	-57.5	-45.3	0	0	114.5	H507 A568 I569 V661 T662	H507-Q573 PolarHBondContact O-NE2 3.34Å; A568-Q573 HydrophobicContact CB-CG 4.45Å; I569-Q573 WeakPolarHBondContact O-CG 3.25Å; I569-Q573 PolarHBondContact O-NE2 2.96Å; Q573-V661 PolarHBondContact OE1-O 3.34Å; Q573-T662 WeakPolarHBondContact CG-O 3.08Å
574	E	72.8	Confident	84.5	Confident	182 Å²	182	64.5 Å²	64.5	85%	0.85	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	130.8	-177.8	-69.5	-172.2	170.4	0	0	111.7	R576	E574-R576 PolarHBondContact O-N 3.48Å
575	Q	66.9	Low	84.5	Confident	193 Å²	193	64 Å²	64	90%	0.902	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	20.6	175.9	-54.6	-175.3	-1.5	0	0	116.3
576	R	72.4	Confident	84.4	Confident	29 Å²	29	64.5 Å²	64.5	11%	0.109	34%	0.341	C	S	.	.			trans	-71.5	135.5	178.7	74.7	180	-68.2	-150.8	-4.9	112.1	E508 E574 D578 A660 V661	E508-R576 IonicContact OE1-CZ 3.63Å; E508-R576 IonicContact OE1-NH1 3.67Å; E508-R576 PolarHBondContact OE1-NH1 3.06Å; E508-R576 IonicContact OE1-NH2 3.71Å; E508-R576 PolarHBondContact OE1-NH2 3.05Å; E574-R576 PolarHBondContact O-N 3.48Å; R576-D578 WeakPolarHBondContact CB-OD1 3.37Å; R576-D578 IonicContact CZ-OD1 2.7Å; R576-D578 IonicContact CZ-OD2 3.49Å; R576-D578 IonicContact NE-OD1 2.68Å; R576-D578 PolarHBondContact NE-OD1 2.88Å; R576-D578 IonicContact NE-OD2 3.84Å; R576-D578 IonicContact NH2-OD1 3.58Å; R576-D578 PolarHBondContact NH2-OD1 2.98Å; R576-D578 IonicContact NH2-OD2 2.99Å; R576-D578 PolarHBondContact NH2-OD2 2.92Å; R576-A660 HydrophobicContact CG-CB 4.47Å; R576-V661 PolarHBondContact NH1-O 2.94Å
577	M	69.9	Low	84.4	Confident	179 Å²	179	64 Å²	64	88%	0.882	34%	0.34	S	S	*	.			trans	-125.1	6.6	-178.2	-64.3	-63.7	-64	0	0	112.2
578	D	82.1	Confident	84.1	Confident	48 Å²	48	63.2 Å²	63.2	26%	0.257	33%	0.334	S	S	.	.			trans	-81.3	163.2	177.3	65.4	-52.8	0	0	0	111.8	T505 H507 R576	T505-D578 WeakPolarHBondContact CB-OD2 3.42Å; T505-D578 PolarHBondContact OG1-OD2 3Å; H507-D578 IonicContact CD2-OD1 3.52Å; H507-D578 IonicContact CD2-OD2 3.87Å; R576-D578 WeakPolarHBondContact CB-OD1 3.37Å; R576-D578 IonicContact CZ-OD1 2.7Å; R576-D578 IonicContact CZ-OD2 3.49Å; R576-D578 IonicContact NE-OD1 2.68Å; R576-D578 PolarHBondContact NE-OD1 2.88Å; R576-D578 IonicContact NE-OD2 3.84Å; R576-D578 IonicContact NH2-OD1 3.58Å; R576-D578 PolarHBondContact NH2-OD1 2.98Å; R576-D578 IonicContact NH2-OD2 2.99Å; R576-D578 PolarHBondContact NH2-OD2 2.92Å
579	L	89.4	Confident	83.5	Confident	41 Å²	41	63.7 Å²	63.7	22%	0.215	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	145.3	174	-62.4	175.9	0	0	0	109.9	H581 V583 F625 V658 W659	L579-H581 WeakPolarHBondContact CB-O 3.42Å; L579-H581 PolarHBondContact O-N 3.26Å; L579-V583 HydrophobicContact CD1-CG2 4.14Å; L579-F625 HydrophobicContact CD1-CE1 4.37Å; L579-F625 HydrophobicContact CD1-CZ 3.81Å; L579-F625 HydrophobicContact CD2-CE1 3.83Å; L579-F625 HydrophobicContact CD2-CZ 3.92Å; L579-V658 WeakPolarHBondContact CB-O 3.25Å; L579-W659 HydrophobicContact CD2-CD2 4.14Å; L579-W659 HydrophobicContact CD2-CE3 3.47Å; L579-W659 VanDerWaalsContact CD2-CE3 3.47Å; L579-W659 HydrophobicContact CD2-CH2 4.42Å; L579-W659 HydrophobicContact CD2-CZ3 3.64Å
580	S	89.1	Confident	83.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.014	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	-36.4	170.6	-179.5	0	0	0	0	110.6	E508 V658 W659	E508-S580 WeakPolarHBondContact OE1-CB 3.27Å; E508-S580 VanDerWaalsContact OE2-CB 3.3Å; E508-S580 WeakPolarHBondContact OE2-CB 3.29Å; E508-S580 PolarHBondContact OE2-OG 2.91Å; S580-V658 PolarHBondContact N-O 3.31Å; S580-W659 WeakPolarHBondContact CB-O 3.4Å
581	H	90.1	Very high	83	Confident	40 Å²	40	55.4 Å²	55.4	19%	0.185	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	126.3	169.4	-160.7	-71.9	0	0	0	109.7	H504 L579 H584 V658	H504-H581 AromaticContact CD2-CD2 3.94Å; H504-H581 AromaticContact NE2-CD2 3.69Å; H504-H581 AromaticContact NE2-NE2 3.82Å; L579-H581 WeakPolarHBondContact CB-O 3.42Å; L579-H581 PolarHBondContact O-N 3.26Å; H581-H584 AromaticContact CE1-CD2 3.94Å; H581-H584 AromaticContact CE1-CE1 3.14Å; H581-H584 PolarHBondContact CE1-CE1 2.68Å; H581-H584 AromaticContact CE1-CG 3.94Å; H581-H584 AromaticContact CE1-ND1 3.45Å; H581-H584 PolarHBondContact CE1-ND1 2.69Å; H581-H584 AromaticContact CE1-NE2 3.4Å; H581-H584 PolarHBondContact CE1-NE2 3.49Å; H581-H584 AromaticContact ND1-CE1 3.28Å; H581-H584 PolarHBondContact ND1-CE1 2.67Å; H581-H584 VanDerWaalsContact ND1-CE1 3.28Å; H581-H584 AromaticContact ND1-ND1 3.4Å; H581-H584 PolarHBondContact ND1-ND1 2.04Å; H581-V658 HydrophobicContact CB-CB 3.88Å; H581-V658 HydrophobicContact CB-CG2 3.95Å; H581-V658 PolarHBondContact N-O 2.91Å; H581-V658 PolarHBondContact O-N 3.09Å
582	P	90.1	Very high	82.7	Confident	43 Å²	43	54.4 Å²	54.4	28%	0.279	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	159.1	-179.9	28.1	-35.6	0	0	0	111.7	H584	P582-H584 PolarHBondContact O-N 3.49Å; P582-H584 PolarHBondContact O-ND1 2.84Å; P582-H584 VanDerWaalsContact O-ND1 3.1Å
583	V	90.5	Very high	81.9	Confident	32 Å²	32	57.1 Å²	57.1	19%	0.194	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	130.9	173.6	-177.5	0	0	0	0	109.8	L579 L590 F625 T627 A631 P655 H656	L579-V583 HydrophobicContact CD1-CG2 4.14Å; V583-L590 HydrophobicContact CG1-CD2 4.45Å; V583-F625 HydrophobicContact CG2-CE2 3.63Å; V583-F625 HydrophobicContact CG2-CZ 3.71Å; V583-T627 HydrophobicContact CG1-CG2 4.36Å; V583-T627 HydrophobicContact CG2-CG2 4.22Å; V583-A631 HydrophobicContact CB-CB 3.99Å; V583-A631 HydrophobicContact CG1-CB 3.65Å; V583-P655 HydrophobicContact CG1-CB 4.12Å; V583-H656 VanDerWaalsContact CA-O 3.27Å; V583-H656 WeakPolarHBondContact CA-O 3.42Å
584	H	91.2	Very high	81	Confident	46 Å²	46	58.4 Å²	58.4	21%	0.213	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	169.4	-179.2	67	-54.5	0	0	0	110.8	H581 P582 D586 P655 H656	H581-H584 AromaticContact CE1-CD2 3.94Å; H581-H584 AromaticContact CE1-CE1 3.14Å; H581-H584 PolarHBondContact CE1-CE1 2.68Å; H581-H584 AromaticContact CE1-CG 3.94Å; H581-H584 AromaticContact CE1-ND1 3.45Å; H581-H584 PolarHBondContact CE1-ND1 2.69Å; H581-H584 AromaticContact CE1-NE2 3.4Å; H581-H584 PolarHBondContact CE1-NE2 3.49Å; H581-H584 AromaticContact ND1-CE1 3.28Å; H581-H584 PolarHBondContact ND1-CE1 2.67Å; H581-H584 VanDerWaalsContact ND1-CE1 3.28Å; H581-H584 AromaticContact ND1-ND1 3.4Å; H581-H584 PolarHBondContact ND1-ND1 2.04Å; P582-H584 PolarHBondContact O-N 3.49Å; P582-H584 PolarHBondContact O-ND1 2.84Å; P582-H584 VanDerWaalsContact O-ND1 3.1Å; H584-D586 IonicContact CD2-OD1 3.06Å; H584-D586 IonicContact NE2-OD1 3.49Å; H584-D586 PolarHBondContact NE2-OD1 2.8Å; H584-P655 WeakPolarHBondContact O-CA 3.48Å; H584-H656 AromaticContact CE1-CD2 3.75Å; H584-H656 AromaticContact CE1-CE1 3.82Å; H584-H656 AromaticContact CE1-NE2 3.24Å; H584-H656 PolarHBondContact CE1-NE2 3.02Å; H584-H656 PolarHBondContact N-O 3.44Å; H584-H656 PolarHBondContact ND1-O 2.82Å; H584-H656 VanDerWaalsContact ND1-O 3.12Å; H584-H656 AromaticContact NE2-NE2 3.66Å; H584-H656 PolarHBondContact O-N 3.33Å
585	A	93.1	Very high	80.7	Confident	9 Å²	9	51 Å²	51	7%	0.074	28%	0.276	C	S	.	.			trans	-113.4	149	162.5	0	0	0	0	0	108.4	C588 L590	A585-C588 WeakPolarHBondContact CB-SG 3.41Å; A585-L590 HydrophobicContact CB-CB 4.48Å
586	D	92.9	Very high	81.1	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.064	25%	0.247	C	C	.	.	S	Bend	trans	-82.7	-27.7	-169.1	-87.5	-46.4	0	0	0	113.3	H584 R607 S610 S650 H656 W672	H584-D586 IonicContact CD2-OD1 3.06Å; H584-D586 IonicContact NE2-OD1 3.49Å; H584-D586 PolarHBondContact NE2-OD1 2.8Å; D586-R607 IonicContact OD1-NH1 2.76Å; D586-S610 VanDerWaalsContact OD2-CB 3.31Å; D586-S610 WeakPolarHBondContact OD2-CB 3.43Å; D586-S610 PolarHBondContact OD2-OG 3.35Å; D586-S650 PolarHBondContact N-O 2.88Å; D586-H656 IonicContact OD2-CE1 3.43Å; D586-H656 PolarHBondContact OD2-CE1 3.26Å; D586-H656 IonicContact OD2-NE2 2.77Å; D586-W672 PolarHBondContact OD1-NE1 2.83Å; D586-W672 PolarHBondContact OD2-NE1 3.12Å
587	N	92.3	Very high	81.5	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.043	26%	0.256	C	S	.	.	S	Bend	trans	-113.3	3.5	-176.4	79.3	8.1	0	0	0	114.6	R599 Y604 T605 R607 S650 G651	N587-R599 PolarHBondContact ND2-NH2 2.88Å; N587-Y604 WeakPolarHBondContact CA-O 3.45Å; N587-Y604 WeakPolarHBondContact CB-O 3.27Å; N587-T605 WeakPolarHBondContact O-CA 3.26Å; N587-R607 HydrophobicContact CB-CB 4.05Å; N587-R607 WeakPolarHBondContact CB-O 3.45Å; N587-R607 PolarHBondContact ND2-O 3.26Å; N587-S650 PolarHBondContact N-O 3.22Å; N587-S650 PolarHBondContact OD1-O 2.84Å; N587-G651 VanDerWaalsContact OD1-CA 3.28Å; N587-G651 WeakPolarHBondContact OD1-CA 3.47Å
588	C	86.1	Confident	81.6	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.034	22%	0.223	C	C	.	.	S	Bend	trans	-147.8	160.7	-179.7	77.7	0	0	0	0	112.7	A585 L590 C597 W598 R599	A585-C588 WeakPolarHBondContact CB-SG 3.41Å; C588-L590 PolarHBondContact O-N 3.23Å; C588-C597 HydrophobicContact CB-CB 4.13Å; C588-C597 WeakPolarHBondContact CB-SG 3.17Å; C588-C597 VanDerWaalsContact SG-CA 3.57Å; C588-C597 WeakPolarHBondContact SG-CB 3.42Å; C588-C597 CovalentContact SG-SG 2Å; C588-C597 PolarHBondContact SG-SG 3.47Å; C588-W598 CarbonylContact C-O 3.58Å; C588-W598 VanDerWaalsContact CA-O 3.26Å; C588-W598 WeakPolarHBondContact CA-O 3.33Å; C588-W598 VanDerWaalsContact CB-O 3.3Å; C588-W598 WeakPolarHBondContact CB-O 3.16Å; C588-R599 HydrophobicContact CB-CG 4.13Å
589	V	80.9	Confident	81.4	Confident	34 Å²	34	42.7 Å²	42.7	21%	0.206	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	97.4	171.2	-176.2	0	0	0	0	108.4	R307 W598 P602 A603	R307-V589 PolarHBondContact NH1-O 3.35Å; V589-W598 PolarHBondContact N-O 2.94Å; V589-W598 PolarHBondContact O-N 3.43Å; V589-P602 HydrophobicContact CG2-CG 4.38Å; V589-A603 HydrophobicContact CG2-CB 4.05Å
590	L	81	Confident	80.5	Confident	25 Å²	25	41.5 Å²	41.5	13%	0.131	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	128.5	177.5	-176.1	68.5	0	0	0	111.3	V583 A585 C588 P629 A631 P655	V583-L590 HydrophobicContact CG1-CD2 4.45Å; A585-L590 HydrophobicContact CB-CB 4.48Å; C588-L590 PolarHBondContact O-N 3.23Å; L590-P629 HydrophobicContact CD1-CB 4.33Å; L590-A631 HydrophobicContact CD2-CB 4.48Å; L590-P655 HydrophobicContact CD1-CG 4.36Å; L590-P655 HydrophobicContact CD2-CB 3.76Å; L590-P655 HydrophobicContact CD2-CG 4.06Å
591	D	77.9	Confident	79.1	Confident	34 Å²	34	45 Å²	45	18%	0.182	25%	0.248	C	C	.	.			trans	-101.7	106.7	170	-161.4	-35.2	0	0	0	110	R307 D593 T594 G595 E596	R307-D591 IonicContact NH2-OD2 3.98Å; R307-D591 PolarHBondContact NH2-OD2 3.42Å; D591-D593 PolarHBondContact O-N 2.04Å; D591-D593 PolarHBondContact OD1-N 3.44Å; D591-D593 VanDerWaalsContact OD1-N 3.14Å; D591-T594 WeakPolarHBondContact CB-OG1 3.24Å; D591-G595 VanDerWaalsContact O-CA 3.24Å; D591-G595 WeakPolarHBondContact O-CA 3.35Å; D591-G595 PolarHBondContact O-N 3.35Å; D591-E596 PolarHBondContact N-O 2.99Å
592	P	69.3	Low	78	Confident	62 Å²	62	46.4 Å²	46.4	40%	0.403	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24	-178.3	-22.1	34.7	0	0	0	114.2	N630 A631	P592-N630 WeakPolarHBondContact O-CA 3.46Å; P592-A631 HydrophobicContact CB-CB 4Å; P592-A631 HydrophobicContact CG-CB 4.1Å
593	D	60.5	Low	77.5	Confident	140 Å²	140	45.1 Å²	45.1	75%	0.749	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-39.4	-174.3	-65.6	-34.7	0	0	0	110.8	D591	D591-D593 PolarHBondContact O-N 2.04Å; D591-D593 PolarHBondContact OD1-N 3.44Å; D591-D593 VanDerWaalsContact OD1-N 3.14Å
594	T	63.1	Low	77.2	Confident	62 Å²	62	49.1 Å²	49.1	38%	0.38	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-17.1	176.8	69.8	0	0	0	0	113.5	D591 E596	D591-T594 WeakPolarHBondContact CB-OG1 3.24Å; T594-E596 PolarHBondContact O-N 2.72Å; T594-E596 WeakPolarHBondContact OG1-CB 3.47Å; T594-E596 WeakPolarHBondContact OG1-CG 3.42Å; T594-E596 PolarHBondContact OG1-N 3.29Å; T594-E596 PolarHBondContact OG1-OE2 2.82Å
595	G	66.7	Low	77	Confident	28 Å²	28	47.8 Å²	47.8	29%	0.289	26%	0.261	S	S	.	.			trans	73	8.5	-172	0	0	0	0	0	113.9	D591 P629	D591-G595 VanDerWaalsContact O-CA 3.24Å; D591-G595 WeakPolarHBondContact O-CA 3.35Å; D591-G595 PolarHBondContact O-N 3.35Å; G595-P629 VanDerWaalsContact O-CB 3.3Å; G595-P629 WeakPolarHBondContact O-CB 3Å
596	E	75.2	Confident	76.6	Confident	59 Å²	59	49.6 Å²	49.6	28%	0.276	27%	0.266	S	S	.	.			trans	-83.1	148.3	-179.2	-67.2	172.4	132	0	0	112.3	R304 D591 T594 W598	R304-E596 IonicContact NE-OE2 2.99Å; R304-E596 IonicContact NH2-OE2 3.88Å; D591-E596 PolarHBondContact N-O 2.99Å; T594-E596 PolarHBondContact O-N 2.72Å; T594-E596 WeakPolarHBondContact OG1-CB 3.47Å; T594-E596 WeakPolarHBondContact OG1-CG 3.42Å; T594-E596 PolarHBondContact OG1-N 3.29Å; T594-E596 PolarHBondContact OG1-OE2 2.82Å; E596-W598 HydrophobicContact CB-CZ2 4.16Å; E596-W598 VanDerWaalsContact CD-CZ2 3.45Å; E596-W598 HydrophobicContact CG-CZ2 4.38Å; E596-W598 WeakPolarHBondContact OE2-CZ2 3.21Å
597	C	79.3	Confident	76.7	Confident	44 Å²	44	49.7 Å²	49.7	30%	0.297	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	103.8	-178.1	162.2	0	0	0	0	109.4	C588 G652	C588-C597 HydrophobicContact CB-CB 4.13Å; C588-C597 WeakPolarHBondContact CB-SG 3.17Å; C588-C597 VanDerWaalsContact SG-CA 3.57Å; C588-C597 WeakPolarHBondContact SG-CB 3.42Å; C588-C597 CovalentContact SG-SG 2Å; C588-C597 PolarHBondContact SG-SG 3.47Å; C597-G652 WeakPolarHBondContact SG-CA 3.49Å; C597-G652 PolarHBondContact SG-N 2.98Å
598	W	72.4	Confident	76.6	Confident	50 Å²	50	49.7 Å²	49.7	19%	0.189	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.4	-171.2	-58	88.6	0	0	0	111.3	R307 V311 C588 V589 E596 E600	R307-W598 VanDerWaalsContact NH1-CD1 3.26Å; V311-W598 HydrophobicContact CG2-CH2 3.69Å; V311-W598 HydrophobicContact CG2-CZ3 3.93Å; C588-W598 CarbonylContact C-O 3.58Å; C588-W598 VanDerWaalsContact CA-O 3.26Å; C588-W598 WeakPolarHBondContact CA-O 3.33Å; C588-W598 VanDerWaalsContact CB-O 3.3Å; C588-W598 WeakPolarHBondContact CB-O 3.16Å; V589-W598 PolarHBondContact N-O 2.94Å; V589-W598 PolarHBondContact O-N 3.43Å; E596-W598 HydrophobicContact CB-CZ2 4.16Å; E596-W598 VanDerWaalsContact CD-CZ2 3.45Å; E596-W598 HydrophobicContact CG-CZ2 4.38Å; E596-W598 WeakPolarHBondContact OE2-CZ2 3.21Å; W598-E600 VanDerWaalsContact C-N 3.28Å; W598-E600 HydrophobicContact CB-CG 4.12Å; W598-E600 PolarHBondContact O-N 3.4Å
599	R	78.6	Confident	77.1	Confident	121 Å²	121	49.9 Å²	49.9	46%	0.457	27%	0.266	S	S	.	.			trans	-79.4	76.3	178.1	-63.5	-175.9	88.3	171.9	6.5	110.4	N587 C588 T605 D608	N587-R599 PolarHBondContact ND2-NH2 2.88Å; C588-R599 HydrophobicContact CB-CG 4.13Å; R599-T605 HydrophobicContact CB-CG2 4.02Å; R599-T605 PolarHBondContact NE-O 3.37Å; R599-T605 PolarHBondContact NH2-O 3.03Å; R599-T605 WeakPolarHBondContact O-CG2 3.46Å; R599-D608 IonicContact NH2-OD1 3.7Å
600	E	69.8	Low	77.9	Confident	15 Å²	15	48.3 Å²	48.3	7%	0.07	26%	0.257	C	S	.	.			trans	-140.2	154.5	176.3	55.1	173.2	-157.2	0	0	112.1	R307 F309 W598 A603	R307-E600 WeakPolarHBondContact CD-OE1 3.39Å; R307-E600 IonicContact NH1-OE1 3.85Å; F309-E600 HydrophobicContact CD2-CB 3.63Å; F309-E600 HydrophobicContact CD2-CG 4.49Å; F309-E600 VanDerWaalsContact CD2-OE2 3.32Å; F309-E600 WeakPolarHBondContact CD2-OE2 3.34Å; F309-E600 HydrophobicContact CE2-CB 4.07Å; F309-E600 PolarHBondContact N-OE2 2.81Å; W598-E600 VanDerWaalsContact C-N 3.28Å; W598-E600 HydrophobicContact CB-CG 4.12Å; W598-E600 PolarHBondContact O-N 3.4Å; E600-A603 WeakPolarHBondContact O-CB 3.46Å; E600-A603 PolarHBondContact O-N 3.32Å
601	P	59.8	Low	78.6	Confident	75 Å²	75	47.1 Å²	47.1	49%	0.487	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	136.2	166.1	-28.6	32.9	0	0	0	111.7	F309	F309-P601 HydrophobicContact CE2-CG 4.22Å
602	P	68.4	Low	79.6	Confident	70 Å²	70	46.6 Å²	46.6	46%	0.455	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.1	-0.1	13.3	40.5	-46.6	0	0	0	115	M186 V589	M186-P602 HydrophobicContact CE-CB 3.53Å; M186-P602 HydrophobicContact CE-CG 3.51Å; M186-P602 HydrophobicContact CG-CG 4.28Å; M186-P602 HydrophobicContact SD-CB 3.78Å; M186-P602 HydrophobicContact SD-CG 3.39Å; M186-P602 WeakPolarHBondContact SD-CG 3.34Å; V589-P602 HydrophobicContact CG2-CG 4.38Å
603	A	78.6	Confident	81	Confident	17 Å²	17	43.7 Å²	43.7	14%	0.14	23%	0.229	C	C	.	.	S	Bend	trans	-65.6	146.4	-178.2	0	0	0	0	0	110.3	V589 E600 T605	V589-A603 HydrophobicContact CG2-CB 4.05Å; E600-A603 WeakPolarHBondContact O-CB 3.46Å; E600-A603 PolarHBondContact O-N 3.32Å; A603-T605 PolarHBondContact O-N 3.11Å
604	Y	84.8	Confident	82.8	Confident	116 Å²	116	37 Å²	37	46%	0.455	19%	0.193	S	C	.	.			trans	-80.5	75.7	174.3	-62.2	-69.2	0	0	0	108.7	N587 Y606 R607	N587-Y604 WeakPolarHBondContact CA-O 3.45Å; N587-Y604 WeakPolarHBondContact CB-O 3.27Å; Y604-Y606 AromaticContact CD1-CE1 3.91Å; Y604-Y606 HydrophobicContact CD1-CE1 3.91Å; Y604-Y606 HydrophobicContact CD1-CE2 4.45Å; Y604-Y606 AromaticContact CD1-CZ 3.58Å; Y604-Y606 WeakPolarHBondContact CD1-OH 3.44Å; Y604-Y606 PolarHBondContact O-N 2.94Å; Y604-R607 VanDerWaalsContact CD2-CZ 3.45Å; Y604-R607 WeakPolarHBondContact O-CB 3.5Å; Y604-R607 PolarHBondContact O-N 3.42Å
605	T	86.3	Confident	84.4	Confident	17 Å²	17	34.1 Å²	34.1	10%	0.104	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-23.7	-172	59.5	0	0	0	0	113.7	N587 R599 A603 R607	N587-T605 WeakPolarHBondContact O-CA 3.26Å; R599-T605 HydrophobicContact CB-CG2 4.02Å; R599-T605 PolarHBondContact NE-O 3.37Å; R599-T605 PolarHBondContact NH2-O 3.03Å; R599-T605 WeakPolarHBondContact O-CG2 3.46Å; A603-T605 PolarHBondContact O-N 3.11Å; T605-R607 VanDerWaalsContact C-N 3.32Å; T605-R607 PolarHBondContact O-N 2.92Å
606	Y	85.8	Confident	85.9	Confident	47 Å²	47	33.2 Å²	33.2	18%	0.184	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.1	179.1	57.5	-106	0	0	0	115.9	W430 S559 Y604 T674 H679	W430-Y606 HydrophobicContact CZ2-CG 4.47Å; S559-Y606 WeakPolarHBondContact OG-CE2 3.1Å; Y604-Y606 AromaticContact CD1-CE1 3.91Å; Y604-Y606 HydrophobicContact CD1-CE1 3.91Å; Y604-Y606 HydrophobicContact CD1-CE2 4.45Å; Y604-Y606 AromaticContact CD1-CZ 3.58Å; Y604-Y606 WeakPolarHBondContact CD1-OH 3.44Å; Y604-Y606 PolarHBondContact O-N 2.94Å; Y606-T674 WeakPolarHBondContact O-CB 3.21Å; Y606-T674 PolarHBondContact O-OG1 2.94Å; Y606-H679 VanDerWaalsContact CB-CD2 3.43Å; Y606-H679 WeakPolarHBondContact CB-CD2 3.47Å; Y606-H679 AromaticContact CD1-CD2 3.88Å; Y606-H679 AromaticContact CD1-CE1 3.65Å; Y606-H679 AromaticContact CD1-CG 3.83Å; Y606-H679 AromaticContact CD1-ND1 3.69Å; Y606-H679 AromaticContact CD1-NE2 3.75Å; Y606-H679 HydrophobicContact CD2-CB 3.84Å; Y606-H679 AromaticContact CD2-CG 3.95Å; Y606-H679 AromaticContact CE1-ND1 3.82Å; Y606-H679 HydrophobicContact CE2-CB 4.25Å; Y606-H679 HydrophobicContact CG-CB 4.02Å; Y606-H679 AromaticContact CG-CD2 3.65Å; Y606-H679 AromaticContact CG-CG 3.62Å; Y606-H679 AromaticContact CG-ND1 3.98Å; Y606-H679 AromaticContact CG-NE2 4Å
607	R	93.1	Very high	86.9	Confident	14 Å²	14	35 Å²	35	5%	0.053	18%	0.175	C	C	.	.			trans	-78.2	125.9	177.1	-65.4	177.8	173.7	-175.3	-6.8	109.6	D586 N587 Y604 T605 W672	D586-R607 IonicContact OD1-NH1 2.76Å; N587-R607 HydrophobicContact CB-CB 4.05Å; N587-R607 WeakPolarHBondContact CB-O 3.45Å; N587-R607 PolarHBondContact ND2-O 3.26Å; Y604-R607 VanDerWaalsContact CD2-CZ 3.45Å; Y604-R607 WeakPolarHBondContact O-CB 3.5Å; Y604-R607 PolarHBondContact O-N 3.42Å; T605-R607 VanDerWaalsContact C-N 3.32Å; T605-R607 PolarHBondContact O-N 2.92Å; R607-W672 VanDerWaalsContact CD-CD1 3.46Å; R607-W672 HydrophobicContact CG-CB 4.04Å; R607-W672 HydrophobicContact CG-CG 4.45Å; R607-W672 VanDerWaalsContact CZ-CD2 3.47Å; R607-W672 VanDerWaalsContact NH1-CD1 3.34Å
608	D	92	Very high	87.6	Confident	9 Å²	9	38.7 Å²	38.7	5%	0.048	19%	0.192	C	C	.	.			trans	-104.4	-40.6	-179.8	-60	-62.5	0	0	0	111	R599 S649 S650 H673 T674 W675	R599-D608 IonicContact NH2-OD1 3.7Å; D608-S649 WeakPolarHBondContact O-CA 3.46Å; D608-S650 PolarHBondContact O-N 2.89Å; D608-H673 PolarHBondContact N-O 2.86Å; D608-T674 WeakPolarHBondContact OD2-CA 3.13Å; D608-W675 HydrophobicContact CB-CD2 4.02Å; D608-W675 HydrophobicContact CB-CE3 4.11Å; D608-W675 HydrophobicContact CB-CZ2 4.45Å; D608-W675 HydrophobicContact CB-CZ3 4.35Å; D608-W675 VanDerWaalsContact OD1-CE3 3.28Å; D608-W675 PolarHBondContact OD2-N 3.26Å
609	Y	95.4	Very high	88.7	Confident	8 Å²	8	37.2 Å²	37.2	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.2	177.5	-65.3	-83.3	0	0	0	112.8	E465 T546 F550 L556 F648 S650 H673 W675	E465-Y609 PolarHBondContact OE1-OH 3.15Å; T546-Y609 HydrophobicContact CG2-CG 4.15Å; F550-Y609 HydrophobicContact CB-CD1 3.95Å; F550-Y609 HydrophobicContact CB-CE1 3.37Å; F550-Y609 HydrophobicContact CB-CE2 4.02Å; F550-Y609 VanDerWaalsContact CB-CZ 3.42Å; F550-Y609 HydrophobicContact CD1-CD1 4.45Å; F550-Y609 AromaticContact CD1-CE1 3.85Å; F550-Y609 HydrophobicContact CD1-CE1 3.85Å; F550-Y609 AromaticContact CD2-CD1 3.75Å; F550-Y609 HydrophobicContact CD2-CD1 3.75Å; F550-Y609 AromaticContact CD2-CE1 3.91Å; F550-Y609 HydrophobicContact CD2-CE1 3.91Å; F550-Y609 HydrophobicContact CD2-CG 4.5Å; F550-Y609 HydrophobicContact CE2-CD1 4.36Å; F550-Y609 AromaticContact CG-CD1 3.81Å; F550-Y609 HydrophobicContact CG-CD1 3.81Å; F550-Y609 AromaticContact CG-CE1 3.44Å; F550-Y609 HydrophobicContact CG-CE1 3.44Å; F550-Y609 VanDerWaalsContact CG-CE1 3.44Å; L556-Y609 HydrophobicContact CD1-CD2 3.85Å; L556-Y609 HydrophobicContact CD1-CE2 4.31Å; L556-Y609 HydrophobicContact CD2-CD2 3.94Å; Y609-F648 CarbonylContact C-O 3.6Å; Y609-F648 WeakPolarHBondContact CA-O 3.39Å; Y609-S650 WeakPolarHBondContact CA-OG 3.42Å; Y609-S650 PolarHBondContact N-OG 2.86Å; Y609-H673 PolarHBondContact N-O 3.21Å; Y609-H673 PolarHBondContact O-N 3.2Å; Y609-H673 PolarHBondContact O-ND1 3.17Å; Y609-H673 VanDerWaalsContact O-ND1 3.11Å; Y609-W675 AromaticContact CE2-CZ2 3.72Å; Y609-W675 HydrophobicContact CE2-CZ2 3.72Å
610	S	97.3	Very high	89.4	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.3	176.6	-58.2	0	0	0	0	110.6	D586 A647 F648 S650 L671 W672	D586-S610 VanDerWaalsContact OD2-CB 3.31Å; D586-S610 WeakPolarHBondContact OD2-CB 3.43Å; D586-S610 PolarHBondContact OD2-OG 3.35Å; S610-A647 WeakPolarHBondContact O-CA 3.49Å; S610-F648 PolarHBondContact N-O 3.28Å; S610-F648 PolarHBondContact O-N 2.96Å; S610-S650 PolarHBondContact N-OG 3.43Å; S610-S650 PolarHBondContact OG-OG 3.37Å; S610-L671 CarbonylContact C-O 3.45Å; S610-L671 WeakPolarHBondContact CA-O 3.11Å; S610-W672 VanDerWaalsContact OG-CD1 3.31Å
611	G	97	Very high	90.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	130.9	175.7	0	0	0	0	0	111.3	V646 A670 L671	G611-V646 CarbonylContact C-O 3.59Å; G611-V646 WeakPolarHBondContact CA-O 3.23Å; G611-A670 WeakPolarHBondContact O-CA 3.44Å; G611-L671 PolarHBondContact N-O 3.38Å; G611-L671 PolarHBondContact O-N 2.86Å
612	L	97.9	Very high	92	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.12	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	108.6	168.6	-81.5	93.4	0	0	0	109.7	L645 V646 F648 L669	L612-L645 CarbonylContact O-C 3.58Å; L612-L645 WeakPolarHBondContact O-CA 3.29Å; L612-V646 PolarHBondContact N-O 3.49Å; L612-V646 PolarHBondContact O-N 2.97Å; L612-F648 HydrophobicContact CD1-CE1 3.69Å; L612-F648 HydrophobicContact CD1-CZ 3.82Å; L612-L669 WeakPolarHBondContact CA-O 3.36Å
613	L	98.3	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.4	174.8	176	60.1	0	0	0	110.5	L472 L473 V538 V542 R644 L645 A668 L669	L472-L613 HydrophobicContact CB-CD1 4.14Å; L472-L613 HydrophobicContact CD2-CD1 3.9Å; L472-L613 HydrophobicContact CD2-CD2 3.93Å; L472-L613 HydrophobicContact CD2-CG 4.47Å; L472-L613 HydrophobicContact CG-CD1 4.38Å; L473-L613 HydrophobicContact CD1-CD1 4.38Å; L473-L613 HydrophobicContact CD1-CD2 3.72Å; L473-L613 HydrophobicContact CD1-CG 4.1Å; L473-L613 HydrophobicContact CD2-CD2 4.39Å; L473-L613 HydrophobicContact CG-CD1 4.38Å; L473-L613 HydrophobicContact CG-CD2 3.97Å; V538-L613 HydrophobicContact CG1-CD2 3.27Å; V542-L613 HydrophobicContact CG2-CB 4.3Å; V542-L613 HydrophobicContact CG2-CD2 3.86Å; L613-R644 WeakPolarHBondContact CA-O 3.28Å; L613-L645 HydrophobicContact CB-CD1 4.27Å; L613-L645 HydrophobicContact CD1-CB 4.26Å; L613-A668 CarbonylContact O-C 3.59Å; L613-A668 VanDerWaalsContact O-CA 3.23Å; L613-A668 WeakPolarHBondContact O-CA 3.35Å; L613-L669 HydrophobicContact CB-CB 4.27Å; L613-L669 PolarHBondContact N-O 2.58Å; L613-L669 PolarHBondContact O-N 3.33Å
614	Y	98.3	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.1	-178.3	-69	-60.7	0	0	0	112.7	L624 P640 R641 C642 G643 R644 V646 R666 A668	Y614-L624 WeakPolarHBondContact OH-CB 3.25Å; Y614-P640 HydrophobicContact CD1-CB 3.53Å; Y614-P640 HydrophobicContact CD1-CG 3.91Å; Y614-P640 HydrophobicContact CD2-CB 4.01Å; Y614-P640 HydrophobicContact CD2-CG 4.42Å; Y614-P640 HydrophobicContact CE1-CB 3.92Å; Y614-P640 HydrophobicContact CE1-CG 3.74Å; Y614-P640 HydrophobicContact CE2-CB 4.3Å; Y614-P640 HydrophobicContact CE2-CG 4.2Å; Y614-P640 HydrophobicContact CG-CB 3.61Å; Y614-P640 HydrophobicContact CG-CG 4.27Å; Y614-R641 WeakPolarHBondContact CB-O 3.38Å; Y614-C642 CarbonylContact O-C 3.56Å; Y614-C642 WeakPolarHBondContact O-CA 3.44Å; Y614-G643 PolarHBondContact O-N 3.5Å; Y614-R644 HydrophobicContact CD2-CB 4.25Å; Y614-R644 HydrophobicContact CD2-CG 4.17Å; Y614-R644 PolarHBondContact N-O 3.41Å; Y614-V646 HydrophobicContact CD2-CG2 4.41Å; Y614-V646 HydrophobicContact CE2-CG2 3.75Å; Y614-R666 VanDerWaalsContact CE1-CZ 3.45Å; Y614-R666 PolarHBondContact OH-NH2 2.9Å; Y614-A668 HydrophobicContact CD1-CB 3.79Å; Y614-A668 HydrophobicContact CE1-CB 3.94Å
615	L	98	Very high	94.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.134	C	C	.	.			trans	-102.9	-19	-177.4	-57	-174.9	0	0	0	113.3	L473 C478 L481 L482 L563 C642 C667	L473-L615 HydrophobicContact CD1-CD2 3.6Å; C478-L615 WeakPolarHBondContact CB-O 3.39Å; L481-L615 HydrophobicContact CB-CD1 3.83Å; L481-L615 HydrophobicContact CB-CD2 4.33Å; L481-L615 HydrophobicContact CD1-CD2 3.83Å; L482-L615 HydrophobicContact CD2-CB 3.9Å; L482-L615 HydrophobicContact CD2-CD1 4.44Å; L482-L615 HydrophobicContact CG-CB 4.09Å; L563-L615 HydrophobicContact CD1-CD1 3.46Å; L563-L615 VanDerWaalsContact CD1-CD1 3.46Å; L615-C642 WeakPolarHBondContact O-CB 3.46Å; L615-C667 HydrophobicContact CB-CB 4.28Å; L615-C667 HydrophobicContact CD1-CB 4.21Å; L615-C667 PolarHBondContact N-O 3.49Å; L615-C667 VanDerWaalsContact N-O 3.1Å
616	N	97.4	Very high	95.4	Very high	10 Å²	10	24.3 Å²	24.3	5%	0.053	13%	0.129	C	C	.	.			trans	-155.7	169.5	-175.3	70.2	-44.9	0	0	0	113.5	L482 D618 F619 R665 C667	L482-N616 HydrophobicContact CD1-CB 4.05Å; L482-N616 HydrophobicContact CD2-CB 4.29Å; N616-D618 VanDerWaalsContact CB-OD1 3.32Å; N616-D618 WeakPolarHBondContact CB-OD1 3.43Å; N616-D618 PolarHBondContact ND2-OD1 2.98Å; N616-F619 WeakPolarHBondContact O-CE1 3.34Å; N616-R665 PolarHBondContact ND2-O 2.88Å; N616-C667 PolarHBondContact OD1-N 3.44Å; N616-C667 PolarHBondContact OD1-O 3.43Å
617	D	95.6	Very high	95.6	Very high	96 Å²	96	22.2 Å²	22.2	51%	0.513	12%	0.121	S	C	.	.			trans	-139.3	6.2	177.8	51.9	3.7	0	0	0	114.1	F619 R641	D617-F619 PolarHBondContact O-N 3.28Å; D617-R641 HydrophobicContact CB-CB 4.3Å
618	D	94.9	Very high	95.3	Very high	121 Å²	121	25.6 Å²	25.6	65%	0.647	14%	0.137	S	C	*	.			trans	-80	45.3	179	63.8	-44.9	0	0	0	113	N616	N616-D618 VanDerWaalsContact CB-OD1 3.32Å; N616-D618 WeakPolarHBondContact CB-OD1 3.43Å; N616-D618 PolarHBondContact ND2-OD1 2.98Å
619	F	94.8	Very high	94.7	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.083	15%	0.151	C	C	.	.	S	Bend	trans	-143.9	168.6	178.2	61.7	-94.1	0	0	0	112.4	N616 D617 G621 P640 R663 R666	N616-F619 WeakPolarHBondContact O-CE1 3.34Å; D617-F619 PolarHBondContact O-N 3.28Å; F619-G621 VanDerWaalsContact CE2-O 3.31Å; F619-G621 WeakPolarHBondContact CE2-O 3.21Å; F619-P640 HydrophobicContact CE1-CB 4.22Å; F619-P640 HydrophobicContact CE2-CB 4.41Å; F619-P640 HydrophobicContact CE2-CG 4.18Å; F619-P640 HydrophobicContact CZ-CB 3.5Å; F619-P640 HydrophobicContact CZ-CG 3.68Å; F619-R663 WeakPolarHBondContact CA-O 3.37Å; F619-R663 VanDerWaalsContact CB-O 3.24Å; F619-R663 WeakPolarHBondContact CB-O 3.42Å; F619-R666 HydrophobicContact CD1-CB 3.94Å; F619-R666 HydrophobicContact CD1-CG 4.48Å; F619-R666 HydrophobicContact CD2-CB 4.04Å; F619-R666 HydrophobicContact CE1-CB 3.72Å; F619-R666 HydrophobicContact CE1-CG 3.76Å; F619-R666 HydrophobicContact CE2-CB 3.85Å; F619-R666 HydrophobicContact CE2-CG 3.87Å; F619-R666 HydrophobicContact CG-CB 4.07Å; F619-R666 HydrophobicContact CZ-CB 3.65Å; F619-R666 HydrophobicContact CZ-CG 3.39Å
620	Q	93.1	Very high	93.8	Very high	104 Å²	104	29.5 Å²	29.5	49%	0.486	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.5	175.6	-59.1	-175.9	6.4	0	0	111	T662 R663	Q620-T662 WeakPolarHBondContact CB-OG1 3.43Å; Q620-T662 PolarHBondContact O-N 3.46Å; Q620-T662 PolarHBondContact O-OG1 3.19Å; Q620-R663 HydrophobicContact CB-CB 4Å; Q620-R663 HydrophobicContact CG-CB 4.13Å; Q620-R663 PolarHBondContact N-O 2.63Å
621	G	91.9	Very high	93	Very high	33 Å²	33	30.5 Å²	30.5	34%	0.34	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.9	-150.3	-171.8	0	0	0	0	0	111.9	F619 D623 A660	F619-G621 VanDerWaalsContact CE2-O 3.31Å; F619-G621 WeakPolarHBondContact CE2-O 3.21Å; G621-D623 PolarHBondContact O-N 3.21Å; G621-A660 CarbonylContact C-O 3.56Å; G621-A660 VanDerWaalsContact CA-O 3.27Å; G621-A660 WeakPolarHBondContact CA-O 3.27Å
622	G	93.8	Very high	92.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.			trans	71.5	9.9	172.2	0	0	0	0	0	116.4	W659 A660 R666	G622-W659 VanDerWaalsContact CA-O 3.22Å; G622-W659 WeakPolarHBondContact CA-O 3.18Å; G622-W659 PolarHBondContact N-O 3.23Å; G622-A660 PolarHBondContact N-O 3.5Å; G622-R666 PolarHBondContact O-NE 3.46Å; G622-R666 PolarHBondContact O-NH2 2.89Å
623	D	96.3	Very high	91.5	Very high	17 Å²	17	39.4 Å²	39.4	9%	0.091	22%	0.219	C	C	.	.			trans	-64.3	137.4	177.2	-74.1	-12.3	0	0	0	110.7	G621 R637 P640 W659	G621-D623 PolarHBondContact O-N 3.21Å; D623-R637 HydrophobicContact CB-CG 3.87Å; D623-R637 WeakPolarHBondContact OD2-CD 3.37Å; D623-R637 IonicContact OD2-CZ 3.37Å; D623-R637 IonicContact OD2-NE 2.96Å; D623-R637 PolarHBondContact OD2-NE 2.91Å; D623-R637 IonicContact OD2-NH1 3.54Å; D623-P640 WeakPolarHBondContact OD1-CD 3.1Å; D623-W659 PolarHBondContact O-N 3.49Å
624	L	97.4	Very high	91.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	139.7	167.5	175.9	76.5	0	0	0	108.5	Y614 F626 R637 V638 V646 H656 V658	Y614-L624 WeakPolarHBondContact OH-CB 3.25Å; L624-F626 HydrophobicContact CD2-CE2 4.02Å; L624-F626 HydrophobicContact CD2-CZ 4.07Å; L624-R637 CarbonylContact O-C 3.56Å; L624-R637 WeakPolarHBondContact O-CA 3.2Å; L624-V638 HydrophobicContact CB-CB 4.46Å; L624-V638 PolarHBondContact N-O 3.05Å; L624-V638 VanDerWaalsContact N-O 3.08Å; L624-V638 PolarHBondContact O-N 3.49Å; L624-V646 HydrophobicContact CD2-CB 4.05Å; L624-V646 HydrophobicContact CD2-CG1 3.73Å; L624-V646 HydrophobicContact CD2-CG2 4.07Å; L624-H656 HydrophobicContact CD1-CB 4.26Å; L624-V658 HydrophobicContact CD1-CG2 4.24Å
625	F	97.2	Very high	90.9	Very high	6 Å²	6	44.2 Å²	44.2	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.1	171.5	67.2	-83.9	0	0	0	111	L579 V583 T627 V634 A636 H656 G657 W659	L579-F625 HydrophobicContact CD1-CE1 4.37Å; L579-F625 HydrophobicContact CD1-CZ 3.81Å; L579-F625 HydrophobicContact CD2-CE1 3.83Å; L579-F625 HydrophobicContact CD2-CZ 3.92Å; V583-F625 HydrophobicContact CG2-CE2 3.63Å; V583-F625 HydrophobicContact CG2-CZ 3.71Å; F625-T627 HydrophobicContact CD2-CG2 3.66Å; F625-T627 HydrophobicContact CE2-CG2 3.55Å; F625-V634 HydrophobicContact CB-CG1 4.14Å; F625-V634 HydrophobicContact CD2-CG1 4.48Å; F625-V634 HydrophobicContact CD2-CG2 3.95Å; F625-V634 HydrophobicContact CE2-CG2 4.44Å; F625-A636 CarbonylContact C-O 3.48Å; F625-A636 VanDerWaalsContact CA-O 3.23Å; F625-A636 WeakPolarHBondContact CA-O 3.31Å; F625-A636 WeakPolarHBondContact CB-O 3.27Å; F625-H656 CarbonylContact O-C 3.6Å; F625-H656 WeakPolarHBondContact O-CA 3.41Å; F625-H656 WeakPolarHBondContact O-CB 3.39Å; F625-G657 WeakPolarHBondContact CD1-O 3.09Å; F625-G657 WeakPolarHBondContact CE1-O 3.32Å; F625-G657 PolarHBondContact N-O 2.76Å; F625-G657 PolarHBondContact O-N 2.6Å; F625-W659 AromaticContact CD1-CD1 3.44Å; F625-W659 VanDerWaalsContact CD1-CD1 3.44Å; F625-W659 HydrophobicContact CD1-CD2 4.13Å; F625-W659 AromaticContact CD1-CE2 3.68Å; F625-W659 HydrophobicContact CD1-CG 4.01Å; F625-W659 HydrophobicContact CD1-CZ2 4.31Å; F625-W659 AromaticContact CD1-NE1 3.23Å; F625-W659 HydrophobicContact CE1-CD2 4.06Å; F625-W659 AromaticContact CE1-CE2 3.87Å; F625-W659 HydrophobicContact CE1-CG 4.2Å; F625-W659 HydrophobicContact CE1-CZ2 4.31Å; F625-W659 AromaticContact CE1-NE1 3.89Å; F625-W659 HydrophobicContact CG-CZ2 4.49Å; F625-W659 AromaticContact CG-NE1 3.63Å
626	F	96.9	Very high	90.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	150.2	172.2	-66.6	-83.7	0	0	0	109.7	R466 L624 V634 T635 A636 V638 V646 F648 N654 P655 H656	R466-F626 VanDerWaalsContact NH1-CB 3.31Å; L624-F626 HydrophobicContact CD2-CE2 4.02Å; L624-F626 HydrophobicContact CD2-CZ 4.07Å; F626-V634 CarbonylContact O-C 3.53Å; F626-V634 WeakPolarHBondContact O-CA 3.04Å; F626-T635 PolarHBondContact O-N 2.94Å; F626-T635 PolarHBondContact O-OG1 3.49Å; F626-A636 HydrophobicContact CD2-CB 4.27Å; F626-A636 PolarHBondContact N-O 3.41Å; F626-V638 HydrophobicContact CE2-CG2 4.37Å; F626-V646 HydrophobicContact CE2-CG1 4.2Å; F626-V646 HydrophobicContact CZ-CG1 4.04Å; F626-F648 HydrophobicContact CE1-CB 4.32Å; F626-F648 HydrophobicContact CE1-CD1 4.07Å; F626-F648 HydrophobicContact CE1-CD2 4.01Å; F626-F648 HydrophobicContact CE1-CE1 4.4Å; F626-F648 HydrophobicContact CE1-CE2 4.36Å; F626-F648 AromaticContact CE1-CG 3.87Å; F626-F648 HydrophobicContact CE1-CG 3.87Å; F626-F648 HydrophobicContact CZ-CB 4.36Å; F626-F648 AromaticContact CZ-CD1 3.79Å; F626-F648 HydrophobicContact CZ-CD1 3.79Å; F626-F648 HydrophobicContact CZ-CE1 4.21Å; F626-F648 AromaticContact CZ-CG 3.99Å; F626-F648 HydrophobicContact CZ-CG 3.99Å; F626-N654 HydrophobicContact CD1-CB 4.21Å; F626-N654 HydrophobicContact CE1-CB 4.12Å; F626-P655 CarbonylContact C-O 3.57Å; F626-P655 WeakPolarHBondContact CA-O 3.3Å; F626-H656 HydrophobicContact CD1-CB 3.74Å; F626-H656 HydrophobicContact CE1-CB 3.96Å; F626-H656 HydrophobicContact CG-CB 4.46Å
627	T	91.3	Very high	90.7	Very high	4 Å²	4	52.1 Å²	52.1	3%	0.025	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	169	176.1	67.5	0	0	0	0	111.7	V583 F625 A631 T633 V634 P655	V583-T627 HydrophobicContact CG1-CG2 4.36Å; V583-T627 HydrophobicContact CG2-CG2 4.22Å; F625-T627 HydrophobicContact CD2-CG2 3.66Å; F625-T627 HydrophobicContact CE2-CG2 3.55Å; T627-A631 WeakPolarHBondContact OG1-CA 3.48Å; T627-T633 CarbonylContact C-O 3.54Å; T627-T633 WeakPolarHBondContact CA-O 3.02Å; T627-T633 VanDerWaalsContact CB-O 3.31Å; T627-T633 WeakPolarHBondContact CB-O 3.38Å; T627-V634 HydrophobicContact CG2-CG2 4.48Å; T627-P655 PolarHBondContact N-O 3.31Å; T627-P655 WeakPolarHBondContact OG1-CB 3.47Å
628	E	86.5	Confident	90.8	Very high	84 Å²	84	47.6 Å²	47.6	39%	0.393	26%	0.256	S	S	.	.			trans	-66.3	167.5	156.9	-68.1	177.3	168	0	0	110.5	N630 A631 T633 T635	E628-N630 PolarHBondContact O-N 3.05Å; E628-N630 PolarHBondContact OE2-ND2 3.4Å; E628-A631 PolarHBondContact O-N 2.92Å; E628-T633 HydrophobicContact CG-CG2 4.19Å; E628-T633 PolarHBondContact N-O 2.97Å; E628-T633 VanDerWaalsContact OE2-CB 3.23Å; E628-T633 WeakPolarHBondContact OE2-CB 3.25Å; E628-T633 PolarHBondContact OE2-OG1 3.4Å; E628-T635 HydrophobicContact CG-CG2 3.73Å
629	P	79.1	Confident	90.9	Very high	51 Å²	51	49.5 Å²	49.5	33%	0.331	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.6	177.1	-28.3	36.6	0	0	0	115	L590 G595 A631	L590-P629 HydrophobicContact CD1-CB 4.33Å; G595-P629 VanDerWaalsContact O-CB 3.3Å; G595-P629 WeakPolarHBondContact O-CB 3Å; P629-A631 PolarHBondContact O-N 2.86Å; P629-A631 VanDerWaalsContact O-N 3.11Å
630	N	76.9	Confident	91	Very high	48 Å²	48	48.8 Å²	48.8	26%	0.257	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-4.2	174	61.5	35.9	0	0	0	114.9	P592 E628 L632 T633	P592-N630 WeakPolarHBondContact O-CA 3.46Å; E628-N630 PolarHBondContact O-N 3.05Å; E628-N630 PolarHBondContact OE2-ND2 3.4Å; N630-L632 WeakPolarHBondContact O-CG 3.48Å; N630-L632 PolarHBondContact O-N 3.42Å; N630-L632 PolarHBondContact OD1-N 2.95Å; N630-T633 PolarHBondContact ND2-OG1 3.04Å; N630-T633 PolarHBondContact OD1-N 3.33Å
631	A	80.5	Confident	91.1	Very high	23 Å²	23	48.4 Å²	48.4	19%	0.19	25%	0.245	C	C	.	.	S	Bend	trans	58.2	10.6	-179	0	0	0	0	0	116.1	V583 L590 P592 T627 E628 P629	V583-A631 HydrophobicContact CB-CB 3.99Å; V583-A631 HydrophobicContact CG1-CB 3.65Å; L590-A631 HydrophobicContact CD2-CB 4.48Å; P592-A631 HydrophobicContact CB-CB 4Å; P592-A631 HydrophobicContact CG-CB 4.1Å; T627-A631 WeakPolarHBondContact OG1-CA 3.48Å; E628-A631 PolarHBondContact O-N 2.92Å; P629-A631 PolarHBondContact O-N 2.86Å; P629-A631 VanDerWaalsContact O-N 3.11Å
632	L	78.8	Confident	91.3	Very high	149 Å²	149	48.6 Å²	48.6	78%	0.78	24%	0.241	S	C	*	.	S	Bend	trans	-116.7	-44.8	-175.4	-67.9	173.9	0	0	0	111.9	N630 V634	N630-L632 WeakPolarHBondContact O-CG 3.48Å; N630-L632 PolarHBondContact O-N 3.42Å; N630-L632 PolarHBondContact OD1-N 2.95Å; L632-V634 PolarHBondContact O-N 2.95Å
633	T	84.9	Confident	91.4	Very high	62 Å²	62	48.6 Å²	48.6	38%	0.38	24%	0.241	S	C	.	.	S	Bend	trans	-79.8	107.7	-176.6	-54.4	0	0	0	0	110.2	T627 E628 N630 T635	T627-T633 CarbonylContact C-O 3.54Å; T627-T633 WeakPolarHBondContact CA-O 3.02Å; T627-T633 VanDerWaalsContact CB-O 3.31Å; T627-T633 WeakPolarHBondContact CB-O 3.38Å; E628-T633 HydrophobicContact CG-CG2 4.19Å; E628-T633 PolarHBondContact N-O 2.97Å; E628-T633 VanDerWaalsContact OE2-CB 3.23Å; E628-T633 WeakPolarHBondContact OE2-CB 3.25Å; E628-T633 PolarHBondContact OE2-OG1 3.4Å; N630-T633 PolarHBondContact ND2-OG1 3.04Å; N630-T633 PolarHBondContact OD1-N 3.33Å; T633-T635 PolarHBondContact O-N 3.44Å
634	V	92.3	Very high	91.5	Very high	70 Å²	70	48.9 Å²	48.9	42%	0.424	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123	176.4	178.5	0	0	0	0	110.4	F625 F626 T627 L632 W659	F625-V634 HydrophobicContact CB-CG1 4.14Å; F625-V634 HydrophobicContact CD2-CG1 4.48Å; F625-V634 HydrophobicContact CD2-CG2 3.95Å; F625-V634 HydrophobicContact CE2-CG2 4.44Å; F626-V634 CarbonylContact O-C 3.53Å; F626-V634 WeakPolarHBondContact O-CA 3.04Å; T627-V634 HydrophobicContact CG2-CG2 4.48Å; L632-V634 PolarHBondContact O-N 2.95Å; V634-W659 HydrophobicContact CG2-CZ2 4.48Å
635	T	91.8	Very high	91.5	Very high	30 Å²	30	48.9 Å²	48.9	18%	0.184	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-33.6	-178.7	53.4	0	0	0	0	112.9	N462 R466 F626 E628 T633	N462-T635 PolarHBondContact ND2-O 3.43Å; N462-T635 VanDerWaalsContact ND2-O 3.14Å; R466-T635 PolarHBondContact NH2-OG1 2.97Å; F626-T635 PolarHBondContact O-N 2.94Å; F626-T635 PolarHBondContact O-OG1 3.49Å; E628-T635 HydrophobicContact CG-CG2 3.73Å; T633-T635 PolarHBondContact O-N 3.44Å
636	A	95.1	Very high	91.5	Very high	14 Å²	14	48.6 Å²	48.6	12%	0.116	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	158	176.7	0	0	0	0	0	112.5	L461 F625 F626	L461-A636 HydrophobicContact CB-CB 4.33Å; L461-A636 HydrophobicContact CD2-CB 4.21Å; L461-A636 WeakPolarHBondContact O-CB 3.46Å; F625-A636 CarbonylContact C-O 3.48Å; F625-A636 VanDerWaalsContact CA-O 3.23Å; F625-A636 WeakPolarHBondContact CA-O 3.31Å; F625-A636 WeakPolarHBondContact CB-O 3.27Å; F626-A636 HydrophobicContact CD2-CB 4.27Å; F626-A636 PolarHBondContact N-O 3.41Å
637	R	96.3	Very high	91.4	Very high	163 Å²	163	48.7 Å²	48.7	62%	0.615	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.2	175.9	-172.7	180	71.9	172.5	-0.8	110.3	D623 L624	D623-R637 HydrophobicContact CB-CG 3.87Å; D623-R637 WeakPolarHBondContact OD2-CD 3.37Å; D623-R637 IonicContact OD2-CZ 3.37Å; D623-R637 IonicContact OD2-NE 2.96Å; D623-R637 PolarHBondContact OD2-NE 2.91Å; D623-R637 IonicContact OD2-NH1 3.54Å; L624-R637 CarbonylContact O-C 3.56Å; L624-R637 WeakPolarHBondContact O-CA 3.2Å
638	V	96.7	Very high	91.6	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.7	178.2	-173.5	0	0	0	0	109.7	L461 V468 L624 F626 V646	L461-V638 HydrophobicContact CD2-CG2 3.98Å; V468-V638 HydrophobicContact CG1-CG1 4.33Å; V468-V638 HydrophobicContact CG2-CG1 3.84Å; V468-V638 HydrophobicContact CG2-CG2 3.79Å; L624-V638 HydrophobicContact CB-CB 4.46Å; L624-V638 PolarHBondContact N-O 3.05Å; L624-V638 VanDerWaalsContact N-O 3.08Å; L624-V638 PolarHBondContact O-N 3.49Å; F626-V638 HydrophobicContact CE2-CG2 4.37Å; V638-V646 HydrophobicContact CB-CG2 4.3Å; V638-V646 HydrophobicContact CG1-CG2 3.68Å
639	R	96.5	Very high	92	Very high	161 Å²	161	44.7 Å²	44.7	61%	0.608	22%	0.222	S	C	*	.			trans	-81.3	127	176.4	-172.1	166.5	-175	151.6	2.1	110.6	R644	R639-R644 WeakPolarHBondContact O-CD 3.49Å; R639-R644 PolarHBondContact O-NH1 3.46Å
640	P	96.8	Very high	92.7	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.026	21%	0.206	C	C	.	.			trans	-60.1	144.8	174.9	-29.8	40	0	0	0	113.3	Y614 F619 D623	Y614-P640 HydrophobicContact CD1-CB 3.53Å; Y614-P640 HydrophobicContact CD1-CG 3.91Å; Y614-P640 HydrophobicContact CD2-CB 4.01Å; Y614-P640 HydrophobicContact CD2-CG 4.42Å; Y614-P640 HydrophobicContact CE1-CB 3.92Å; Y614-P640 HydrophobicContact CE1-CG 3.74Å; Y614-P640 HydrophobicContact CE2-CB 4.3Å; Y614-P640 HydrophobicContact CE2-CG 4.2Å; Y614-P640 HydrophobicContact CG-CB 3.61Å; Y614-P640 HydrophobicContact CG-CG 4.27Å; F619-P640 HydrophobicContact CE1-CB 4.22Å; F619-P640 HydrophobicContact CE2-CB 4.41Å; F619-P640 HydrophobicContact CE2-CG 4.18Å; F619-P640 HydrophobicContact CZ-CB 3.5Å; F619-P640 HydrophobicContact CZ-CG 3.68Å; D623-P640 WeakPolarHBondContact OD1-CD 3.1Å
641	R	95.8	Very high	93.2	Very high	96 Å²	96	40.1 Å²	40.1	36%	0.362	20%	0.196	S	C	.	.			trans	-157.4	154.3	166.6	63.7	-178.7	178.2	-175.9	-0.5	111.1	D470 Y614 D617 G643 R644	D470-R641 IonicContact OD1-CZ 3.56Å; D470-R641 IonicContact OD1-NE 2.77Å; D470-R641 PolarHBondContact OD1-NE 3.44Å; D470-R641 IonicContact OD1-NH2 3.56Å; D470-R641 PolarHBondContact OD1-NH2 3.12Å; D470-R641 IonicContact OD2-CZ 3.67Å; D470-R641 IonicContact OD2-NE 3.44Å; D470-R641 IonicContact OD2-NH2 2.99Å; D470-R641 PolarHBondContact OD2-NH2 2.91Å; Y614-R641 WeakPolarHBondContact CB-O 3.38Å; D617-R641 HydrophobicContact CB-CB 4.3Å; R641-G643 PolarHBondContact O-N 2.95Å; R641-R644 HydrophobicContact CG-CB 3.59Å; R641-R644 HydrophobicContact CG-CG 4.42Å; R641-R644 VanDerWaalsContact O-CB 3.27Å; R641-R644 WeakPolarHBondContact O-CB 3.4Å; R641-R644 PolarHBondContact O-N 3.23Å; R641-R644 VanDerWaalsContact O-N 3.08Å
642	C	97.2	Very high	93.5	Very high	37 Å²	37	39.6 Å²	39.6	25%	0.25	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	130.5	176.9	163.8	0	0	0	0	111	C478 Y614 L615 R644	C478-C642 HydrophobicContact CB-CB 4.01Å; C478-C642 WeakPolarHBondContact CB-SG 3.25Å; C478-C642 VanDerWaalsContact SG-CA 3.6Å; C478-C642 WeakPolarHBondContact SG-CB 3.42Å; C478-C642 CovalentContact SG-SG 2.04Å; C478-C642 PolarHBondContact SG-SG 3.36Å; Y614-C642 CarbonylContact O-C 3.56Å; Y614-C642 WeakPolarHBondContact O-CA 3.44Å; L615-C642 WeakPolarHBondContact O-CB 3.46Å; C642-R644 VanDerWaalsContact C-N 3.26Å; C642-R644 PolarHBondContact O-N 2.97Å
643	G	95.4	Very high	93.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	8.3	177.1	0	0	0	0	0	115.1	G471 L472 Y614 R641	G471-G643 PolarHBondContact N-O 3.29Å; L472-G643 PolarHBondContact N-O 2.87Å; L472-G643 VanDerWaalsContact N-O 3.08Å; Y614-G643 PolarHBondContact O-N 3.5Å; R641-G643 PolarHBondContact O-N 2.95Å
644	R	97.6	Very high	94.3	Very high	24 Å²	24	33.2 Å²	33.2	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.4	173.2	176.9	166.7	-78.9	-173.5	-19.4	111.2	V468 L469 D470 L613 Y614 R639 R641 C642	V468-R644 HydrophobicContact CG1-CG 3.78Å; L469-R644 CarbonylContact O-C 3.58Å; L469-R644 WeakPolarHBondContact O-CA 3.49Å; D470-R644 WeakPolarHBondContact OD1-CB 3.37Å; D470-R644 WeakPolarHBondContact OD1-CG 3.41Å; D470-R644 IonicContact OD1-CZ 3.14Å; D470-R644 IonicContact OD1-NE 2.9Å; D470-R644 PolarHBondContact OD1-NE 3.44Å; D470-R644 IonicContact OD1-NH2 2.69Å; D470-R644 IonicContact OD2-CZ 2.74Å; D470-R644 IonicContact OD2-NE 3.75Å; D470-R644 PolarHBondContact OD2-NE 3.18Å; D470-R644 IonicContact OD2-NH2 2.7Å; D470-R644 PolarHBondContact OD2-NH2 3.5Å; L613-R644 WeakPolarHBondContact CA-O 3.28Å; Y614-R644 HydrophobicContact CD2-CB 4.25Å; Y614-R644 HydrophobicContact CD2-CG 4.17Å; Y614-R644 PolarHBondContact N-O 3.41Å; R639-R644 WeakPolarHBondContact O-CD 3.49Å; R639-R644 PolarHBondContact O-NH1 3.46Å; R641-R644 HydrophobicContact CG-CB 3.59Å; R641-R644 HydrophobicContact CG-CG 4.42Å; R641-R644 VanDerWaalsContact O-CB 3.27Å; R641-R644 WeakPolarHBondContact O-CB 3.4Å; R641-R644 PolarHBondContact O-N 3.23Å; R641-R644 VanDerWaalsContact O-N 3.08Å; C642-R644 VanDerWaalsContact C-N 3.26Å; C642-R644 PolarHBondContact O-N 2.97Å
645	L	96.8	Very high	94.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.1	169.4	175.9	61	0	0	0	110.1	V468 L469 L472 V542 L545 L612 L613 A647	V468-L645 CarbonylContact C-O 3.46Å; V468-L645 WeakPolarHBondContact CA-O 3.48Å; L469-L645 HydrophobicContact CB-CB 4.47Å; L469-L645 HydrophobicContact CD1-CD2 4.35Å; L469-L645 PolarHBondContact N-O 3.26Å; L469-L645 PolarHBondContact O-N 3.3Å; L472-L645 HydrophobicContact CD2-CB 4.13Å; L472-L645 HydrophobicContact CD2-CD2 4.01Å; V542-L645 HydrophobicContact CG1-CD1 3.73Å; V542-L645 HydrophobicContact CG1-CD2 4Å; V542-L645 HydrophobicContact CG2-CD1 4.3Å; V542-L645 HydrophobicContact CG2-CD2 4.5Å; L545-L645 HydrophobicContact CB-CD2 4.43Å; L545-L645 HydrophobicContact CD1-CD2 4.37Å; L612-L645 CarbonylContact O-C 3.58Å; L612-L645 WeakPolarHBondContact O-CA 3.29Å; L613-L645 HydrophobicContact CB-CD1 4.27Å; L613-L645 HydrophobicContact CD1-CB 4.26Å; L645-A647 HydrophobicContact CD2-CB 4.38Å; L645-A647 HydrophobicContact CG-CB 4.24Å
646	V	97.9	Very high	94.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.4	162.5	-166.6	0	0	0	0	107.4	A467 V468 G611 L612 Y614 L624 F626 V638 F648	A467-V646 WeakPolarHBondContact O-CA 3.47Å; V468-V646 HydrophobicContact CG2-CG1 4.25Å; V468-V646 HydrophobicContact CG2-CG2 4.28Å; G611-V646 CarbonylContact C-O 3.59Å; G611-V646 WeakPolarHBondContact CA-O 3.23Å; L612-V646 PolarHBondContact N-O 3.49Å; L612-V646 PolarHBondContact O-N 2.97Å; Y614-V646 HydrophobicContact CD2-CG2 4.41Å; Y614-V646 HydrophobicContact CE2-CG2 3.75Å; L624-V646 HydrophobicContact CD2-CB 4.05Å; L624-V646 HydrophobicContact CD2-CG1 3.73Å; L624-V646 HydrophobicContact CD2-CG2 4.07Å; F626-V646 HydrophobicContact CE2-CG1 4.2Å; F626-V646 HydrophobicContact CZ-CG1 4.04Å; V638-V646 HydrophobicContact CB-CG2 4.3Å; V638-V646 HydrophobicContact CG1-CG2 3.68Å; V646-F648 HydrophobicContact CG1-CD1 4.07Å; V646-F648 HydrophobicContact CG1-CE1 4.44Å
647	A	94.7	Very high	94.6	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.1	179.9	0	0	0	0	0	109.4	R466 A467 F550 S610 L645	R466-A647 CarbonylContact C-O 3.59Å; R466-A647 WeakPolarHBondContact CA-O 3.29Å; A467-A647 PolarHBondContact N-O 3.33Å; A467-A647 PolarHBondContact O-N 3.44Å; F550-A647 HydrophobicContact CE2-CB 3.77Å; F550-A647 WeakPolarHBondContact CZ-O 3.44Å; S610-A647 WeakPolarHBondContact O-CA 3.49Å; L645-A647 HydrophobicContact CD2-CB 4.38Å; L645-A647 HydrophobicContact CG-CB 4.24Å
648	F	96.4	Very high	94.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.9	-174.9	55	-84.4	0	0	0	111.9	E465 R466 Y609 S610 L612 F626 V646 N654 H656	E465-F648 CarbonylContact O-C 3.54Å; E465-F648 WeakPolarHBondContact O-CA 3.5Å; R466-F648 HydrophobicContact CB-CB 3.61Å; Y609-F648 CarbonylContact C-O 3.6Å; Y609-F648 WeakPolarHBondContact CA-O 3.39Å; S610-F648 PolarHBondContact N-O 3.28Å; S610-F648 PolarHBondContact O-N 2.96Å; L612-F648 HydrophobicContact CD1-CE1 3.69Å; L612-F648 HydrophobicContact CD1-CZ 3.82Å; F626-F648 HydrophobicContact CE1-CB 4.32Å; F626-F648 HydrophobicContact CE1-CD1 4.07Å; F626-F648 HydrophobicContact CE1-CD2 4.01Å; F626-F648 HydrophobicContact CE1-CE1 4.4Å; F626-F648 HydrophobicContact CE1-CE2 4.36Å; F626-F648 AromaticContact CE1-CG 3.87Å; F626-F648 HydrophobicContact CE1-CG 3.87Å; F626-F648 HydrophobicContact CZ-CB 4.36Å; F626-F648 AromaticContact CZ-CD1 3.79Å; F626-F648 HydrophobicContact CZ-CD1 3.79Å; F626-F648 HydrophobicContact CZ-CE1 4.21Å; F626-F648 AromaticContact CZ-CG 3.99Å; F626-F648 HydrophobicContact CZ-CG 3.99Å; V646-F648 HydrophobicContact CG1-CD1 4.07Å; V646-F648 HydrophobicContact CG1-CE1 4.44Å; F648-N654 HydrophobicContact CB-CB 4.44Å; F648-N654 HydrophobicContact CD2-CB 3.88Å; F648-H656 AromaticContact CE2-CE1 3.4Å; F648-H656 WeakPolarHBondContact CE2-CE1 3.37Å; F648-H656 AromaticContact CE2-ND1 3.46Å; F648-H656 WeakPolarHBondContact CE2-ND1 3.46Å; F648-H656 AromaticContact CZ-CE1 3.62Å; F648-H656 AromaticContact CZ-ND1 3.85Å; F648-H656 AromaticContact CZ-NE2 3.73Å
649	S	93.8	Very high	94.5	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.021	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	141.8	173.1	59.9	0	0	0	0	111.4	E465 D608 G651 E653 N654	E465-S649 PolarHBondContact O-N 2.86Å; D608-S649 WeakPolarHBondContact O-CA 3.46Å; S649-G651 PolarHBondContact O-N 3.49Å; S649-E653 WeakPolarHBondContact CB-OE1 3.31Å; S649-E653 WeakPolarHBondContact OG-CG 3.26Å; S649-E653 PolarHBondContact OG-OE1 2.91Å; S649-N654 WeakPolarHBondContact O-CB 3.34Å; S649-N654 PolarHBondContact OG-ND2 3.48Å
650	S	94.7	Very high	94.2	Very high	1 Å²	1	19 Å²	19	1%	0.007	9%	0.09	C	C	.	.	S	Bend	trans	-78.5	1	-170.1	-63.3	0	0	0	0	114.8	D586 N587 D608 Y609 S610	D586-S650 PolarHBondContact N-O 2.88Å; N587-S650 PolarHBondContact N-O 3.22Å; N587-S650 PolarHBondContact OD1-O 2.84Å; D608-S650 PolarHBondContact O-N 2.89Å; Y609-S650 WeakPolarHBondContact CA-OG 3.42Å; Y609-S650 PolarHBondContact N-OG 2.86Å; S610-S650 PolarHBondContact N-OG 3.43Å; S610-S650 PolarHBondContact OG-OG 3.37Å
651	G	88	Confident	94	Very high	3 Å²	3	18.8 Å²	18.8	3%	0.031	9%	0.089	C	C	.	.	S	Bend	trans	-86.4	-172.4	-171	0	0	0	0	0	116.7	N587 S649 E653 N654	N587-G651 VanDerWaalsContact OD1-CA 3.28Å; N587-G651 WeakPolarHBondContact OD1-CA 3.47Å; S649-G651 PolarHBondContact O-N 3.49Å; G651-E653 WeakPolarHBondContact CA-OE1 3.28Å; G651-E653 VanDerWaalsContact CA-OE2 3.28Å; G651-E653 WeakPolarHBondContact CA-OE2 3.28Å; G651-E653 PolarHBondContact N-OE1 3.26Å; G651-E653 PolarHBondContact O-N 3.35Å; G651-N654 PolarHBondContact O-N 2.94Å; G651-N654 VanDerWaalsContact O-N 3.14Å
652	G	86.4	Confident	93.8	Very high	11 Å²	11	16.8 Å²	16.8	11%	0.113	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-8.8	-178.8	0	0	0	0	0	114.3	C597 P655	C597-G652 WeakPolarHBondContact SG-CA 3.49Å; C597-G652 PolarHBondContact SG-N 2.98Å; G652-P655 WeakPolarHBondContact O-CD 3.48Å; G652-P655 VanDerWaalsContact O-CG 3.3Å; G652-P655 WeakPolarHBondContact O-CG 3.47Å
653	E	87.3	Confident	93.6	Very high	78 Å²	78	23 Å²	23	36%	0.364	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-19.4	171.3	67.8	-74.5	170.7	0	0	113.4	S649 G651 P655	S649-E653 WeakPolarHBondContact CB-OE1 3.31Å; S649-E653 WeakPolarHBondContact OG-CG 3.26Å; S649-E653 PolarHBondContact OG-OE1 2.91Å; G651-E653 WeakPolarHBondContact CA-OE1 3.28Å; G651-E653 VanDerWaalsContact CA-OE2 3.28Å; G651-E653 WeakPolarHBondContact CA-OE2 3.28Å; G651-E653 PolarHBondContact N-OE1 3.26Å; G651-E653 PolarHBondContact O-N 3.35Å; E653-P655 VanDerWaalsContact C-CD 3.41Å
654	N	93.6	Very high	93.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-126.7	55.5	176.3	-73.4	-57.7	0	0	0	114	S464 R466 F626 F648 S649 G651 H656	S464-N654 PolarHBondContact O-ND2 3.19Å; S464-N654 PolarHBondContact O-OD1 3.44Å; R466-N654 WeakPolarHBondContact CD-OD1 3.19Å; R466-N654 PolarHBondContact NH1-OD1 2.86Å; F626-N654 HydrophobicContact CD1-CB 4.21Å; F626-N654 HydrophobicContact CE1-CB 4.12Å; F648-N654 HydrophobicContact CB-CB 4.44Å; F648-N654 HydrophobicContact CD2-CB 3.88Å; S649-N654 WeakPolarHBondContact O-CB 3.34Å; S649-N654 PolarHBondContact OG-ND2 3.48Å; G651-N654 PolarHBondContact O-N 2.94Å; G651-N654 VanDerWaalsContact O-N 3.14Å; N654-H656 PolarHBondContact O-N 3.34Å; N654-H656 PolarHBondContact O-ND1 3.19Å
655	P	94.4	Very high	93.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.			trans	-57.9	133.3	168	-21.1	35.2	0	0	0	110.2	V583 H584 L590 F626 T627 G652 E653	V583-P655 HydrophobicContact CG1-CB 4.12Å; H584-P655 WeakPolarHBondContact O-CA 3.48Å; L590-P655 HydrophobicContact CD1-CG 4.36Å; L590-P655 HydrophobicContact CD2-CB 3.76Å; L590-P655 HydrophobicContact CD2-CG 4.06Å; F626-P655 CarbonylContact C-O 3.57Å; F626-P655 WeakPolarHBondContact CA-O 3.3Å; T627-P655 PolarHBondContact N-O 3.31Å; T627-P655 WeakPolarHBondContact OG1-CB 3.47Å; G652-P655 WeakPolarHBondContact O-CD 3.48Å; G652-P655 VanDerWaalsContact O-CG 3.3Å; G652-P655 WeakPolarHBondContact O-CG 3.47Å; E653-P655 VanDerWaalsContact C-CD 3.41Å
656	H	96.6	Very high	93.3	Very high	8 Å²	8	27 Å²	27	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.1	-173.9	64	-81.6	0	0	0	112.9	V583 H584 D586 L624 F625 F626 F648 N654	V583-H656 VanDerWaalsContact CA-O 3.27Å; V583-H656 WeakPolarHBondContact CA-O 3.42Å; H584-H656 AromaticContact CE1-CD2 3.75Å; H584-H656 AromaticContact CE1-CE1 3.82Å; H584-H656 AromaticContact CE1-NE2 3.24Å; H584-H656 PolarHBondContact CE1-NE2 3.02Å; H584-H656 PolarHBondContact N-O 3.44Å; H584-H656 PolarHBondContact ND1-O 2.82Å; H584-H656 VanDerWaalsContact ND1-O 3.12Å; H584-H656 AromaticContact NE2-NE2 3.66Å; H584-H656 PolarHBondContact O-N 3.33Å; D586-H656 IonicContact OD2-CE1 3.43Å; D586-H656 PolarHBondContact OD2-CE1 3.26Å; D586-H656 IonicContact OD2-NE2 2.77Å; L624-H656 HydrophobicContact CD1-CB 4.26Å; F625-H656 CarbonylContact O-C 3.6Å; F625-H656 WeakPolarHBondContact O-CA 3.41Å; F625-H656 WeakPolarHBondContact O-CB 3.39Å; F626-H656 HydrophobicContact CD1-CB 3.74Å; F626-H656 HydrophobicContact CE1-CB 3.96Å; F626-H656 HydrophobicContact CG-CB 4.46Å; F648-H656 AromaticContact CE2-CE1 3.4Å; F648-H656 WeakPolarHBondContact CE2-CE1 3.37Å; F648-H656 AromaticContact CE2-ND1 3.46Å; F648-H656 WeakPolarHBondContact CE2-ND1 3.46Å; F648-H656 AromaticContact CZ-CE1 3.62Å; F648-H656 AromaticContact CZ-ND1 3.85Å; F648-H656 AromaticContact CZ-NE2 3.73Å; N654-H656 PolarHBondContact O-N 3.34Å; N654-H656 PolarHBondContact O-ND1 3.19Å
657	G	94.9	Very high	93.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	173.8	177.8	0	0	0	0	0	111.8	F625	F625-G657 WeakPolarHBondContact CD1-O 3.09Å; F625-G657 WeakPolarHBondContact CE1-O 3.32Å; F625-G657 PolarHBondContact N-O 2.76Å; F625-G657 PolarHBondContact O-N 2.6Å
658	V	95.6	Very high	93.4	Very high	11 Å²	11	27.1 Å²	27.1	7%	0.067	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.2	179.4	-175.9	0	0	0	0	109.4	L579 S580 H581 L624	L579-V658 WeakPolarHBondContact CB-O 3.25Å; S580-V658 PolarHBondContact N-O 3.31Å; H581-V658 HydrophobicContact CB-CB 3.88Å; H581-V658 HydrophobicContact CB-CG2 3.95Å; H581-V658 PolarHBondContact N-O 2.91Å; H581-V658 PolarHBondContact O-N 3.09Å; L624-V658 HydrophobicContact CD1-CG2 4.24Å
659	W	93.6	Very high	93.5	Very high	109 Å²	109	27.1 Å²	27.1	41%	0.413	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	150.3	174.7	-70.4	107.4	0	0	0	111.2	L579 S580 G622 D623 F625 V634 V661	L579-W659 HydrophobicContact CD2-CD2 4.14Å; L579-W659 HydrophobicContact CD2-CE3 3.47Å; L579-W659 VanDerWaalsContact CD2-CE3 3.47Å; L579-W659 HydrophobicContact CD2-CH2 4.42Å; L579-W659 HydrophobicContact CD2-CZ3 3.64Å; S580-W659 WeakPolarHBondContact CB-O 3.4Å; G622-W659 VanDerWaalsContact CA-O 3.22Å; G622-W659 WeakPolarHBondContact CA-O 3.18Å; G622-W659 PolarHBondContact N-O 3.23Å; D623-W659 PolarHBondContact O-N 3.49Å; F625-W659 AromaticContact CD1-CD1 3.44Å; F625-W659 VanDerWaalsContact CD1-CD1 3.44Å; F625-W659 HydrophobicContact CD1-CD2 4.13Å; F625-W659 AromaticContact CD1-CE2 3.68Å; F625-W659 HydrophobicContact CD1-CG 4.01Å; F625-W659 HydrophobicContact CD1-CZ2 4.31Å; F625-W659 AromaticContact CD1-NE1 3.23Å; F625-W659 HydrophobicContact CE1-CD2 4.06Å; F625-W659 AromaticContact CE1-CE2 3.87Å; F625-W659 HydrophobicContact CE1-CG 4.2Å; F625-W659 HydrophobicContact CE1-CZ2 4.31Å; F625-W659 AromaticContact CE1-NE1 3.89Å; F625-W659 HydrophobicContact CG-CZ2 4.49Å; F625-W659 AromaticContact CG-NE1 3.63Å; V634-W659 HydrophobicContact CG2-CZ2 4.48Å; W659-V661 PolarHBondContact O-N 3.27Å
660	A	91.6	Very high	93.7	Very high	12 Å²	12	27.7 Å²	27.7	10%	0.099	14%	0.138	C	C	.	.			trans	-44.9	134.3	173.6	0	0	0	0	0	112.9	R576 G621 G622 T662	R576-A660 HydrophobicContact CG-CB 4.47Å; G621-A660 CarbonylContact C-O 3.56Å; G621-A660 VanDerWaalsContact CA-O 3.27Å; G621-A660 WeakPolarHBondContact CA-O 3.27Å; G622-A660 PolarHBondContact N-O 3.5Å; A660-T662 HydrophobicContact CB-CG2 4.42Å; A660-T662 PolarHBondContact O-N 3.03Å
661	V	92.9	Very high	93.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	107.6	166.9	-178.6	0	0	0	0	107.6	E508 R566 A568 Q573 R576 W659 R666	E508-V661 PolarHBondContact OE1-N 2.85Å; R566-V661 HydrophobicContact CB-CG2 4.27Å; A568-V661 HydrophobicContact CB-CG1 4.43Å; A568-V661 WeakPolarHBondContact CB-O 3.21Å; Q573-V661 PolarHBondContact OE1-O 3.34Å; R576-V661 PolarHBondContact NH1-O 2.94Å; W659-V661 PolarHBondContact O-N 3.27Å; V661-R666 HydrophobicContact CG2-CB 3.98Å
662	T	90.6	Very high	94.2	Very high	53 Å²	53	29.4 Å²	29.4	33%	0.325	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-20.3	-172.9	56.1	0	0	0	0	113.4	Q573 Q620 A660	Q573-T662 WeakPolarHBondContact CG-O 3.08Å; Q620-T662 WeakPolarHBondContact CB-OG1 3.43Å; Q620-T662 PolarHBondContact O-N 3.46Å; Q620-T662 PolarHBondContact O-OG1 3.19Å; A660-T662 HydrophobicContact CB-CG2 4.42Å; A660-T662 PolarHBondContact O-N 3.03Å
663	R	92.5	Very high	94.7	Very high	167 Å²	167	28.9 Å²	28.9	63%	0.63	14%	0.138	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-155.4	142.2	175.6	-174.6	178.6	175.5	-173.8	-1.1	110.6	F619 Q620	F619-R663 WeakPolarHBondContact CA-O 3.37Å; F619-R663 VanDerWaalsContact CB-O 3.24Å; F619-R663 WeakPolarHBondContact CB-O 3.42Å; Q620-R663 HydrophobicContact CB-CB 4Å; Q620-R663 HydrophobicContact CG-CB 4.13Å; Q620-R663 PolarHBondContact N-O 2.63Å
664	G	93.6	Very high	95	Very high	37 Å²	37	25.1 Å²	25.1	38%	0.381	12%	0.12	S	C	.	.	S	Bend	trans	84.1	-162.2	176.5	0	0	0	0	0	112.7	A568	A568-G664 PolarHBondContact N-O 3.09Å; A568-G664 VanDerWaalsContact N-O 3.08Å
665	R	94.7	Very high	94.7	Very high	60 Å²	60	27.9 Å²	27.9	23%	0.226	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.5	-176.5	172.3	174.2	137.8	-180	-9.1	109.2	L482 E511 C565 R566 S567 N616 C667	L482-R665 PolarHBondContact O-NH2 3.16Å; E511-R665 IonicContact OE2-NH1 3.42Å; C565-R665 HydrophobicContact CB-CG 4.28Å; R566-R665 CarbonylContact O-C 3.47Å; R566-R665 WeakPolarHBondContact O-CA 3.49Å; S567-R665 WeakPolarHBondContact OG-CD 3.48Å; S567-R665 VanDerWaalsContact OG-CG 3.3Å; S567-R665 WeakPolarHBondContact OG-CG 3.18Å; N616-R665 PolarHBondContact ND2-O 2.88Å; R665-C667 PolarHBondContact NE-SG 3.02Å
666	R	96.5	Very high	94.3	Very high	13 Å²	13	28.3 Å²	28.3	5%	0.049	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.7	175.8	171.2	-178.9	-174.9	-80.2	18.4	109.6	C565 R566 Y614 F619 G622 V661	C565-R666 CarbonylContact C-O 3.55Å; C565-R666 VanDerWaalsContact CA-O 3.23Å; C565-R666 WeakPolarHBondContact CA-O 3.34Å; R566-R666 PolarHBondContact N-O 2.94Å; R566-R666 PolarHBondContact O-N 3.27Å; Y614-R666 VanDerWaalsContact CE1-CZ 3.45Å; Y614-R666 PolarHBondContact OH-NH2 2.9Å; F619-R666 HydrophobicContact CD1-CB 3.94Å; F619-R666 HydrophobicContact CD1-CG 4.48Å; F619-R666 HydrophobicContact CD2-CB 4.04Å; F619-R666 HydrophobicContact CE1-CB 3.72Å; F619-R666 HydrophobicContact CE1-CG 3.76Å; F619-R666 HydrophobicContact CE2-CB 3.85Å; F619-R666 HydrophobicContact CE2-CG 3.87Å; F619-R666 HydrophobicContact CG-CB 4.07Å; F619-R666 HydrophobicContact CZ-CB 3.65Å; F619-R666 HydrophobicContact CZ-CG 3.39Å; G622-R666 PolarHBondContact O-NE 3.46Å; G622-R666 PolarHBondContact O-NH2 2.89Å; V661-R666 HydrophobicContact CG2-CB 3.98Å
667	C	97.2	Very high	93.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.4	175	-63	0	0	0	0	111.8	L482 V564 C565 L615 N616 R665	L482-C667 HydrophobicContact CD2-CB 3.61Å; V564-C667 CarbonylContact O-C 3.5Å; V564-C667 VanDerWaalsContact O-CA 3.3Å; V564-C667 WeakPolarHBondContact O-CA 3.46Å; C565-C667 HydrophobicContact CB-CB 4.22Å; C565-C667 WeakPolarHBondContact CB-SG 3.27Å; C565-C667 WeakPolarHBondContact SG-CB 3.49Å; C565-C667 CovalentContact SG-SG 2.05Å; C565-C667 PolarHBondContact SG-SG 3.48Å; L615-C667 HydrophobicContact CB-CB 4.28Å; L615-C667 HydrophobicContact CD1-CB 4.21Å; L615-C667 PolarHBondContact N-O 3.49Å; L615-C667 VanDerWaalsContact N-O 3.1Å; N616-C667 PolarHBondContact OD1-N 3.44Å; N616-C667 PolarHBondContact OD1-O 3.43Å; R665-C667 PolarHBondContact NE-SG 3.02Å
668	A	97.6	Very high	93.5	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.033	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	149.9	176.9	0	0	0	0	0	110.4	V564 L613 Y614	V564-A668 PolarHBondContact N-O 3.22Å; V564-A668 PolarHBondContact O-N 3.19Å; L613-A668 CarbonylContact O-C 3.59Å; L613-A668 VanDerWaalsContact O-CA 3.23Å; L613-A668 WeakPolarHBondContact O-CA 3.35Å; Y614-A668 HydrophobicContact CD1-CB 3.79Å; Y614-A668 HydrophobicContact CE1-CB 3.94Å
669	L	97.8	Very high	93.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.4	164.5	-172.5	63.7	0	0	0	107.9	L535 V538 T561 L563 L612 L613 L671	L535-L669 HydrophobicContact CD1-CD1 3.54Å; L535-L669 HydrophobicContact CD1-CD2 4.14Å; L535-L669 HydrophobicContact CD1-CG 4.47Å; V538-L669 HydrophobicContact CG1-CD2 3.93Å; T561-L669 HydrophobicContact CG2-CD1 3.76Å; T561-L669 HydrophobicContact CG2-CG 4.39Å; L563-L669 HydrophobicContact CB-CD1 4.04Å; L612-L669 WeakPolarHBondContact CA-O 3.36Å; L613-L669 HydrophobicContact CB-CB 4.27Å; L613-L669 PolarHBondContact N-O 2.58Å; L613-L669 PolarHBondContact O-N 3.33Å; L669-L671 HydrophobicContact CB-CD1 4.2Å; L669-L671 HydrophobicContact CD2-CD1 3.94Å; L669-L671 HydrophobicContact CD2-CD2 4.12Å; L669-L671 HydrophobicContact CD2-CG 4.29Å; L669-L671 HydrophobicContact CG-CD1 3.65Å; L669-L671 HydrophobicContact CG-CD2 4.35Å; L669-L671 HydrophobicContact CG-CG 4.01Å; L669-L671 WeakPolarHBondContact O-CD1 3.35Å
670	A	97.1	Very high	93.1	Very high	14 Å²	14	39.3 Å²	39.3	12%	0.116	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.6	173.6	0	0	0	0	0	109	H562 G611 W672	H562-A670 PolarHBondContact N-O 2.97Å; H562-A670 PolarHBondContact O-N 3.12Å; G611-A670 WeakPolarHBondContact O-CA 3.44Å; A670-W672 HydrophobicContact CB-CH2 3.72Å; A670-W672 HydrophobicContact CB-CZ2 4.34Å; A670-W672 HydrophobicContact CB-CZ3 3.95Å
671	L	97.3	Very high	93.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.6	-178	-50.1	94.4	0	0	0	109.8	V542 L558 F560 T561 S610 G611 L669	V542-L671 HydrophobicContact CB-CD1 4.24Å; V542-L671 HydrophobicContact CB-CD2 4.11Å; V542-L671 HydrophobicContact CG1-CD1 3.93Å; V542-L671 HydrophobicContact CG1-CD2 4.33Å; V542-L671 HydrophobicContact CG2-CD1 4.14Å; L558-L671 HydrophobicContact CD2-CB 4.48Å; L558-L671 HydrophobicContact CD2-CD2 3.85Å; F560-L671 WeakPolarHBondContact O-CA 3.39Å; T561-L671 HydrophobicContact CG2-CD2 4.16Å; T561-L671 HydrophobicContact CG2-CG 4.39Å; S610-L671 CarbonylContact C-O 3.45Å; S610-L671 WeakPolarHBondContact CA-O 3.11Å; G611-L671 PolarHBondContact N-O 3.38Å; G611-L671 PolarHBondContact O-N 2.86Å; L669-L671 HydrophobicContact CB-CD1 4.2Å; L669-L671 HydrophobicContact CD2-CD1 3.94Å; L669-L671 HydrophobicContact CD2-CD2 4.12Å; L669-L671 HydrophobicContact CD2-CG 4.29Å; L669-L671 HydrophobicContact CG-CD1 3.65Å; L669-L671 HydrophobicContact CG-CD2 4.35Å; L669-L671 HydrophobicContact CG-CG 4.01Å; L669-L671 WeakPolarHBondContact O-CD1 3.35Å
672	W	97.8	Very high	93.3	Very high	39 Å²	39	44.3 Å²	44.3	15%	0.148	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.6	172.9	-62.4	-87.6	0	0	0	109.5	S559 F560 H562 D586 R607 S610 A670	S559-W672 WeakPolarHBondContact CB-O 3.16Å; S559-W672 PolarHBondContact N-O 3.07Å; F560-W672 HydrophobicContact CB-CE3 4Å; F560-W672 AromaticContact CD1-CE3 3.68Å; F560-W672 HydrophobicContact CD1-CE3 3.68Å; F560-W672 HydrophobicContact CD1-CH2 4.43Å; F560-W672 AromaticContact CD1-CZ3 3.45Å; F560-W672 HydrophobicContact CD1-CZ3 3.45Å; F560-W672 VanDerWaalsContact CD1-CZ3 3.45Å; F560-W672 HydrophobicContact CE1-CZ3 4.08Å; F560-W672 HydrophobicContact CG-CE3 4.32Å; F560-W672 HydrophobicContact CG-CZ3 4.47Å; F560-W672 PolarHBondContact N-O 3.35Å; F560-W672 PolarHBondContact O-N 2.84Å; H562-W672 HydrophobicContact CB-CZ3 4.23Å; D586-W672 PolarHBondContact OD1-NE1 2.83Å; D586-W672 PolarHBondContact OD2-NE1 3.12Å; R607-W672 VanDerWaalsContact CD-CD1 3.46Å; R607-W672 HydrophobicContact CG-CB 4.04Å; R607-W672 HydrophobicContact CG-CG 4.45Å; R607-W672 VanDerWaalsContact CZ-CD2 3.47Å; R607-W672 VanDerWaalsContact NH1-CD1 3.34Å; S610-W672 VanDerWaalsContact OG-CD1 3.31Å; A670-W672 HydrophobicContact CB-CH2 3.72Å; A670-W672 HydrophobicContact CB-CZ2 4.34Å; A670-W672 HydrophobicContact CB-CZ3 3.95Å
673	H	95.6	Very high	93.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	149.8	-173.9	-45.8	90.1	0	0	0	110.6	R543 L556 H557 D608 Y609	R543-H673 WeakPolarHBondContact CA-NE2 3.38Å; L556-H673 HydrophobicContact CD2-CB 3.57Å; H557-H673 CarbonylContact O-C 3.56Å; H557-H673 WeakPolarHBondContact O-CA 3.18Å; D608-H673 PolarHBondContact N-O 2.86Å; Y609-H673 PolarHBondContact N-O 3.21Å; Y609-H673 PolarHBondContact O-N 3.2Å; Y609-H673 PolarHBondContact O-ND1 3.17Å; Y609-H673 VanDerWaalsContact O-ND1 3.11Å
674	T	93.4	Very high	93.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.9	-178.7	-174.2	0	0	0	0	111.2	H557 Y606 D608 A676 H679	H557-T674 HydrophobicContact CB-CG2 4.16Å; H557-T674 PolarHBondContact N-O 3.34Å; H557-T674 PolarHBondContact O-N 3.45Å; Y606-T674 WeakPolarHBondContact O-CB 3.21Å; Y606-T674 PolarHBondContact O-OG1 2.94Å; D608-T674 WeakPolarHBondContact OD2-CA 3.13Å; T674-A676 VanDerWaalsContact C-N 3.33Å; T674-A676 VanDerWaalsContact CG2-O 3.3Å; T674-A676 WeakPolarHBondContact CG2-O 3.3Å; T674-A676 WeakPolarHBondContact OG1-CB 3.4Å; T674-A676 PolarHBondContact OG1-N 3.27Å; T674-H679 HydrophobicContact CG2-CB 4.02Å
675	W	88.1	Confident	93.5	Very high	57 Å²	57	38.4 Å²	38.4	22%	0.216	18%	0.179	C	C	.	.	S	Bend	trans	-78.8	-18.4	165.6	-63.3	-41.7	0	0	0	112.6	S551 D608 Y609 P677	S551-W675 PolarHBondContact OG-NE1 3.14Å; D608-W675 HydrophobicContact CB-CD2 4.02Å; D608-W675 HydrophobicContact CB-CE3 4.11Å; D608-W675 HydrophobicContact CB-CZ2 4.45Å; D608-W675 HydrophobicContact CB-CZ3 4.35Å; D608-W675 VanDerWaalsContact OD1-CE3 3.28Å; D608-W675 PolarHBondContact OD2-N 3.26Å; Y609-W675 AromaticContact CE2-CZ2 3.72Å; Y609-W675 HydrophobicContact CE2-CZ2 3.72Å; W675-P677 VanDerWaalsContact O-CD 3.25Å; W675-P677 WeakPolarHBondContact O-CD 3.15Å
676	A	86.4	Confident	93.5	Very high	10 Å²	10	40 Å²	40	8%	0.083	19%	0.189	C	C	.	.			trans	-84.6	106.7	-176.3	0	0	0	0	0	110.9	W430 T674 E678 H679	W430-A676 HydrophobicContact CH2-CB 3.67Å; W430-A676 HydrophobicContact CZ2-CB 3.8Å; T674-A676 VanDerWaalsContact C-N 3.33Å; T674-A676 VanDerWaalsContact CG2-O 3.3Å; T674-A676 WeakPolarHBondContact CG2-O 3.3Å; T674-A676 WeakPolarHBondContact OG1-CB 3.4Å; T674-A676 PolarHBondContact OG1-N 3.27Å; A676-E678 HydrophobicContact CB-CG 4.41Å; A676-E678 PolarHBondContact O-N 3.4Å; A676-H679 PolarHBondContact O-N 3.04Å
677	P	87	Confident	93.4	Very high	79 Å²	79	39.3 Å²	39.3	51%	0.513	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-61.2	-27.2	-175.4	25.6	-35.6	0	0	0	113.6	W675 H679 R680	W675-P677 VanDerWaalsContact O-CD 3.25Å; W675-P677 WeakPolarHBondContact O-CD 3.15Å; P677-H679 PolarHBondContact O-N 3.46Å; P677-R680 VanDerWaalsContact O-CB 3.23Å; P677-R680 WeakPolarHBondContact O-CB 3.28Å; P677-R680 PolarHBondContact O-N 3.08Å
678	E	85.9	Confident	93.2	Very high	123 Å²	123	43.7 Å²	43.7	58%	0.575	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-64.9	-19.2	175.4	63.5	-91.2	-145.5	0	0	113.7	A676	A676-E678 HydrophobicContact CB-CG 4.41Å; A676-E678 PolarHBondContact O-N 3.4Å
679	H	89.3	Confident	93	Very high	55 Å²	55	48.4 Å²	48.4	26%	0.255	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-102.7	17.7	177.8	-68	-60.5	0	0	0	113.1	W430 S559 Y606 T674 A676 P677	W430-H679 AromaticContact CZ2-CD2 3.84Å; S559-H679 WeakPolarHBondContact CA-O 3.35Å; S559-H679 PolarHBondContact OG-O 3.36Å; Y606-H679 VanDerWaalsContact CB-CD2 3.43Å; Y606-H679 WeakPolarHBondContact CB-CD2 3.47Å; Y606-H679 AromaticContact CD1-CD2 3.88Å; Y606-H679 AromaticContact CD1-CE1 3.65Å; Y606-H679 AromaticContact CD1-CG 3.83Å; Y606-H679 AromaticContact CD1-ND1 3.69Å; Y606-H679 AromaticContact CD1-NE2 3.75Å; Y606-H679 HydrophobicContact CD2-CB 3.84Å; Y606-H679 AromaticContact CD2-CG 3.95Å; Y606-H679 AromaticContact CE1-ND1 3.82Å; Y606-H679 HydrophobicContact CE2-CB 4.25Å; Y606-H679 HydrophobicContact CG-CB 4.02Å; Y606-H679 AromaticContact CG-CD2 3.65Å; Y606-H679 AromaticContact CG-CG 3.62Å; Y606-H679 AromaticContact CG-ND1 3.98Å; Y606-H679 AromaticContact CG-NE2 4Å; T674-H679 HydrophobicContact CG2-CB 4.02Å; A676-H679 PolarHBondContact O-N 3.04Å; P677-H679 PolarHBondContact O-N 3.46Å
680	R	92.1	Very high	92.7	Very high	101 Å²	101	50 Å²	50	38%	0.381	24%	0.236	S	C	.	.			trans	-65.3	138.4	173.2	-175.9	176.6	-177.1	-173	0.1	111.3	H557 L558 P677 Q682	H557-R680 HydrophobicContact CB-CB 4.26Å; H557-R680 HydrophobicContact CB-CG 4.24Å; L558-R680 CarbonylContact O-C 3.56Å; L558-R680 WeakPolarHBondContact O-CA 3.19Å; P677-R680 VanDerWaalsContact O-CB 3.23Å; P677-R680 WeakPolarHBondContact O-CB 3.28Å; P677-R680 PolarHBondContact O-N 3.08Å; R680-Q682 PolarHBondContact O-N 3.29Å; R680-Q682 PolarHBondContact O-NE2 3.28Å
681	E	95.5	Very high	92.3	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.037	23%	0.232	C	C	.	.			trans	-62.7	100.7	-179.7	-171.4	173.1	-154.5	0	0	111.5	L558 T561 E683 W684	L558-E681 HydrophobicContact CB-CB 4.44Å; L558-E681 WeakPolarHBondContact O-CB 3.34Å; L558-E681 PolarHBondContact O-N 2.77Å; T561-E681 VanDerWaalsContact CB-OE2 3.26Å; T561-E681 WeakPolarHBondContact CB-OE2 3.38Å; T561-E681 VanDerWaalsContact N-CD 3.29Å; T561-E681 PolarHBondContact N-OE1 3.29Å; T561-E681 PolarHBondContact N-OE2 2.99Å; T561-E681 PolarHBondContact OG1-OE2 3.34Å; E681-E683 VanDerWaalsContact C-N 3.35Å; E681-E683 HydrophobicContact CG-CB 4.26Å; E681-W684 HydrophobicContact CB-CB 4.07Å; E681-W684 HydrophobicContact CG-CB 3.86Å; E681-W684 WeakPolarHBondContact O-CB 3.25Å; E681-W684 PolarHBondContact O-N 3.04Å
682	Q	94.4	Very high	91.8	Very high	109 Å²	109	53.8 Å²	53.8	51%	0.509	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-38.3	177.9	-60.1	-56.8	-45.1	0	0	111.8	R680 W684 I685 E686	R680-Q682 PolarHBondContact O-N 3.29Å; R680-Q682 PolarHBondContact O-NE2 3.28Å; Q682-W684 PolarHBondContact O-N 3.37Å; Q682-W684 VanDerWaalsContact O-N 3.11Å; Q682-I685 WeakPolarHBondContact O-CB 3.34Å; Q682-I685 PolarHBondContact O-N 3.49Å; Q682-E686 PolarHBondContact O-N 3.47Å
683	E	92.9	Very high	91	Very high	70 Å²	70	56.6 Å²	56.6	33%	0.327	27%	0.266	S	S	.	.	H	α-helix	trans	-55.3	-31.4	175.9	-75.5	-163.9	-167	0	0	112.8	T514 V515 L516 E681 A687	T514-E683 VanDerWaalsContact CB-OE2 3.31Å; T514-E683 WeakPolarHBondContact CB-OE2 3.4Å; T514-E683 PolarHBondContact OG1-OE2 3.1Å; V515-E683 HydrophobicContact CG2-CB 4.25Å; L516-E683 HydrophobicContact CB-CB 3.82Å; L516-E683 HydrophobicContact CB-CG 4.06Å; L516-E683 HydrophobicContact CD2-CB 4.37Å; L516-E683 HydrophobicContact CD2-CG 3.92Å; E681-E683 VanDerWaalsContact C-N 3.35Å; E681-E683 HydrophobicContact CG-CB 4.26Å; E683-A687 WeakPolarHBondContact O-CB 3.3Å; E683-A687 PolarHBondContact O-N 3.19Å
684	W	94.9	Very high	89.9	Confident	20 Å²	20	57.3 Å²	57.3	8%	0.076	27%	0.271	C	S	.	.	H	α-helix	trans	-71.7	-39.6	178.1	-171.3	101.4	0	0	0	111.7	V515 L536 E540 L558 E681 Q682 A687 K688	V515-W684 HydrophobicContact CG2-CB 4.08Å; L536-W684 HydrophobicContact CB-CZ2 4.31Å; L536-W684 HydrophobicContact CD2-CD2 4.24Å; L536-W684 HydrophobicContact CD2-CG 4.03Å; E540-W684 HydrophobicContact CG-CH2 3.87Å; E540-W684 HydrophobicContact CG-CZ2 3.36Å; L558-W684 HydrophobicContact CD1-CD2 4.47Å; L558-W684 HydrophobicContact CD1-CG 4.25Å; E681-W684 HydrophobicContact CB-CB 4.07Å; E681-W684 HydrophobicContact CG-CB 3.86Å; E681-W684 WeakPolarHBondContact O-CB 3.25Å; E681-W684 PolarHBondContact O-N 3.04Å; Q682-W684 PolarHBondContact O-N 3.37Å; Q682-W684 VanDerWaalsContact O-N 3.11Å; W684-A687 PolarHBondContact O-N 3.39Å; W684-K688 HydrophobicContact CH2-CD 3.73Å; W684-K688 HydrophobicContact CZ3-CB 4.27Å; W684-K688 HydrophobicContact CZ3-CD 3.69Å; W684-K688 WeakPolarHBondContact O-CB 3.09Å; W684-K688 PolarHBondContact O-N 2.97Å
685	I	92.5	Very high	88.9	Confident	43 Å²	43	60.9 Å²	60.9	22%	0.221	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-50.3	177.9	-61.4	169.8	0	0	0	109.2	Q682 A687 K688 E689	Q682-I685 WeakPolarHBondContact O-CB 3.34Å; Q682-I685 PolarHBondContact O-N 3.49Å; I685-A687 VanDerWaalsContact C-N 3.33Å; I685-A687 PolarHBondContact O-N 2.98Å; I685-K688 WeakPolarHBondContact O-CB 3.36Å; I685-K688 PolarHBondContact O-N 3.43Å; I685-K688 VanDerWaalsContact O-N 3.14Å; I685-E689 PolarHBondContact O-N 2.96Å
686	E	94.2	Very high	88.2	Confident	93 Å²	93	64.3 Å²	64.3	44%	0.435	31%	0.306	S	S	.	.	H	α-helix	trans	-59.5	-42.8	176.8	-67.4	175.7	-149.8	0	0	111.9	L516 Q682 K688 E689 L690	L516-E686 HydrophobicContact CD1-CB 3.89Å; L516-E686 WeakPolarHBondContact CD2-OE2 3.01Å; Q682-E686 PolarHBondContact O-N 3.47Å; E686-K688 VanDerWaalsContact C-N 3.28Å; E686-K688 PolarHBondContact O-N 3.4Å; E686-E689 PolarHBondContact O-N 3Å; E686-L690 WeakPolarHBondContact O-CB 3.38Å; E686-L690 VanDerWaalsContact O-CG 3.25Å; E686-L690 WeakPolarHBondContact O-CG 3.28Å; E686-L690 PolarHBondContact O-N 3.31Å
687	A	94	Very high	87.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-38.2	177.3	0	0	0	0	0	112.5	V515 A519 L536 E683 W684 I685 L691	V515-A687 HydrophobicContact CB-CB 4.31Å; V515-A687 HydrophobicContact CG2-CB 4.44Å; A519-A687 HydrophobicContact CB-CB 3.86Å; L536-A687 HydrophobicContact CD1-CB 4.3Å; L536-A687 HydrophobicContact CD2-CB 3.94Å; E683-A687 WeakPolarHBondContact O-CB 3.3Å; E683-A687 PolarHBondContact O-N 3.19Å; W684-A687 PolarHBondContact O-N 3.39Å; I685-A687 VanDerWaalsContact C-N 3.33Å; I685-A687 PolarHBondContact O-N 2.98Å; A687-L691 WeakPolarHBondContact O-CG 3.35Å; A687-L691 PolarHBondContact O-N 3.07Å
688	K	93.6	Very high	86.4	Confident	91 Å²	91	71 Å²	71	40%	0.396	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-48.5	178	-177.7	179.5	175.9	-177.7	0	111	L536 W684 I685 E686 L690 L691 Q692	L536-K688 HydrophobicContact CD1-CB 4.09Å; W684-K688 HydrophobicContact CH2-CD 3.73Å; W684-K688 HydrophobicContact CZ3-CB 4.27Å; W684-K688 HydrophobicContact CZ3-CD 3.69Å; W684-K688 WeakPolarHBondContact O-CB 3.09Å; W684-K688 PolarHBondContact O-N 2.97Å; I685-K688 WeakPolarHBondContact O-CB 3.36Å; I685-K688 PolarHBondContact O-N 3.43Å; I685-K688 VanDerWaalsContact O-N 3.14Å; E686-K688 VanDerWaalsContact C-N 3.28Å; E686-K688 PolarHBondContact O-N 3.4Å; K688-L690 VanDerWaalsContact C-N 3.34Å; K688-L690 PolarHBondContact O-N 3.43Å; K688-L691 PolarHBondContact O-N 2.96Å; K688-Q692 WeakPolarHBondContact O-CG 3.47Å; K688-Q692 PolarHBondContact O-N 3.34Å
689	E	93.2	Very high	85.4	Confident	104 Å²	104	71.4 Å²	71.4	49%	0.486	33%	0.331	S	S	.	.	H	α-helix	trans	-58.1	-47.1	178.3	-69.7	171.5	174.5	0	0	110.9	I685 E686 L691 Q692 E693	I685-E689 PolarHBondContact O-N 2.96Å; E686-E689 PolarHBondContact O-N 3Å; E689-L691 VanDerWaalsContact C-N 3.3Å; E689-L691 PolarHBondContact O-N 3.15Å; E689-Q692 PolarHBondContact O-N 2.88Å; E689-Q692 VanDerWaalsContact O-N 3.14Å; E689-E693 WeakPolarHBondContact O-CG 3.38Å; E689-E693 PolarHBondContact O-N 3.32Å
690	L	91.9	Very high	84.1	Confident	34 Å²	34	75.5 Å²	75.5	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-58.9	-36.7	177.9	-73.8	170.5	0	0	0	114	L516 A519 Q520 E686 K688 S694	L516-L690 HydrophobicContact CD1-CD1 3.53Å; A519-L690 HydrophobicContact CB-CB 4.48Å; Q520-L690 HydrophobicContact CG-CD1 4.35Å; E686-L690 WeakPolarHBondContact O-CB 3.38Å; E686-L690 VanDerWaalsContact O-CG 3.25Å; E686-L690 WeakPolarHBondContact O-CG 3.28Å; E686-L690 PolarHBondContact O-N 3.31Å; K688-L690 VanDerWaalsContact C-N 3.34Å; K688-L690 PolarHBondContact O-N 3.43Å; L690-S694 PolarHBondContact O-N 2.98Å; L690-S694 PolarHBondContact O-OG 3.34Å; L690-S694 VanDerWaalsContact O-OG 3.14Å
691	L	89.3	Confident	82.5	Confident	6 Å²	6	78.3 Å²	78.3	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-81.2	-23.5	179.9	-71.8	174.1	0	0	0	112.7	A519 A522 A532 K533 L536 A687 K688 E689 S694 E695	A519-L691 HydrophobicContact CB-CD1 4.02Å; A519-L691 HydrophobicContact CB-CD2 4.27Å; A519-L691 HydrophobicContact CB-CG 3.85Å; A522-L691 HydrophobicContact CB-CD2 4.05Å; A532-L691 HydrophobicContact CB-CD1 3.93Å; A532-L691 HydrophobicContact CB-CD2 4.25Å; K533-L691 HydrophobicContact CG-CB 4.48Å; K533-L691 HydrophobicContact CG-CD1 4.07Å; L536-L691 HydrophobicContact CD1-CD1 3.73Å; L536-L691 HydrophobicContact CG-CD1 4.49Å; A687-L691 WeakPolarHBondContact O-CG 3.35Å; A687-L691 PolarHBondContact O-N 3.07Å; K688-L691 PolarHBondContact O-N 2.96Å; E689-L691 VanDerWaalsContact C-N 3.3Å; E689-L691 PolarHBondContact O-N 3.15Å; L691-S694 WeakPolarHBondContact CA-OG 3.48Å; L691-S694 PolarHBondContact O-OG 3.05Å; L691-S694 VanDerWaalsContact O-OG 3.09Å; L691-E695 WeakPolarHBondContact O-CG 3.08Å; L691-E695 PolarHBondContact O-N 2.92Å
692	Q	86.7	Confident	80.6	Confident	88 Å²	88	86.2 Å²	86.2	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-77.5	-44.1	174.1	-71.5	-176.4	-55.5	0	0	111.5	K688 E689 S694 E695 E696	K688-Q692 WeakPolarHBondContact O-CG 3.47Å; K688-Q692 PolarHBondContact O-N 3.34Å; E689-Q692 PolarHBondContact O-N 2.88Å; E689-Q692 VanDerWaalsContact O-N 3.14Å; Q692-S694 VanDerWaalsContact C-N 3.26Å; Q692-S694 PolarHBondContact O-N 3.48Å; Q692-E695 WeakPolarHBondContact O-CB 3.14Å; Q692-E695 PolarHBondContact O-N 2.88Å; Q692-E696 PolarHBondContact O-N 3.47Å; Q692-E696 VanDerWaalsContact O-N 3.12Å
693	E	81.3	Confident	78.7	Confident	98 Å²	98	89.1 Å²	89.1	46%	0.458	42%	0.418	S	S	.	.	H	α-helix	trans	-57.3	-40.1	175.7	-70.8	175	171.6	0	0	111.9	E689 E695 E696 E697	E689-E693 WeakPolarHBondContact O-CG 3.38Å; E689-E693 PolarHBondContact O-N 3.32Å; E693-E695 VanDerWaalsContact C-N 3.34Å; E693-E695 PolarHBondContact O-N 3.43Å; E693-E696 PolarHBondContact O-N 3.4Å; E693-E697 WeakPolarHBondContact O-CG 3.29Å; E693-E697 PolarHBondContact O-N 2.9Å
694	S	72	Confident	76.5	Confident	15 Å²	15	93 Å²	93	11%	0.105	44%	0.438	C	S	.	.	H	α-helix	trans	-70.2	-26	177.4	50.9	0	0	0	0	114.2	L690 L691 Q692 E698	L690-S694 PolarHBondContact O-N 2.98Å; L690-S694 PolarHBondContact O-OG 3.34Å; L690-S694 VanDerWaalsContact O-OG 3.14Å; L691-S694 WeakPolarHBondContact CA-OG 3.48Å; L691-S694 PolarHBondContact O-OG 3.05Å; L691-S694 VanDerWaalsContact O-OG 3.09Å; Q692-S694 VanDerWaalsContact C-N 3.26Å; Q692-S694 PolarHBondContact O-N 3.48Å; S694-E698 WeakPolarHBondContact O-CB 3.42Å; S694-E698 VanDerWaalsContact O-CG 3.29Å; S694-E698 WeakPolarHBondContact O-CG 3.42Å; S694-E698 PolarHBondContact O-N 2.83Å; S694-E698 VanDerWaalsContact O-N 3.11Å
695	E	72.1	Confident	74	Confident	74 Å²	74	97.5 Å²	97.5	35%	0.346	47%	0.47	S	S	.	.	H	α-helix	trans	-71.4	-44	171.8	-75.5	176.1	156.3	0	0	111	K533 L691 Q692 E693 E697 E698 E699	K533-E695 WeakPolarHBondContact CD-OE1 3.42Å; K533-E695 WeakPolarHBondContact CE-OE1 3.4Å; K533-E695 IonicContact NZ-OE1 2.78Å; K533-E695 PolarHBondContact NZ-OE1 2.87Å; L691-E695 WeakPolarHBondContact O-CG 3.08Å; L691-E695 PolarHBondContact O-N 2.92Å; Q692-E695 WeakPolarHBondContact O-CB 3.14Å; Q692-E695 PolarHBondContact O-N 2.88Å; E693-E695 VanDerWaalsContact C-N 3.34Å; E693-E695 PolarHBondContact O-N 3.43Å; E695-E697 VanDerWaalsContact C-N 3.32Å; E695-E697 PolarHBondContact O-N 3.17Å; E695-E698 PolarHBondContact O-N 3.26Å; E695-E699 WeakPolarHBondContact O-CB 3.47Å; E695-E699 WeakPolarHBondContact O-CG 3.4Å; E695-E699 PolarHBondContact O-N 2.6Å
696	E	73.8	Confident	71.9	Confident	129 Å²	129	101.1 Å²	101.1	60%	0.603	50%	0.499	S	S	*	.	H	α-helix	trans	-62.3	-40.3	177.7	-66.7	177.7	-180	0	0	111.1	Q692 E693 E700	Q692-E696 PolarHBondContact O-N 3.47Å; Q692-E696 VanDerWaalsContact O-N 3.12Å; E693-E696 PolarHBondContact O-N 3.4Å; E696-E700 WeakPolarHBondContact O-CB 3.49Å; E696-E700 WeakPolarHBondContact O-CG 3.31Å; E696-E700 PolarHBondContact O-N 2.99Å
697	E	69.8	Low	69.3	Low	124 Å²	124	106.1 Å²	106.1	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-65.9	-41.3	174.2	-72.1	178.6	174.8	0	0	112.9	E693 E695 E701	E693-E697 WeakPolarHBondContact O-CG 3.29Å; E693-E697 PolarHBondContact O-N 2.9Å; E695-E697 VanDerWaalsContact C-N 3.32Å; E695-E697 PolarHBondContact O-N 3.17Å; E697-E701 PolarHBondContact O-N 2.82Å
698	E	65.8	Low	66.9	Low	105 Å²	105	113.2 Å²	113.2	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-67.7	-38.9	177.4	-77.5	176.7	-177.7	0	0	111.9	S694 E695 E701 E702	S694-E698 WeakPolarHBondContact O-CB 3.42Å; S694-E698 VanDerWaalsContact O-CG 3.29Å; S694-E698 WeakPolarHBondContact O-CG 3.42Å; S694-E698 PolarHBondContact O-N 2.83Å; S694-E698 VanDerWaalsContact O-N 3.11Å; E695-E698 PolarHBondContact O-N 3.26Å; E698-E701 PolarHBondContact O-N 3.39Å; E698-E702 PolarHBondContact O-N 3.32Å
699	E	65.5	Low	64.5	Low	132 Å²	132	114.5 Å²	114.5	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-68.3	-38.3	175.8	-72.5	-177.7	179.5	0	0	112	E695 E702 E703	E695-E699 WeakPolarHBondContact O-CB 3.47Å; E695-E699 WeakPolarHBondContact O-CG 3.4Å; E695-E699 PolarHBondContact O-N 2.6Å; E699-E702 PolarHBondContact O-N 3.01Å; E699-E703 PolarHBondContact O-N 2.9Å; E699-E703 VanDerWaalsContact O-N 3.08Å
700	E	60.4	Low	61.6	Low	142 Å²	142	114.7 Å²	114.7	66%	0.664	59%	0.588	S	S	*	*	H	α-helix	trans	-67.1	-34.3	173.8	-77.1	-172.8	175.6	0	0	112.8	E696	E696-E700 WeakPolarHBondContact O-CB 3.49Å; E696-E700 WeakPolarHBondContact O-CG 3.31Å; E696-E700 PolarHBondContact O-N 2.99Å
701	E	58.4	Low	60	Low	159 Å²	159	118.7 Å²	118.7	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-72.9	-35.3	174.4	-77.1	-167.1	166.6	0	0	112.7	E697 E698	E697-E701 PolarHBondContact O-N 2.82Å; E698-E701 PolarHBondContact O-N 3.39Å
702	E	57	Low	57.1	Low	175 Å²	175	127.1 Å²	127.1	82%	0.818	66%	0.655	S	S	*	*	H	α-helix	trans	-73.8	-27	176.1	-75.1	-164.3	166.9	0	0	113.4	E698 E699 M704	E698-E702 PolarHBondContact O-N 3.32Å; E699-E702 PolarHBondContact O-N 3.01Å; E702-M704 VanDerWaalsContact C-N 3.31Å; E702-M704 PolarHBondContact O-N 3.03Å
703	E	53.9	Low	54.8	Low	170 Å²	170	128 Å²	128	79%	0.794	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-6.7	177	-78.9	-159.3	156.5	0	0	114.8	E699 P705	E699-E703 PolarHBondContact O-N 2.9Å; E699-E703 VanDerWaalsContact O-N 3.08Å; E703-P705 VanDerWaalsContact O-CD 3.31Å; E703-P705 WeakPolarHBondContact O-CD 3.31Å
704	M	45.7	Very low	53.4	Low	150 Å²	150	129.6 Å²	129.6	74%	0.739	69%	0.687	S	S	*	*	S	Bend	trans	-89	106.4	177.1	-75.5	-76.6	-72.8	0	0	111.5	E702 S706	E702-M704 VanDerWaalsContact C-N 3.31Å; E702-M704 PolarHBondContact O-N 3.03Å; M704-S706 PolarHBondContact O-N 3.3Å
705	P	42.6	Very low	51.4	Low	116 Å²	116	134.7 Å²	134.7	75%	0.753	72%	0.723	S	S	*	*			trans	-71.9	129.3	-178.4	-2.4	18	0	0	0	110.3	E703 K707	E703-P705 VanDerWaalsContact O-CD 3.31Å; E703-P705 WeakPolarHBondContact O-CD 3.31Å; P705-K707 PolarHBondContact O-N 3.36Å
706	S	49.8	Very low	49.5	Very low	118 Å²	118	142 Å²	142	83%	0.825	75%	0.747	S	S	*	*			trans	-44.5	106.6	172.2	58.1	0	0	0	0	112.1	M704 D708	M704-S706 PolarHBondContact O-N 3.3Å; S706-D708 PolarHBondContact O-N 2.61Å
707	K	38.6	Very low	47.5	Very low	199 Å²	199	145.6 Å²	145.6	87%	0.865	76%	0.755	S	S	*	*			trans	-87.1	97.1	160.7	-99.7	-178.1	176.5	172.8	0	108.5	P705 P709	P705-K707 PolarHBondContact O-N 3.36Å; K707-P709 WeakPolarHBondContact O-CD 3.46Å
708	D	43.5	Very low	45.6	Very low	149 Å²	149	146.9 Å²	146.9	80%	0.797	76%	0.761	S	S	*	*			trans	-54.4	140.5	153.1	-103.5	-28.7	0	0	0	109.5	S706	S706-D708 PolarHBondContact O-N 2.61Å
709	P	43.4	Very low	44	Very low	118 Å²	118	150.3 Å²	150.3	77%	0.766	78%	0.777	S	S	*	*				-132.7	137.2	123.8	22.8	-4.7	0	0	0	112.6	K707	K707-P709 WeakPolarHBondContact O-CD 3.46Å
710	S	32.3	Very low	42.3	Very low	108 Å²	108	155.7 Å²	155.7	76%	0.755	79%	0.791	S	S	*	*			trans	-53.9	164.9	173.5	-51.4	0	0	0	0	114.4
711	P	58.3	Low	40.8	Very low	117 Å²	117	153.9 Å²	153.9	76%	0.76	79%	0.79	S	S	*	*			trans	-95.3	153.2	-161.3	37.1	-31.9	0	0	0	113.8
712	E	29	Very low	39.5	Very low	184 Å²	184	154.3 Å²	154.3	86%	0.86	79%	0.792	S	S	*	*			trans	159.8	163.7	143.5	-94.8	-167.8	172.2	0	0	112
713	P	38.6	Very low	38.1	Very low	106 Å²	106	151.5 Å²	151.5	69%	0.688	78%	0.782	S	S	*	*				-130.7	-175	-54.6	38.1	-18.2	0	0	0	110.8
714	P	50.1	Low	37	Very low	131 Å²	131	151.7 Å²	151.7	85%	0.851	78%	0.781	S	S	*	*			trans	-91.6	143.4	-156.4	35.5	-31.8	0	0	0	114.4
715	S	30.5	Very low	36.2	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	78%	0.784	S	S	*	*			trans	-120.3	125.1	165	70.4	0	0	0	0	112.3
716	R	32.7	Very low	35.5	Very low	227 Å²	227	147.1 Å²	147.1	86%	0.857	78%	0.784	S	S	*	*			trans	-67.7	165.9	-175.3	-72.9	170.5	161.1	179.9	-4.7	114.6
717	R	31.1	Very low	34.5	Very low	205 Å²	205	151.3 Å²	151.3	77%	0.774	79%	0.787	S	S	*	*			trans	87.1	133.6	147.6	-88.3	168.5	174.7	-150.9	7.5	115.5
718	H	30.5	Very low	34.4	Very low	151 Å²	151	146.5 Å²	146.5	70%	0.699	78%	0.784	S	S	*	*			cis	-151.2	150	24.7	-100.2	-73.7	0	0	0	112.3
719	Q	32.6	Very low	33.9	Very low	177 Å²	177	144.9 Å²	144.9	83%	0.827	78%	0.782	S	S	*	*			trans	-65.5	149.1	168.4	-71.4	162.3	-41.3	0	0	113.7
720	R	29.3	Very low	33.2	Very low	244 Å²	244	150.4 Å²	150.4	92%	0.921	79%	0.787	S	S	*	*			trans	-151.5	88.8	141.9	-136.5	177.4	-172.2	-171.6	1.4	107.6
721	V	29.5	Very low	33.1	Very low	105 Å²	105	151.7 Å²	151.7	64%	0.636	79%	0.79	S	S	*	*				64.8	104	95.5	179.3	0	0	0	0	113.4
722	Q	29.7	Very low	31.5	Very low	167 Å²	167	156.8 Å²	156.8	78%	0.78	79%	0.794	S	S	*	*			trans	55.5	137.1	135.4	-66.4	173.8	-6	0	0	118
723	D	28.2	Very low	31.4	Very low	116 Å²	116	156.4 Å²	156.4	62%	0.62	79%	0.792	S	S	*	*			cis	-174.9	159.9	44.8	-137.3	-0.4	0	0	0	112.1
724	K	30.2	Very low	30.9	Very low	175 Å²	175	159.3 Å²	159.3	76%	0.761	80%	0.797	S	S	*	*			trans	82.8	114.9	146.3	-76.9	171.3	-173.7	174.7	0	123.1
725	A	29	Very low	29.8	Very low	98 Å²	98	165.1 Å²	165.1	81%	0.81	82%	0.819	S	S	*	*				92.6	119.2	117.3	0	0	0	0	0	116.9
726	G	29.3	Very low	29.8	Very low	72 Å²	72	167.2 Å²	167.2	74%	0.742	82%	0.817	S	S	*	*			trans	-77.7	165	179.3	0	0	0	0	0	113.9
727	K	28.4	Very low	29.6	Very low	205 Å²	205	164.1 Å²	164.1	89%	0.891	82%	0.815	S	S	*	*			trans	-174.6	134.4	138	-107.3	171.6	-179.7	179.1	0	108.4
728	A	35.3	Very low	29.5	Very low	98 Å²	98	161.8 Å²	161.8	81%	0.81	82%	0.818	S	S	*	*			trans	-67.6	152.7	163	0	0	0	0	0	110.8
729	P	33.7	Very low	29.5	Very low	115 Å²	115	162.4 Å²	162.4	75%	0.747	83%	0.825	S	S	*	*			trans	-132.1	128.1	131.2	19.4	0.8	0	0	0	110.7
730	R	28.1	Very low	29.3	Very low	235 Å²	235	161.5 Å²	161.5	89%	0.887	82%	0.824	S	S	*	*				64	95.4	99.9	-77.9	-173.6	171	-177.8	-3.6	114.1
731	V	30.7	Very low	29.3	Very low	135 Å²	135	156 Å²	156	82%	0.818	82%	0.818	S	S	*	*				7.3	118	122.4	-174.5	0	0	0	0	114.1
732	R	25.9	Very low	29.2	Very low	224 Å²	224	159.6 Å²	159.6	85%	0.845	83%	0.831	S	S	*	*			trans	-121.6	110	157	-163.3	174.1	179.7	177.7	-3.2	106.6
733	E	27	Very low	29.2	Very low	175 Å²	175	159.1 Å²	159.1	82%	0.818	84%	0.835	S	S	*	*			trans	-60.4	128.8	162.9	-77.9	164.3	131.4	0	0	108.9
734	E	26.8	Very low	29.3	Very low	168 Å²	168	162.7 Å²	162.7	79%	0.785	85%	0.853	S	S	*	*			trans	-137	110	139.9	-76	-170.9	173.3	0	0	106.5
735	L	27	Very low	29.2	Very low	252 Å²	252	161.5 Å²	161.5	100%	1.319	86%	0.861	S	S	*	*			trans	-175.2	0	142.2	-95.9	171.4	0	0	0	109.2

Retrieved 735 of 735 residues in 5352.9 ms (Link to these results)

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