A0A3Q0KQ02_SCHMA Loading...

Rad21_Rec8 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KQ02, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	46.3	Very low	66.4	Low	220 Å²	220	132 Å²	132	100%	1.084	66%	0.66	S	S	*	*				0	130.9	0	-77.7	-173.1	172.3	0	0	107.1
2	D	65.5	Low	66.3	Low	127 Å²	127	130.1 Å²	130.1	68%	0.679	65%	0.647	S	S	*	*			trans	-76.5	150.3	179.5	-63.1	-40.3	0	0	0	110.7	Q4 T5	D2-Q4 PolarHBondContact O-N 3.32Å; D2-T5 PolarHBondContact O-N 3.16Å; D2-T5 VanDerWaalsContact O-N 3.14Å; D2-T5 PolarHBondContact O-OG1 3.1Å
3	T	67.5	Low	65.6	Low	128 Å²	128	130 Å²	130	79%	0.785	65%	0.65	S	S	*	*	H	α-helix	trans	-58.5	-20.2	-179.7	49.7	0	0	0	0	113.3	Y7	T3-Y7 PolarHBondContact O-N 3.07Å
4	Q	70.9	Confident	64.9	Low	157 Å²	157	128.9 Å²	128.9	73%	0.734	65%	0.646	S	S	*	*	H	α-helix	trans	-73.2	-37.3	178.9	-122.7	152.7	-16.6	0	0	113.4	D2 Y7 Q8	D2-Q4 PolarHBondContact O-N 3.32Å; Q4-Y7 PolarHBondContact O-N 2.96Å; Q4-Q8 PolarHBondContact O-N 3.36Å
5	T	71.8	Confident	64.2	Low	85 Å²	85	127.7 Å²	127.7	52%	0.521	65%	0.648	S	S	.	*	H	α-helix	trans	-71.4	-34.8	178.9	11.5	0	0	0	0	111.7	D2 Y7 Q8 A9	D2-T5 PolarHBondContact O-N 3.16Å; D2-T5 VanDerWaalsContact O-N 3.14Å; D2-T5 PolarHBondContact O-OG1 3.1Å; T5-Y7 VanDerWaalsContact C-N 3.35Å; T5-Q8 PolarHBondContact O-N 3.07Å; T5-A9 PolarHBondContact O-N 3.42Å; T5-A9 VanDerWaalsContact O-N 3.11Å
6	L	67.9	Low	63.2	Low	123 Å²	123	129.4 Å²	129.4	64%	0.644	66%	0.658	S	S	*	*	H	α-helix	trans	-67.8	-33	175.7	-122	167.7	0	0	0	112.8	R10	L6-R10 PolarHBondContact O-N 3.05Å
7	Y	69.2	Low	62.4	Low	171 Å²	171	128.8 Å²	128.8	67%	0.671	66%	0.662	S	S	*	*	H	α-helix	trans	-72.1	-33	176	-148.9	-82.7	0	0	0	112.1	T3 Q4 T5 N11	T3-Y7 PolarHBondContact O-N 3.07Å; Q4-Y7 PolarHBondContact O-N 2.96Å; T5-Y7 VanDerWaalsContact C-N 3.35Å; Y7-N11 PolarHBondContact O-N 3.27Å
8	Q	70	Confident	61.3	Low	118 Å²	118	131.6 Å²	131.6	55%	0.551	67%	0.672	S	S	*	*	H	α-helix	trans	-76.6	-46	-178.6	-173.2	154.8	-8.1	0	0	112.2	Q4 T5 R10 N11 E12	Q4-Q8 PolarHBondContact O-N 3.36Å; T5-Q8 PolarHBondContact O-N 3.07Å; Q8-R10 PolarHBondContact O-N 3.04Å; Q8-N11 PolarHBondContact O-N 3.09Å; Q8-E12 WeakPolarHBondContact CG-OE1 3.43Å; Q8-E12 PolarHBondContact NE2-OE1 2.9Å; Q8-E12 PolarHBondContact O-N 3.32Å; Q8-E12 VanDerWaalsContact O-N 3.12Å
9	A	68.2	Low	60.3	Low	51 Å²	51	132.9 Å²	132.9	42%	0.421	68%	0.681	S	S	.	*	H	α-helix	trans	-55.7	-39.3	173	0	0	0	0	0	112.5	T5 N11 E12 D13	T5-A9 PolarHBondContact O-N 3.42Å; T5-A9 VanDerWaalsContact O-N 3.11Å; A9-N11 VanDerWaalsContact C-N 3.31Å; A9-N11 PolarHBondContact O-N 3.25Å; A9-E12 PolarHBondContact O-N 3.11Å; A9-D13 PolarHBondContact O-N 2.91Å; A9-D13 VanDerWaalsContact O-N 3.17Å
10	R	67.3	Low	59.2	Low	184 Å²	184	132.7 Å²	132.7	69%	0.694	69%	0.688	S	S	*	*	H	α-helix	trans	-67.8	-26.5	177.8	-170.9	173.8	-177.8	134	3.7	113.9	L6 Q8 I14	L6-R10 PolarHBondContact O-N 3.05Å; Q8-R10 PolarHBondContact O-N 3.04Å; R10-I14 HydrophobicContact CG-CD1 4.48Å; R10-I14 VanDerWaalsContact O-CD1 3.23Å; R10-I14 WeakPolarHBondContact O-CD1 3.41Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.4Å
11	N	65.5	Low	58.3	Low	88 Å²	88	131 Å²	131	47%	0.471	69%	0.688	S	S	.	*	H	α-helix	trans	-80.7	-35	175.2	-77.2	-7.6	0	0	0	111.6	Y7 Q8 A9 I14 T15	Y7-N11 PolarHBondContact O-N 3.27Å; Q8-N11 PolarHBondContact O-N 3.09Å; A9-N11 VanDerWaalsContact C-N 3.31Å; A9-N11 PolarHBondContact O-N 3.25Å; N11-I14 PolarHBondContact O-N 3.01Å; N11-T15 PolarHBondContact O-N 2.91Å; N11-T15 PolarHBondContact O-OG1 3.4Å
12	E	65	Low	58.1	Low	109 Å²	109	127.2 Å²	127.2	51%	0.509	68%	0.677	S	S	.	*	H	α-helix	trans	-69.4	-39.6	-179.3	-69.7	169.3	-163.4	0	0	111.4	Q8 A9 I14 T15	Q8-E12 WeakPolarHBondContact CG-OE1 3.43Å; Q8-E12 PolarHBondContact NE2-OE1 2.9Å; Q8-E12 PolarHBondContact O-N 3.32Å; Q8-E12 VanDerWaalsContact O-N 3.12Å; A9-E12 PolarHBondContact O-N 3.11Å; E12-I14 PolarHBondContact O-N 3.42Å; E12-T15 PolarHBondContact O-N 3.05Å; E12-T15 PolarHBondContact O-OG1 3.41Å
13	D	57.5	Low	56.6	Low	129 Å²	129	129.9 Å²	129.9	69%	0.69	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-23.5	172.3	-84.1	-16.9	0	0	0	114.1	A9	A9-D13 PolarHBondContact O-N 2.91Å; A9-D13 VanDerWaalsContact O-N 3.17Å
14	I	55.5	Low	55.2	Low	114 Å²	114	129.6 Å²	129.6	59%	0.585	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-19.8	179.9	-68.9	172.2	0	0	0	111.5	R10 N11 E12	R10-I14 HydrophobicContact CG-CD1 4.48Å; R10-I14 VanDerWaalsContact O-CD1 3.23Å; R10-I14 WeakPolarHBondContact O-CD1 3.41Å; R10-I14 VanDerWaalsContact O-CG1 3.28Å; R10-I14 WeakPolarHBondContact O-CG1 3.4Å; N11-I14 PolarHBondContact O-N 3.01Å; E12-I14 PolarHBondContact O-N 3.42Å
15	T	54.2	Low	53.6	Low	112 Å²	112	128.4 Å²	128.4	69%	0.687	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	2	-176.5	45.9	0	0	0	0	115.9	N11 E12	N11-T15 PolarHBondContact O-N 2.91Å; N11-T15 PolarHBondContact O-OG1 3.4Å; E12-T15 PolarHBondContact O-N 3.05Å; E12-T15 PolarHBondContact O-OG1 3.41Å
16	L	49.3	Very low	51.6	Low	154 Å²	154	128.5 Å²	128.5	81%	0.806	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	15.1	177.3	-73.6	171.7	0	0	0	114.1
17	V	48.6	Very low	50	Low	119 Å²	119	126.5 Å²	126.5	72%	0.721	71%	0.706	S	S	*	*			trans	-127.3	60	-177.3	-167.1	0	0	0	0	111.3
18	E	43.8	Very low	48.2	Very low	179 Å²	179	130.1 Å²	130.1	84%	0.836	72%	0.719	S	S	*	*			trans	-159.8	106.1	167	-117.7	163.5	-145.6	0	0	111.5
19	D	42.1	Very low	46.3	Very low	157 Å²	157	133.5 Å²	133.5	84%	0.84	73%	0.732	S	S	*	*			trans	-167.9	78.4	152.3	-109.9	-15.4	0	0	0	111	S21	D19-S21 PolarHBondContact O-N 3.32Å
20	P	38.6	Very low	44.8	Very low	128 Å²	128	135.3 Å²	135.3	83%	0.831	74%	0.741	S	S	*	*			trans	-93.5	71.6	176.2	36.5	-31.6	0	0	0	111.1
21	S	40.1	Very low	43.1	Very low	97 Å²	97	137 Å²	137	68%	0.678	75%	0.754	S	S	*	*			trans	-131.3	101.9	169.9	69.4	0	0	0	0	112.3	D19	D19-S21 PolarHBondContact O-N 3.32Å
22	V	42.2	Very low	41.7	Very low	142 Å²	142	141.1 Å²	141.1	86%	0.861	77%	0.77	S	S	*	*			trans	-179.4	107.5	136.3	152.3	0	0	0	0	106.4
23	E	33.5	Very low	40.3	Very low	183 Å²	183	144 Å²	144	86%	0.855	78%	0.784	S	S	*	*			trans	-67	143.9	160.6	-57	174.1	128	0	0	108.7
24	T	38	Very low	39.2	Very low	121 Å²	121	145 Å²	145	74%	0.742	79%	0.789	S	S	*	*			trans	178.4	127.2	134.8	-77	0	0	0	0	111.6
25	T	36.5	Very low	38.2	Very low	133 Å²	133	147.8 Å²	147.8	82%	0.816	80%	0.804	S	S	*	*			trans	52.1	111.1	167.7	51.1	0	0	0	0	119.3
26	G	30.5	Very low	37.3	Very low	87 Å²	87	150.3 Å²	150.3	90%	0.897	81%	0.813	S	S	*	*			trans	-76.9	140.2	168.1	0	0	0	0	0	113.5
27	A	35.7	Very low	36.6	Very low	80 Å²	80	147.6 Å²	147.6	66%	0.661	80%	0.804	S	S	*	*			trans	-121.9	118.2	158.3	0	0	0	0	0	108.3	F29	A27-F29 HydrophobicContact CB-CE2 4.41Å; A27-F29 PolarHBondContact O-N 2.97Å
28	R	30.3	Very low	35.8	Very low	248 Å²	248	150.1 Å²	150.1	94%	0.936	81%	0.808	S	S	*	*			trans	-64.4	113.3	170.7	-86.2	175.5	164.5	159.6	-6.7	108.7
29	F	30.6	Very low	35.4	Very low	189 Å²	189	150.3 Å²	150.3	83%	0.829	81%	0.806	S	S	*	*			trans	-94.1	88.8	158.7	-81.5	-79.3	0	0	0	109.3	A27 F31	A27-F29 HydrophobicContact CB-CE2 4.41Å; A27-F29 PolarHBondContact O-N 2.97Å; F29-F31 PolarHBondContact O-N 3.38Å
30	S	37.1	Very low	34.9	Very low	88 Å²	88	149.1 Å²	149.1	62%	0.615	80%	0.799	S	S	*	*			trans	-66.6	123	160.3	37.3	0	0	0	0	108.9	E32	S30-E32 PolarHBondContact O-N 3.12Å; S30-E32 VanDerWaalsContact O-N 3.12Å
31	F	30.7	Very low	34.5	Very low	219 Å²	219	152.2 Å²	152.2	96%	0.961	80%	0.799	S	S	*	*			trans	-67	103.8	158.3	-97.4	-100.6	0	0	0	107.1	F29	F29-F31 PolarHBondContact O-N 3.38Å
32	E	37.1	Very low	34.1	Very low	176 Å²	176	155.4 Å²	155.4	82%	0.822	80%	0.804	S	S	*	*			trans	-105.9	144.5	176.7	-160.7	159.9	-148.7	0	0	110.2	S30	S30-E32 PolarHBondContact O-N 3.12Å; S30-E32 VanDerWaalsContact O-N 3.12Å
33	E	35.3	Very low	33.4	Very low	169 Å²	169	153.3 Å²	153.3	79%	0.79	80%	0.796	S	S	*	*			trans	-87.5	167.2	-167.9	-63.4	175.8	122.2	0	0	112.1
34	D	33.1	Very low	33.4	Very low	150 Å²	150	150.5 Å²	150.5	80%	0.802	79%	0.791	S	S	*	*			trans	48.2	96.4	154.6	-63.1	-13.3	0	0	0	119.7
35	L	35.2	Very low	33	Very low	173 Å²	173	152 Å²	152	91%	0.906	79%	0.794	S	S	*	*			trans	-127	91.6	153.2	-72.6	177.5	0	0	0	111.4
36	L	34.6	Very low	32.8	Very low	165 Å²	165	157.9 Å²	157.9	86%	0.864	80%	0.802	S	S	*	*			trans	-82.3	125.9	154.4	-72.3	173	0	0	0	108.4	E38	L36-E38 PolarHBondContact O-N 3.1Å
37	P	35.8	Very low	32.9	Very low	96 Å²	96	156.6 Å²	156.6	62%	0.623	79%	0.788	S	S	*	*			trans	-81.2	99.3	166.8	-10.3	27.9	0	0	0	109.8	F39	P37-F39 HydrophobicContact CB-CD2 3.89Å; P37-F39 HydrophobicContact CB-CE2 3.59Å; P37-F39 HydrophobicContact CB-CZ 4.44Å; P37-F39 PolarHBondContact O-N 3.02Å
38	E	32.1	Very low	32.8	Very low	173 Å²	173	159.5 Å²	159.5	81%	0.808	79%	0.793	S	S	*	*			trans	-68.3	106.7	156.1	-77.3	-171.9	141.6	0	0	108.4	L36 I40	L36-E38 PolarHBondContact O-N 3.1Å; E38-I40 PolarHBondContact O-N 2.87Å
39	F	34.3	Very low	33.1	Very low	182 Å²	182	155.8 Å²	155.8	80%	0.798	79%	0.786	S	S	*	*			trans	-88.7	89.7	169	-82.9	-78	0	0	0	109.8	P37 F41	P37-F39 HydrophobicContact CB-CD2 3.89Å; P37-F39 HydrophobicContact CB-CE2 3.59Å; P37-F39 HydrophobicContact CB-CZ 4.44Å; P37-F39 PolarHBondContact O-N 3.02Å; F39-F41 PolarHBondContact O-N 3.46Å
40	I	32.4	Very low	33.1	Very low	133 Å²	133	152.4 Å²	152.4	68%	0.682	78%	0.781	S	S	*	*			trans	-69.2	117.8	166.9	-63.3	177.6	0	0	0	108.4	E38 E42	E38-I40 PolarHBondContact O-N 2.87Å; I40-E42 HydrophobicContact CG2-CB 4.3Å; I40-E42 PolarHBondContact O-N 2.96Å
41	F	29.6	Very low	32.9	Very low	192 Å²	192	154.1 Å²	154.1	84%	0.842	79%	0.788	S	S	*	*			trans	-77	91.6	167.3	-103.7	-89.9	0	0	0	109.3	F39	F39-F41 PolarHBondContact O-N 3.46Å
42	E	30.8	Very low	33.1	Very low	165 Å²	165	152.1 Å²	152.1	77%	0.771	78%	0.781	S	S	*	*			trans	-104.4	96.3	170	-163.7	152.2	-146.8	0	0	110.6	I40	I40-E42 HydrophobicContact CG2-CB 4.3Å; I40-E42 PolarHBondContact O-N 2.96Å
43	S	28.6	Very low	32.7	Very low	98 Å²	98	149.3 Å²	149.3	69%	0.685	78%	0.778	S	S	*	*			trans	-98	99.5	179.5	-56.8	0	0	0	0	109.9
44	T	33.4	Very low	32.8	Very low	124 Å²	124	148 Å²	148	76%	0.761	78%	0.782	S	S	*	*			trans	-120.9	117.7	176.7	-47.7	0	0	0	0	111.8
45	N	29.6	Very low	32.8	Very low	152 Å²	152	147.6 Å²	147.6	81%	0.813	78%	0.78	S	S	*	*			trans	-70.4	144.1	-172.1	-69.9	-70.7	0	0	0	114.9
46	R	32.5	Very low	32.5	Very low	256 Å²	256	146.7 Å²	146.7	97%	0.966	78%	0.775	S	S	*	*			trans	-177.1	128.4	142.7	-103.3	169.6	-168.6	-109.8	3.7	108.6
47	G	33	Very low	32.4	Very low	60 Å²	60	146.2 Å²	146.2	62%	0.619	77%	0.771	S	S	*	*			cis	-177.3	156.9	-7.9	0	0	0	0	0	110
48	D	31.8	Very low	32	Very low	142 Å²	142	146.7 Å²	146.7	76%	0.759	78%	0.775	S	S	*	*			trans	55.6	129.9	163.4	-41.7	-31.8	0	0	0	117.6
49	H	38.1	Very low	32.1	Very low	169 Å²	169	146 Å²	146	78%	0.782	77%	0.774	S	S	*	*				-163.3	121.3	60.5	-64.4	-66.2	0	0	0	113.3
50	T	30.6	Very low	31.8	Very low	118 Å²	118	145.1 Å²	145.1	72%	0.724	77%	0.773	S	S	*	*				66.8	123.9	129	-35	0	0	0	0	122.5
51	T	33	Very low	31.8	Very low	124 Å²	124	146.3 Å²	146.3	76%	0.761	78%	0.779	S	S	*	*			trans	69.8	138	153.7	34.8	0	0	0	0	120.3
52	Q	34.7	Very low	31.8	Very low	178 Å²	178	142.5 Å²	142.5	83%	0.832	77%	0.774	S	S	*	*			cis	-140.9	161.9	0.5	-92.5	-172.2	3	0	0	111.2
53	P	28.3	Very low	31.6	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	78%	0.778	S	S	*	*			trans	-100.9	151	-179.3	38.1	-32.2	0	0	0	114.6
54	V	37.1	Very low	31.7	Very low	142 Å²	142	146.2 Å²	146.2	86%	0.861	79%	0.786	S	S	*	*			trans	-143.1	106.4	159.5	-177.1	0	0	0	0	111.4
55	D	33.8	Very low	31.4	Very low	142 Å²	142	149.1 Å²	149.1	76%	0.759	79%	0.787	S	S	*	*			trans	24.7	102.4	148.3	-56.6	-22	0	0	0	122.8
56	L	28.4	Very low	31.5	Very low	154 Å²	154	153 Å²	153	81%	0.806	79%	0.791	S	S	*	*				20.6	118	122.4	-65	166.8	0	0	0	120.4
57	I	32.8	Very low	31.4	Very low	154 Å²	154	150.8 Å²	150.8	79%	0.79	78%	0.784	S	S	*	*			trans	-138	114.7	135.1	-57.3	-179	0	0	0	108.8	I59	I57-I59 HydrophobicContact CG2-CG1 4.27Å
58	P	27.7	Very low	31.2	Very low	107 Å²	107	154.7 Å²	154.7	70%	0.695	79%	0.789	S	S	*	*			trans	-89.1	129.5	166.6	16.1	-0.4	0	0	0	110.6
59	I	33.1	Very low	31.2	Very low	157 Å²	157	153.5 Å²	153.5	81%	0.805	79%	0.792	S	S	*	*			trans	-106.5	115.4	169.6	-64.2	178.4	0	0	0	108.2	I57	I57-I59 HydrophobicContact CG2-CG1 4.27Å
60	E	27.6	Very low	30.9	Very low	165 Å²	165	154.7 Å²	154.7	77%	0.771	80%	0.795	S	S	*	*			trans	-79.9	-176.4	172.1	-61.6	-175.1	140.1	0	0	111.8
61	I	33.3	Very low	30.8	Very low	158 Å²	158	156.8 Å²	156.8	81%	0.81	80%	0.796	S	S	*	*			trans	90.9	127.3	163.9	-48.5	152.6	0	0	0	115.1
62	P	29.1	Very low	30.8	Very low	111 Å²	111	157.3 Å²	157.3	72%	0.721	79%	0.794	S	S	*	*			cis	-138.7	-177.9	-36.1	38.9	-19.1	0	0	0	113.5	E64	P62-E64 PolarHBondContact O-N 2.91Å
63	N	26.3	Very low	30.6	Very low	163 Å²	163	155.5 Å²	155.5	87%	0.872	79%	0.794	S	S	*	*			trans	-65.8	122.6	172.2	-74.9	-66.2	0	0	0	113.8
64	E	31	Very low	30.9	Very low	179 Å²	179	159.8 Å²	159.8	84%	0.836	80%	0.797	S	S	*	*			trans	-100.9	113.3	158.2	-84.5	-155	147.8	0	0	112.2	P62 R66	P62-E64 PolarHBondContact O-N 2.91Å; E64-R66 PolarHBondContact O-N 2.86Å
65	K	28.1	Very low	30.6	Very low	184 Å²	184	159.3 Å²	159.3	80%	0.8	79%	0.785	S	S	*	*			trans	-74.4	105.9	171.5	-68.9	174.8	177.7	174.8	0	110.1	Y67	K65-Y67 PolarHBondContact O-N 3.12Å
66	R	31.1	Very low	30.5	Very low	234 Å²	234	160.6 Å²	160.6	88%	0.883	79%	0.792	S	S	*	*			trans	-72.2	113.5	164.9	-77.1	-173.5	176.8	169.4	1.2	110.2	E64 I68	E64-R66 PolarHBondContact O-N 2.86Å; R66-I68 PolarHBondContact O-N 3.46Å
67	Y	30.7	Very low	30.8	Very low	209 Å²	209	160.7 Å²	160.7	82%	0.82	79%	0.786	S	S	*	*			trans	-65.7	121.5	-178.9	-90.8	-104.8	0	0	0	111.9	K65 S69	K65-Y67 PolarHBondContact O-N 3.12Å; Y67-S69 PolarHBondContact O-N 3.47Å
68	I	29.7	Very low	30.8	Very low	143 Å²	143	158.3 Å²	158.3	73%	0.733	79%	0.789	S	S	*	*			trans	-68	119.5	158.4	-62.9	172.9	0	0	0	107.2	R66 K70	R66-I68 PolarHBondContact O-N 3.46Å; I68-K70 VanDerWaalsContact C-N 3.28Å; I68-K70 HydrophobicContact CG2-CG 4.34Å; I68-K70 PolarHBondContact O-N 2.97Å
69	S	30.9	Very low	31.1	Very low	117 Å²	117	162.5 Å²	162.5	82%	0.818	80%	0.8	S	S	*	*			trans	-70	82.2	175.4	-75.2	0	0	0	0	111.6	Y67 H71	Y67-S69 PolarHBondContact O-N 3.47Å; S69-H71 PolarHBondContact O-N 2.94Å
70	K	30.7	Very low	30.8	Very low	193 Å²	193	161 Å²	161	84%	0.839	80%	0.798	S	S	*	*			trans	-79.7	89.5	159.9	-68.2	-176.4	179.3	-178.5	0	108.3	I68	I68-K70 VanDerWaalsContact C-N 3.28Å; I68-K70 HydrophobicContact CG2-CG 4.34Å; I68-K70 PolarHBondContact O-N 2.97Å
71	H	30.4	Very low	31.2	Very low	162 Å²	162	160 Å²	160	75%	0.75	80%	0.802	S	S	*	*			trans	-100.7	129.8	173.8	-141.2	-68.9	0	0	0	110.5	S69	S69-H71 PolarHBondContact O-N 2.94Å
72	L	31.9	Very low	31	Very low	136 Å²	136	160.4 Å²	160.4	71%	0.712	80%	0.801	S	S	*	*			trans	67.9	66.9	175.2	-65.9	134.1	0	0	0	116.8	Y74	L72-Y74 HydrophobicContact CD2-CD2 4.15Å
73	V	29.7	Very low	31.1	Very low	140 Å²	140	166.5 Å²	166.5	85%	0.848	81%	0.812	S	S	*	*				-87.9	122.1	126.6	175.2	0	0	0	0	106.2
74	Y	34.7	Very low	31.4	Very low	205 Å²	205	163.8 Å²	163.8	80%	0.804	81%	0.805	S	S	*	*			trans	-121.7	118	165.9	-123.8	-88.9	0	0	0	107.3	L72	L72-Y74 HydrophobicContact CD2-CD2 4.15Å
75	E	30.7	Very low	31.2	Very low	132 Å²	132	161.2 Å²	161.2	62%	0.617	80%	0.802	S	S	*	*			trans	-62.9	140.9	167.3	-70.2	-171.5	118.5	0	0	109.2	K77	E75-K77 WeakPolarHBondContact OE1-CE 3.36Å; E75-K77 IonicContact OE1-NZ 2.87Å; E75-K77 PolarHBondContact OE1-NZ 3.41Å; E75-K77 IonicContact OE2-NZ 3.21Å; E75-K77 PolarHBondContact OE2-NZ 3.33Å
76	N	33.4	Very low	31.4	Very low	169 Å²	169	158.3 Å²	158.3	90%	0.904	80%	0.799	S	S	*	*			trans	-127.7	117	146.6	-106.4	-8.8	0	0	0	107.1
77	K	33.7	Very low	31.2	Very low	157 Å²	157	155.3 Å²	155.3	68%	0.683	80%	0.795	S	S	*	*			trans	-92	149	175.6	-81.4	172.3	173.6	128.7	0	110	E75	E75-K77 WeakPolarHBondContact OE1-CE 3.36Å; E75-K77 IonicContact OE1-NZ 2.87Å; E75-K77 PolarHBondContact OE1-NZ 3.41Å; E75-K77 IonicContact OE2-NZ 3.21Å; E75-K77 PolarHBondContact OE2-NZ 3.33Å
78	A	32.6	Very low	31.2	Very low	103 Å²	103	156.9 Å²	156.9	85%	0.851	80%	0.799	S	S	*	*			trans	63.1	130.8	175.4	0	0	0	0	0	114
79	E	34.1	Very low	31.1	Very low	196 Å²	196	155.2 Å²	155.2	92%	0.916	80%	0.801	S	S	*	*			cis	-142.2	168.2	47.5	-159.9	160.8	-152.9	0	0	112.9
80	V	28.1	Very low	31.1	Very low	126 Å²	126	154.9 Å²	154.9	76%	0.764	80%	0.797	S	S	*	*			trans	-97.7	136.2	-166.6	173.1	0	0	0	0	111.7
81	T	34.6	Very low	31.2	Very low	142 Å²	142	156 Å²	156	87%	0.871	80%	0.797	S	S	*	*			trans	-153.2	131.1	149.8	-16.9	0	0	0	0	110.4
82	E	28.7	Very low	31.3	Very low	168 Å²	168	152.8 Å²	152.8	79%	0.785	79%	0.793	S	S	*	*			trans	-72.7	150.1	-174.4	-56.7	165.8	115.9	0	0	112.3
83	Y	31.7	Very low	31.1	Very low	239 Å²	239	153.1 Å²	153.1	94%	0.937	80%	0.796	S	S	*	*			trans	-153	142.9	131.8	-93.1	-67	0	0	0	110
84	S	32.4	Very low	31.3	Very low	106 Å²	106	155.9 Å²	155.9	74%	0.741	80%	0.796	S	S	*	*			trans	-91.4	150.5	-159.5	53.7	0	0	0	0	115.7
85	V	27	Very low	31.1	Very low	125 Å²	125	151.8 Å²	151.8	76%	0.758	79%	0.793	S	S	*	*			trans	-62.5	143.8	168	175	0	0	0	0	111.7	E87	V85-E87 HydrophobicContact CG1-CG 4.07Å
86	V	31.9	Very low	31.2	Very low	123 Å²	123	153.5 Å²	153.5	75%	0.745	80%	0.801	S	S	*	*			trans	-132.2	103.9	158.1	179.1	0	0	0	0	109.1
87	E	27.5	Very low	31.1	Very low	171 Å²	171	156.7 Å²	156.7	80%	0.799	80%	0.8	S	S	*	*			trans	-80.8	147.2	162.7	-66.1	-175.7	148.3	0	0	110.2	V85	V85-E87 HydrophobicContact CG1-CG 4.07Å
88	R	30.6	Very low	30.8	Very low	242 Å²	242	155 Å²	155	91%	0.913	81%	0.805	S	S	*	*			trans	-139.5	103.8	158.3	-89.5	-171.8	174.9	154.6	-0.1	110.4
89	S	27.7	Very low	30.9	Very low	108 Å²	108	157.6 Å²	157.6	76%	0.755	80%	0.803	S	S	*	*			trans	-84.3	158.4	154.7	55	0	0	0	0	109.8
90	C	30.5	Very low	30.9	Very low	109 Å²	109	154 Å²	154	74%	0.736	79%	0.794	S	S	*	*			trans	165.5	122.3	138.8	-89.9	0	0	0	0	114
91	Y	33.3	Very low	30.8	Very low	216 Å²	216	154.1 Å²	154.1	85%	0.847	80%	0.796	S	S	*	*			trans	58	98.6	142.1	-71.2	-85.1	0	0	0	123.5
92	S	31.8	Very low	30.7	Very low	96 Å²	96	155.3 Å²	155.3	67%	0.671	80%	0.795	S	S	*	*				48.2	129.6	106.5	-168.3	0	0	0	0	122.8
93	D	28.6	Very low	30.8	Very low	142 Å²	142	156.1 Å²	156.1	76%	0.759	80%	0.799	S	S	*	*			trans	58.6	113.5	145.9	-67.3	17.8	0	0	0	122.4
94	K	34.4	Very low	30.8	Very low	199 Å²	199	147.5 Å²	147.5	87%	0.865	78%	0.783	S	S	*	*				-168	115.4	114.8	-101.9	155.2	-170.2	174.5	0	114.7
95	T	30.8	Very low	30.7	Very low	119 Å²	119	149.5 Å²	149.5	73%	0.73	79%	0.786	S	S	*	*			trans	15.5	141.3	139.6	56.8	0	0	0	0	122.5
96	Q	32.6	Very low	30.7	Very low	167 Å²	167	150.7 Å²	150.7	78%	0.78	79%	0.788	S	S	*	*			trans	112.6	95.5	138.6	-84.3	167.7	1.2	0	0	121.5
97	R	29.7	Very low	30.7	Very low	236 Å²	236	150.9 Å²	150.9	89%	0.891	79%	0.789	S	S	*	*			trans	72.8	139	131.1	-71.3	-175.8	173.5	-176.4	-2.4	121.5
98	P	28.8	Very low	30.6	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	79%	0.786	S	S	*	*			trans	-103.1	162.7	-175.9	41	-35.9	0	0	0	114.5
99	I	33.8	Very low	30.5	Very low	156 Å²	156	147.8 Å²	147.8	80%	0.8	79%	0.785	S	S	*	*			trans	-140.4	116.5	170.6	-70.6	-174.4	0	0	0	111.7
100	T	33.5	Very low	30.5	Very low	120 Å²	120	148.8 Å²	148.8	74%	0.736	78%	0.782	S	S	*	*			trans	41.6	121.2	151.4	62.2	0	0	0	0	123.4
101	T	26.9	Very low	30.4	Very low	130 Å²	130	148.3 Å²	148.3	80%	0.798	78%	0.78	S	S	*	*			trans	-24.2	135	139.1	-46.2	0	0	0	0	116.7
102	I	32.8	Very low	30.3	Very low	167 Å²	167	143.9 Å²	143.9	86%	0.856	78%	0.775	S	S	*	*			trans	-131.4	141.6	147	-65	-175.7	0	0	0	108.7
103	Q	31	Very low	30.1	Very low	184 Å²	184	144.5 Å²	144.5	86%	0.86	78%	0.779	S	S	*	*			trans	-107.4	147.9	-171.4	-179.1	-174.7	17.6	0	0	110.4
104	G	31	Very low	30.1	Very low	59 Å²	59	144.5 Å²	144.5	61%	0.608	78%	0.779	S	S	*	*			trans	110.5	115.7	148.5	0	0	0	0	0	118.7
105	N	31	Very low	29.8	Very low	148 Å²	148	142.6 Å²	142.6	79%	0.791	77%	0.773	S	S	*	*			trans	75.7	120.5	136.1	-56.6	-7	0	0	0	120.6
106	N	26.2	Very low	29.7	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	78%	0.78	S	S	*	*			trans	49.4	115.2	137.4	-54.5	-12.9	0	0	0	118.5
107	V	31.6	Very low	29.6	Very low	126 Å²	126	143.4 Å²	143.4	76%	0.764	77%	0.773	S	S	*	*				-168.8	136.1	116.9	141.1	0	0	0	0	110.9
108	I	25.6	Very low	29.5	Very low	143 Å²	143	137.8 Å²	137.8	73%	0.733	77%	0.767	S	S	*	*			trans	-34.1	136.1	167	-60.6	152.3	0	0	0	113.5	D110	I108-D110 HydrophobicContact CG2-CB 4.34Å
109	F	30.2	Very low	29.5	Very low	206 Å²	206	138 Å²	138	90%	0.904	77%	0.766	S	S	*	*			trans	-123.2	124.1	147.5	-98.9	-83.3	0	0	0	110.8
110	D	26	Very low	29.1	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	77%	0.767	S	S	*	*			trans	-102	166.9	-179.2	-172.2	6.3	0	0	0	109.1	I108	I108-D110 HydrophobicContact CG2-CB 4.34Å
111	S	28.5	Very low	29.1	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	77%	0.769	S	S	*	*			trans	68.3	157.1	175.1	-49.4	0	0	0	0	114.9
112	V	31.7	Very low	29.3	Very low	123 Å²	123	139.2 Å²	139.2	75%	0.745	77%	0.773	S	S	*	*			cis	-140.4	139.5	22.4	176.2	0	0	0	0	110.8
113	S	27.5	Very low	28.9	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	77%	0.768	S	S	*	*			trans	-66.6	125.4	167	-179.6	0	0	0	0	111.3
114	N	29.7	Very low	29.1	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	76%	0.764	S	S	*	*			trans	-111.3	95.6	166.4	-99.2	-27.7	0	0	0	111
115	Q	26.9	Very low	28.9	Very low	158 Å²	158	138.3 Å²	138.3	74%	0.738	77%	0.77	S	S	*	*			trans	-76.7	121.3	172.7	-171	-178.4	67.8	0	0	109.3	V117	Q115-V117 HydrophobicContact CG-CG2 4.06Å
116	F	29.1	Very low	29.3	Very low	199 Å²	199	137.1 Å²	137.1	87%	0.873	77%	0.771	S	S	*	*			trans	-119.6	106.9	163.1	-94.5	-81.2	0	0	0	110
117	V	30.1	Very low	29.5	Very low	104 Å²	104	135 Å²	135	63%	0.63	77%	0.767	S	S	*	*			trans	-78.3	143.8	178.2	175	0	0	0	0	109.1	Q115	Q115-V117 HydrophobicContact CG-CG2 4.06Å
118	P	27.2	Very low	29.8	Very low	118 Å²	118	137.4 Å²	137.4	77%	0.766	77%	0.768	S	S	*	*			trans	-72	147.9	-175.1	29.7	-37.1	0	0	0	112.8
119	V	30.1	Very low	30	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	77%	0.768	S	S	*	*			trans	-111	116.5	168.1	174.8	0	0	0	0	108.8	T121	V119-T121 HydrophobicContact CG1-CG2 3.99Å
120	S	24.5	Very low	30.2	Very low	117 Å²	117	134.5 Å²	134.5	82%	0.818	76%	0.763	S	S	*	*			trans	-88.2	133.3	161	-53.4	0	0	0	0	108.6
121	T	32.9	Very low	30.6	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	76%	0.761	S	S	*	*			trans	-127.9	135	165.8	43.6	0	0	0	0	110.8	V119	V119-T121 HydrophobicContact CG1-CG2 3.99Å
122	E	31.1	Very low	30.9	Very low	187 Å²	187	135.7 Å²	135.7	87%	0.874	77%	0.765	S	S	*	*			trans	-66	163.4	-161.1	-68.2	162.2	107	0	0	117.2
123	T	25.5	Very low	31.1	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	77%	0.766	S	S	*	*			trans	-52.2	133.4	162.5	-51	0	0	0	0	113.4
124	V	34.4	Very low	31.6	Very low	130 Å²	130	139.3 Å²	139.3	79%	0.788	77%	0.77	S	S	*	*			trans	-136	111.3	153	-178.1	0	0	0	0	109.8
125	N	26.7	Very low	32	Very low	137 Å²	137	138.1 Å²	138.1	73%	0.733	77%	0.768	S	S	*	*			trans	-84.8	141.3	159.2	-74.5	-45.7	0	0	0	108.9
126	P	39.4	Very low	32.4	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	77%	0.769	S	S	*	*			trans	-114.3	138.3	146.2	33.9	-26.3	0	0	0	110.7
127	S	31.6	Very low	32.9	Very low	105 Å²	105	132 Å²	132	73%	0.734	76%	0.761	S	S	*	*			trans	-98.6	165.7	177.4	-43.2	0	0	0	0	111.5
128	K	37.2	Very low	33.2	Very low	177 Å²	177	135.7 Å²	135.7	77%	0.77	77%	0.771	S	S	*	*			trans	87.2	118.4	149.3	-73.6	178.6	-179.4	-177.2	0	120.9
129	D	29	Very low	33.7	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	77%	0.769	S	S	*	*				85.3	155.5	127.2	-56.9	-18.4	0	0	0	121.2
130	L	35.7	Very low	34	Very low	151 Å²	151	133 Å²	133	79%	0.791	77%	0.772	S	S	*	*			trans	83.8	92.8	175.5	-48.8	-178.9	0	0	0	115.4
131	T	33.5	Very low	34.6	Very low	107 Å²	107	131.2 Å²	131.2	66%	0.656	76%	0.764	S	S	*	*				90.1	144.1	61.4	59.1	0	0	0	0	115.1
132	N	35.2	Very low	35	Very low	145 Å²	145	132.7 Å²	132.7	78%	0.775	77%	0.767	S	S	*	*			trans	87.4	107.8	170.9	-47.3	-29.6	0	0	0	114.2
133	V	35.3	Very low	35.3	Very low	128 Å²	128	129.8 Å²	129.8	78%	0.776	76%	0.762	S	S	*	*				85.5	104.6	52.5	175.1	0	0	0	0	112.9
134	E	38.4	Very low	35.8	Very low	179 Å²	179	129.4 Å²	129.4	84%	0.836	76%	0.763	S	S	*	*				-169.2	116.4	128.6	-101.1	170.5	175.7	0	0	107.7
135	T	38.4	Very low	35.9	Very low	118 Å²	118	129.5 Å²	129.5	72%	0.724	76%	0.764	S	S	*	*				47.7	140.9	88.3	12.3	0	0	0	0	115.4
136	L	35.5	Very low	36	Very low	144 Å²	144	128 Å²	128	75%	0.754	76%	0.76	S	S	*	*			cis	-161.5	161.6	11.9	-176.3	71.5	0	0	0	110.6
137	A	38.3	Very low	35.8	Very low	84 Å²	84	128.2 Å²	128.2	69%	0.694	76%	0.764	S	S	*	*			trans	94.7	147.6	147.8	0	0	0	0	0	120.2
138	Q	37.5	Very low	35.8	Very low	183 Å²	183	131.8 Å²	131.8	86%	0.855	77%	0.769	S	S	*	*			cis	-174	151.2	-36.7	-131	164.7	-32.1	0	0	109.3
139	G	38	Very low	35.8	Very low	70 Å²	70	128.4 Å²	128.4	72%	0.722	77%	0.768	S	S	*	*			trans	127.3	87.2	170	0	0	0	0	0	114.5
140	S	36.4	Very low	36.1	Very low	118 Å²	118	126.3 Å²	126.3	83%	0.825	76%	0.764	S	S	*	*				74.1	108.2	91.4	-157.4	0	0	0	0	112.9
141	A	37.5	Very low	36.2	Very low	81 Å²	81	125.4 Å²	125.4	67%	0.669	76%	0.76	S	S	*	*			cis	100.7	125.8	36	0	0	0	0	0	113.4
142	D	40	Very low	36.3	Very low	158 Å²	158	127.4 Å²	127.4	85%	0.845	77%	0.765	S	S	*	*			trans	146.3	115.1	158.8	-79.6	-11.6	0	0	0	108.9
143	V	37.5	Very low	36.5	Very low	127 Å²	127	125.8 Å²	125.8	77%	0.77	76%	0.763	S	S	*	*			cis	103.7	138.7	19.5	-179.6	0	0	0	0	114.2
144	C	36.6	Very low	36.4	Very low	114 Å²	114	127 Å²	127	77%	0.77	76%	0.761	S	S	*	*			trans	78.7	141.9	166.5	-89.9	0	0	0	0	118.8
145	T	35.4	Very low	36.1	Very low	132 Å²	132	124.5 Å²	124.5	81%	0.81	75%	0.754	S	S	*	*			cis	-152.3	164.7	-4.2	-23.9	0	0	0	0	112.6
146	V	29.2	Very low	36	Very low	106 Å²	106	124.7 Å²	124.7	64%	0.642	76%	0.76	S	S	*	*			trans	-80.5	162.2	179.3	170.4	0	0	0	0	113.8	Q148	V146-Q148 HydrophobicContact CG1-CG 3.85Å
147	S	35.6	Very low	35.8	Very low	127 Å²	127	123.7 Å²	123.7	89%	0.888	76%	0.76	S	S	*	*			trans	-145.2	142.9	149.6	-74	0	0	0	0	111.6
148	Q	32.6	Very low	35.7	Very low	180 Å²	180	127.6 Å²	127.6	84%	0.841	77%	0.769	S	S	*	*			trans	-129.9	152	-170.7	-65.4	174.5	-26.3	0	0	112.2	V146	V146-Q148 HydrophobicContact CG1-CG 3.85Å
149	S	35.8	Very low	35.3	Very low	107 Å²	107	123.2 Å²	123.2	75%	0.748	76%	0.764	S	S	*	*			trans	174.6	121.1	150.3	46.7	0	0	0	0	107.6
150	S	36	Very low	35.1	Very low	94 Å²	94	128.2 Å²	128.2	66%	0.657	77%	0.773	S	S	*	*				68.8	134.8	69.4	94.7	0	0	0	0	111.8
151	D	37.3	Very low	34.8	Very low	131 Å²	131	127.5 Å²	127.5	70%	0.701	77%	0.768	S	S	*	*			cis	-154.5	149.4	21	-79.9	-68.5	0	0	0	115.1
152	I	36.5	Very low	34.8	Very low	150 Å²	150	130 Å²	130	77%	0.769	78%	0.775	S	S	*	*			trans	55	135.7	134.5	-56.2	171.8	0	0	0	122.5
153	P	37.9	Very low	34.3	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	77%	0.773	S	S	*	*			trans	-107.6	-179.8	179.4	43	-36.6	0	0	0	115.3
154	M	33.4	Very low	34.4	Very low	152 Å²	152	129.5 Å²	129.5	75%	0.749	77%	0.772	S	S	*	*			trans	174.1	151.1	134.6	-93.1	-67.9	-88.9	0	0	114.7
155	D	32	Very low	34.3	Very low	127 Å²	127	131.1 Å²	131.1	68%	0.679	77%	0.773	S	S	*	*			trans	43.3	125.5	155.2	-65.7	-10.9	0	0	0	124.7
156	S	37.1	Very low	34.2	Very low	123 Å²	123	129.3 Å²	129.3	86%	0.86	77%	0.765	S	S	*	*				-161.3	144	109.5	54.9	0	0	0	0	113
157	V	32.3	Very low	34.5	Very low	122 Å²	122	131.5 Å²	131.5	74%	0.739	78%	0.779	S	S	*	*			trans	-91	149.3	-173.9	168.9	0	0	0	0	111.3
158	N	35.1	Very low	34.3	Very low	166 Å²	166	130.9 Å²	130.9	89%	0.888	77%	0.769	S	S	*	*			trans	-170.1	128.7	132.7	-95.8	-22	0	0	0	113
159	A	28.3	Very low	34.3	Very low	91 Å²	91	129.6 Å²	129.6	75%	0.752	77%	0.767	S	S	*	*			trans	-120.8	140.3	171.9	0	0	0	0	0	109.4
160	I	34.8	Very low	33.9	Very low	176 Å²	176	130 Å²	130	90%	0.903	77%	0.766	S	S	*	*			trans	-131.7	140.7	161.5	-64.1	-175.3	0	0	0	107.8
161	S	29.3	Very low	33.5	Very low	103 Å²	103	130 Å²	130	72%	0.72	77%	0.767	S	S	*	*			trans	-107.9	-167.9	-166	-171.7	0	0	0	0	112.1
162	T	38.2	Very low	33.2	Very low	133 Å²	133	127.8 Å²	127.8	82%	0.816	77%	0.766	S	S	*	*			trans	91.8	107.6	177.3	70.5	0	0	0	0	114.4
163	N	30.5	Very low	32.8	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	77%	0.768	S	S	*	*			cis	88.3	151.7	37.2	-163	17	0	0	0	113.7
164	V	38.3	Very low	32.4	Very low	121 Å²	121	132.9 Å²	132.9	73%	0.733	77%	0.774	S	S	*	*			trans	79.7	122.4	-168.3	-175.2	0	0	0	0	111.7
165	D	35.1	Very low	32.1	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	78%	0.775	S	S	*	*			cis	-139.6	-169.6	1.9	-142.7	-37.2	0	0	0	112.6
166	S	32.5	Very low	31.9	Very low	93 Å²	93	131.3 Å²	131.3	65%	0.65	78%	0.783	S	S	*	*			trans	-131.9	138	-178.8	-64.2	0	0	0	0	114.2
167	V	35	Very low	31.6	Very low	153 Å²	153	133 Å²	133	93%	0.927	78%	0.777	S	S	*	*			trans	-132.8	135.6	153	-178.4	0	0	0	0	107.9
168	V	32.5	Very low	31.6	Very low	113 Å²	113	134.5 Å²	134.5	69%	0.685	78%	0.78	S	S	*	*			trans	-128.4	168.6	-160.6	-171.7	0	0	0	0	109.8
169	I	32.2	Very low	31.6	Very low	154 Å²	154	131.7 Å²	131.7	79%	0.79	76%	0.763	S	S	*	*			trans	92.8	128.7	161.1	-51.9	175.4	0	0	0	114.8
170	P	27.3	Very low	31.8	Very low	114 Å²	114	132.9 Å²	132.9	74%	0.74	76%	0.757	S	S	*	*			cis	-136	172.9	-24.9	37.6	-19.4	0	0	0	115.2
171	S	27.5	Very low	31.8	Very low	95 Å²	95	129.4 Å²	129.4	66%	0.664	74%	0.74	S	S	*	*			trans	-65.7	136.7	165.6	-180	0	0	0	0	112.3
172	A	30.5	Very low	32.2	Very low	84 Å²	84	128.6 Å²	128.6	69%	0.694	73%	0.734	S	S	*	*			trans	-113.5	113.7	160.2	0	0	0	0	0	109.1	F174	A172-F174 PolarHBondContact O-N 2.95Å
173	H	29.3	Very low	32.4	Very low	173 Å²	173	127.2 Å²	127.2	80%	0.801	73%	0.726	S	S	*	*			trans	-70.4	119.9	175.8	-71.4	-101.2	0	0	0	110.4
174	F	29.3	Very low	32.8	Very low	195 Å²	195	126.1 Å²	126.1	86%	0.855	72%	0.716	S	S	*	*			trans	-105.3	109.7	157.3	-87.2	-79	0	0	0	109.7	A172 T176	A172-F174 PolarHBondContact O-N 2.95Å; F174-T176 PolarHBondContact O-N 3.06Å
175	S	26.3	Very low	33.1	Very low	109 Å²	109	124.2 Å²	124.2	76%	0.762	70%	0.701	S	S	*	*			trans	-57.4	128.1	-179.2	-57.9	0	0	0	0	111.3	E177	S175-E177 PolarHBondContact O-N 3.25Å
176	T	28.7	Very low	33.5	Very low	137 Å²	137	121.4 Å²	121.4	84%	0.84	69%	0.689	S	S	*	*			trans	-76.4	78.9	172.8	-24.1	0	0	0	0	109.1	F174 I178	F174-T176 PolarHBondContact O-N 3.06Å; T176-I178 PolarHBondContact O-N 2.98Å
177	E	29.4	Very low	33.8	Very low	158 Å²	158	122.5 Å²	122.5	74%	0.738	69%	0.688	S	S	*	*			trans	-74.4	101.7	179	-152.5	172	-129.5	0	0	109.6	S175 I179	S175-E177 PolarHBondContact O-N 3.25Å; E177-I179 HydrophobicContact CB-CG1 4.29Å; E177-I179 HydrophobicContact CG-CG1 4.08Å; E177-I179 PolarHBondContact O-N 3.18Å
178	I	33.1	Very low	34.2	Very low	155 Å²	155	120.4 Å²	120.4	80%	0.795	67%	0.671	S	S	*	*			trans	-73.1	79	173.9	-57.2	176	0	0	0	107.3	T176 N180	T176-I178 PolarHBondContact O-N 2.98Å; I178-N180 PolarHBondContact O-N 3.21Å
179	I	34.7	Very low	34.8	Very low	106 Å²	106	123.9 Å²	123.9	54%	0.544	68%	0.676	S	S	.	*			trans	-68.1	104.2	178.8	-58.3	-179.7	0	0	0	108.6	E177 N181	E177-I179 HydrophobicContact CB-CG1 4.29Å; E177-I179 HydrophobicContact CG-CG1 4.08Å; E177-I179 PolarHBondContact O-N 3.18Å; I179-N181 VanDerWaalsContact C-N 3.31Å; I179-N181 WeakPolarHBondContact CG2-OD1 3.46Å; I179-N181 PolarHBondContact O-N 2.87Å
180	N	34	Very low	35.4	Very low	116 Å²	116	123.8 Å²	123.8	62%	0.62	67%	0.672	S	S	*	*			trans	-75.6	79.7	-177.2	-166.1	1.6	0	0	0	110.2	I178 S182 T183	I178-N180 PolarHBondContact O-N 3.21Å; N180-S182 PolarHBondContact O-N 3.18Å; N180-T183 PolarHBondContact O-OG1 3.26Å
181	N	34.9	Very low	35.8	Very low	103 Å²	103	125.3 Å²	125.3	55%	0.551	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	2.7	-173.2	-73.2	-37.9	0	0	0	115.7	I179 T183	I179-N181 VanDerWaalsContact C-N 3.31Å; I179-N181 WeakPolarHBondContact CG2-OD1 3.46Å; I179-N181 PolarHBondContact O-N 2.87Å; N181-T183 PolarHBondContact O-N 3.33Å
182	S	37.9	Very low	36	Very low	86 Å²	86	127.5 Å²	127.5	60%	0.601	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-26	172.5	-79.7	0	0	0	0	113.9	N180	N180-S182 PolarHBondContact O-N 3.18Å
183	T	40.6	Very low	36.1	Very low	104 Å²	104	129.5 Å²	129.5	64%	0.638	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-36.2	-177.4	47.3	0	0	0	0	113.8	N180 N181 L185 V186	N180-T183 PolarHBondContact O-OG1 3.26Å; N181-T183 PolarHBondContact O-N 3.33Å; T183-L185 PolarHBondContact O-N 2.84Å; T183-V186 PolarHBondContact O-N 3.3Å
184	Q	40.8	Very low	36.1	Very low	131 Å²	131	127 Å²	127	61%	0.612	68%	0.678	S	S	*	*	H	α-helix	trans	-64.2	-28.7	177.8	-67.5	-163.1	4.6	0	0	112.7	V186 N187	Q184-V186 PolarHBondContact O-N 3.22Å; Q184-N187 PolarHBondContact O-N 3.04Å
185	L	43.2	Very low	36.3	Very low	80 Å²	80	125.8 Å²	125.8	42%	0.419	68%	0.68	S	S	.	*	H	α-helix	trans	-73.6	-10.5	179.4	-117.4	148.2	0	0	0	114	T183	T183-L185 PolarHBondContact O-N 2.84Å
186	V	43.4	Very low	36.5	Very low	90 Å²	90	128.2 Å²	128.2	55%	0.545	68%	0.679	S	S	.	*	H	α-helix	trans	-80.6	-41.9	173.2	-179.2	0	0	0	0	110.6	T183 Q184 I188 K189	T183-V186 PolarHBondContact O-N 3.3Å; Q184-V186 PolarHBondContact O-N 3.22Å; V186-I188 VanDerWaalsContact C-N 3.27Å; V186-I188 PolarHBondContact O-N 3.15Å; V186-K189 PolarHBondContact O-N 3.32Å; V186-K189 VanDerWaalsContact O-N 3.13Å
187	N	40.3	Very low	36.6	Very low	116 Å²	116	129.9 Å²	129.9	62%	0.62	68%	0.677	S	S	*	*	H	α-helix	trans	-65.6	-26.3	-177.2	-72.7	-2.8	0	0	0	113.7	Q184 K189 Q190	Q184-N187 PolarHBondContact O-N 3.04Å; N187-K189 PolarHBondContact O-N 3.08Å; N187-Q190 WeakPolarHBondContact O-CB 3.3Å; N187-Q190 PolarHBondContact O-N 3.15Å
188	I	43.2	Very low	36.8	Very low	110 Å²	110	127.9 Å²	127.9	56%	0.564	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-25	177.1	-60	174.8	0	0	0	111.6	V186 Q190	V186-I188 VanDerWaalsContact C-N 3.27Å; V186-I188 PolarHBondContact O-N 3.15Å; I188-Q190 VanDerWaalsContact C-N 3.31Å
189	K	43.5	Very low	36.8	Very low	185 Å²	185	127.5 Å²	127.5	80%	0.804	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-13.9	173.6	-69.6	-169.6	172.3	-170.1	0	114	V186 N187	V186-K189 PolarHBondContact O-N 3.32Å; V186-K189 VanDerWaalsContact O-N 3.13Å; N187-K189 PolarHBondContact O-N 3.08Å
190	Q	46	Very low	36.6	Very low	152 Å²	152	129.7 Å²	129.7	71%	0.71	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-16.6	179.6	-134.1	76.8	23.7	0	0	112.4	N187 I188 N192	N187-Q190 WeakPolarHBondContact O-CB 3.3Å; N187-Q190 PolarHBondContact O-N 3.15Å; I188-Q190 VanDerWaalsContact C-N 3.31Å; Q190-N192 VanDerWaalsContact C-N 3.25Å; Q190-N192 PolarHBondContact O-N 3.45Å; Q190-N192 VanDerWaalsContact O-N 3.08Å
191	L	35.3	Very low	36.5	Very low	146 Å²	146	129 Å²	129	76%	0.764	68%	0.682	S	S	*	*			trans	-85.9	55.1	-178.8	-109.6	154.8	0	0	0	112.6
192	N	32.6	Very low	36.5	Very low	141 Å²	141	130 Å²	130	75%	0.754	69%	0.692	S	S	*	*			trans	-86.9	157.4	146.2	-87	-16.5	0	0	0	107.6	Q190	Q190-N192 VanDerWaalsContact C-N 3.25Å; Q190-N192 PolarHBondContact O-N 3.45Å; Q190-N192 VanDerWaalsContact O-N 3.08Å
193	V	32.6	Very low	36.2	Very low	127 Å²	127	132.4 Å²	132.4	77%	0.77	70%	0.699	S	S	*	*	S	Bend	trans	77.1	113.9	-175.4	-173.1	0	0	0	0	111.8
194	V	28.9	Very low	35.7	Very low	121 Å²	121	136.6 Å²	136.6	73%	0.733	71%	0.708	S	S	*	*			cis	-128.2	131.9	-6.5	177	0	0	0	0	107.4	E196	V194-E196 HydrophobicContact CG1-CB 4.49Å
195	L	32.1	Very low	35.4	Very low	169 Å²	169	138.6 Å²	138.6	89%	0.885	72%	0.722	S	S	*	*			trans	-118	100.4	162.3	-137.3	165.2	0	0	0	106.5	Q197	L195-Q197 PolarHBondContact O-N 3.2Å
196	E	30.9	Very low	35	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	74%	0.739	S	S	*	*			trans	-63.3	124.6	-172.4	-168.1	167.7	-157.7	0	0	109.8	V194 V198	V194-E196 HydrophobicContact CG1-CB 4.49Å; E196-V198 PolarHBondContact O-N 3.36Å
197	Q	31.8	Very low	34.5	Very low	171 Å²	171	145.3 Å²	145.3	80%	0.799	75%	0.754	S	S	*	*			trans	-70.9	94.8	175.1	-74.8	178.7	-40.5	0	0	108.6	L195 E199	L195-Q197 PolarHBondContact O-N 3.2Å; Q197-E199 PolarHBondContact O-N 3.37Å
198	V	32.8	Very low	34.4	Very low	117 Å²	117	146 Å²	146	71%	0.709	76%	0.763	S	S	*	*			trans	-72.5	81.3	165.1	-176.4	0	0	0	0	108.1	E196 L200	E196-V198 PolarHBondContact O-N 3.36Å; V198-L200 PolarHBondContact O-N 2.99Å
199	E	32.5	Very low	34	Very low	147 Å²	147	148.5 Å²	148.5	69%	0.687	77%	0.772	S	S	*	*			trans	-63.6	116.3	165.9	-70	-166.6	136.4	0	0	108.7	Q197 T201	Q197-E199 PolarHBondContact O-N 3.37Å; E199-T201 VanDerWaalsContact C-N 3.29Å; E199-T201 PolarHBondContact O-N 2.82Å
200	L	31.7	Very low	33.5	Very low	151 Å²	151	146.8 Å²	146.8	79%	0.791	77%	0.769	S	S	*	*			trans	-79.4	78.2	174.7	-71.2	171.3	0	0	0	109.7	V198 T202	V198-L200 PolarHBondContact O-N 2.99Å; L200-T202 PolarHBondContact O-N 2.89Å; L200-T202 VanDerWaalsContact O-N 3.1Å
201	T	32.6	Very low	33.1	Very low	102 Å²	102	145.6 Å²	145.6	63%	0.626	77%	0.772	S	S	*	*			trans	-70.5	100.3	168.9	50.3	0	0	0	0	109.7	E199 D203	E199-T201 VanDerWaalsContact C-N 3.29Å; E199-T201 PolarHBondContact O-N 2.82Å; T201-D203 VanDerWaalsContact C-N 3.32Å; T201-D203 PolarHBondContact O-N 3.49Å
202	T	33.6	Very low	33.1	Very low	123 Å²	123	147 Å²	147	76%	0.755	78%	0.775	S	S	*	*			trans	-77.5	79.5	173.4	51.6	0	0	0	0	110.6	L200	L200-T202 PolarHBondContact O-N 2.89Å; L200-T202 VanDerWaalsContact O-N 3.1Å
203	D	32.1	Very low	33.3	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	78%	0.781	S	S	*	*			trans	-93.9	123.8	176.9	-73.3	-24	0	0	0	112.1	T201 L205	T201-D203 VanDerWaalsContact C-N 3.32Å; T201-D203 PolarHBondContact O-N 3.49Å; D203-L205 PolarHBondContact O-N 3.4Å
204	F	30.8	Very low	33.2	Very low	192 Å²	192	150 Å²	150	84%	0.842	78%	0.784	S	S	*	*			trans	-70.2	119	170.9	-71.3	-108.3	0	0	0	109
205	L	34.3	Very low	33.6	Very low	173 Å²	173	148.8 Å²	148.8	91%	0.906	78%	0.779	S	S	*	*			trans	-100.2	107.2	160.7	-82.4	168.9	0	0	0	109.4	D203	D203-L205 PolarHBondContact O-N 3.4Å
206	T	34.6	Very low	33.9	Very low	125 Å²	125	149 Å²	149	77%	0.767	78%	0.775	S	S	*	*			trans	-70.7	146.4	168.4	36.6	0	0	0	0	110.1
207	E	32.6	Very low	34.1	Very low	185 Å²	185	148.8 Å²	148.8	86%	0.864	77%	0.772	S	S	*	*			trans	-55.7	150.1	167.5	-60.8	166.5	109.7	0	0	111
208	T	37.7	Very low	34.6	Very low	132 Å²	132	147.6 Å²	147.6	81%	0.81	77%	0.766	S	S	*	*				178.8	157.8	121.6	-64.7	0	0	0	0	109.4
209	E	34.9	Very low	34.8	Very low	162 Å²	162	150 Å²	150	76%	0.757	77%	0.77	S	S	*	*			trans	82.3	136.6	172.8	-55.9	-158.6	161.2	0	0	117.6
210	M	33.5	Very low	35.1	Very low	148 Å²	148	154 Å²	154	73%	0.729	78%	0.778	S	S	*	*			cis	-173.4	120.1	-27.1	-126.3	-154	-64	0	0	108.4
211	T	36.3	Very low	35.3	Very low	128 Å²	128	152 Å²	152	79%	0.785	77%	0.772	S	S	*	*			trans	-165.7	106.6	144.9	9.9	0	0	0	0	114.5
212	Q	37.2	Very low	35.3	Very low	174 Å²	174	154.1 Å²	154.1	81%	0.813	78%	0.78	S	S	*	*			trans	41.9	115	133.2	-55.6	176.8	36.8	0	0	120.2
213	I	34.9	Very low	35.3	Very low	175 Å²	175	152.4 Å²	152.4	90%	0.897	77%	0.772	S	S	*	*				-169.4	129.3	106.1	-89	150.6	0	0	0	109.6
214	L	32.2	Very low	35.2	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	77%	0.771	S	S	*	*			trans	-97.5	169.4	177.4	-151.9	49.6	0	0	0	107.4
215	P	36.8	Very low	35.4	Very low	96 Å²	96	147.3 Å²	147.3	62%	0.623	77%	0.767	S	S	*	*			cis	-155.8	172	27.4	45.8	-24.4	0	0	0	121.8
216	Q	37.9	Very low	35.4	Very low	173 Å²	173	143.4 Å²	143.4	81%	0.808	75%	0.754	S	S	*	*			trans	66.3	144.6	157.9	-70.9	169.5	28.1	0	0	116.4
217	K	35.9	Very low	35.7	Very low	156 Å²	156	144.5 Å²	144.5	68%	0.678	75%	0.75	S	S	*	*			cis	-160.2	169.4	8.5	-127.1	-173.8	172.5	-142.7	0	107.1
218	E	40.5	Very low	36.1	Very low	146 Å²	146	142.8 Å²	142.8	68%	0.682	74%	0.742	S	S	*	*			cis	-153.1	171.4	-1.2	-168.1	148.6	-146.4	0	0	108.8
219	E	38	Very low	36.1	Very low	168 Å²	168	143.8 Å²	143.8	79%	0.785	74%	0.743	S	S	*	*			trans	-99.1	160.3	-172.4	-56.4	167.9	115.4	0	0	115.1
220	R	37.9	Very low	36.4	Very low	229 Å²	229	142.6 Å²	142.6	86%	0.864	75%	0.746	S	S	*	*			trans	174	107.5	130.7	-91.2	153.1	-164.5	-157.9	5.5	110.5
221	T	36.3	Very low	36.5	Very low	109 Å²	109	141.4 Å²	141.4	67%	0.669	75%	0.751	S	S	*	*				60.7	136.1	85.6	62.4	0	0	0	0	114.7
222	L	34	Very low	36.5	Very low	148 Å²	148	140.5 Å²	140.5	78%	0.775	75%	0.747	S	S	*	*			cis	-167.8	145.4	7.8	-115.2	165.3	0	0	0	112.5
223	S	32.1	Very low	36.6	Very low	86 Å²	86	139.6 Å²	139.6	60%	0.601	75%	0.746	S	S	*	*			trans	44.4	130.9	139.2	67.5	0	0	0	0	125.8
224	S	30.1	Very low	36.5	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	74%	0.735	S	S	*	*				64.2	156.7	128.6	73.9	0	0	0	0	119.9
225	T	35.7	Very low	36.8	Very low	121 Å²	121	136.5 Å²	136.5	74%	0.742	74%	0.739	S	S	*	*			cis	-152.5	161.3	25.7	30.7	0	0	0	0	111.9
226	S	34.1	Very low	36.7	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	75%	0.745	S	S	*	*			trans	16.3	156.5	144.6	77.4	0	0	0	0	122
227	E	40.3	Very low	36.6	Very low	147 Å²	147	137.5 Å²	137.5	69%	0.687	75%	0.746	S	S	*	*			cis	-178.8	171.7	42.2	-142.4	164.8	-99.8	0	0	112.9
228	Q	41.5	Very low	36.6	Very low	149 Å²	149	136 Å²	136	70%	0.696	75%	0.75	S	S	*	*			trans	66.3	107	157.7	-57.3	179.6	27.3	0	0	118.9
229	N	37.1	Very low	36.4	Very low	154 Å²	154	138 Å²	138	82%	0.824	76%	0.759	S	S	*	*				77.1	111.4	76.3	-74.3	-29.5	0	0	0	115.2
230	V	41.7	Very low	36.5	Very low	137 Å²	137	134.8 Å²	134.8	83%	0.83	76%	0.755	S	S	*	*				-173	121.3	121.1	169.1	0	0	0	0	109.3
231	C	35.2	Very low	36.4	Very low	123 Å²	123	133.1 Å²	133.1	83%	0.831	76%	0.757	S	S	*	*			trans	-113.4	160.1	147.1	-63.6	0	0	0	0	106.8
232	P	37	Very low	36.7	Very low	109 Å²	109	135.8 Å²	135.8	71%	0.708	76%	0.762	S	S	*	*				-159.3	-176.9	93.7	34.9	-11	0	0	0	117.8
233	I	40	Very low	36.8	Very low	154 Å²	154	134.5 Å²	134.5	79%	0.79	76%	0.756	S	S	*	*			trans	88.3	76.1	155.9	-36.4	-172.9	0	0	0	119.9
234	S	32.6	Very low	37.4	Very low	96 Å²	96	136 Å²	136	67%	0.671	76%	0.762	S	S	*	*				18.8	128.2	121	175.5	0	0	0	0	121.3
235	L	38.9	Very low	38	Very low	171 Å²	171	138.6 Å²	138.6	90%	0.895	76%	0.762	S	S	*	*			trans	-149.8	110.2	142.3	-104.1	149.1	0	0	0	109.4
236	H	33.2	Very low	38.3	Very low	163 Å²	163	143.8 Å²	143.8	76%	0.755	77%	0.768	S	S	*	*			trans	-84	151.8	168.2	-83.8	-83.7	0	0	0	110.4
237	P	36.9	Very low	38.8	Very low	127 Å²	127	150.6 Å²	150.6	83%	0.825	78%	0.78	S	S	*	*				-120.4	162.8	115.9	-5.8	26	0	0	0	114.2
238	V	34.8	Very low	39.1	Very low	126 Å²	126	155.2 Å²	155.2	76%	0.764	79%	0.791	S	S	*	*			trans	-91.4	138.4	179.3	169.5	0	0	0	0	109.9
239	E	37.7	Very low	39.8	Very low	187 Å²	187	155.6 Å²	155.6	87%	0.874	80%	0.796	S	S	*	*			trans	-163.6	126	147.3	-112.7	155.6	-142.9	0	0	113.8
240	S	40.2	Very low	40.6	Very low	101 Å²	101	157.7 Å²	157.7	71%	0.706	80%	0.798	S	S	*	*			trans	35.6	105.7	162.2	57.4	0	0	0	0	121.7	E242	S240-E242 PolarHBondContact O-N 3.13Å
241	E	35.3	Very low	41.4	Very low	194 Å²	194	160.6 Å²	160.6	91%	0.907	80%	0.8	S	S	*	*			trans	-74.1	105.3	151.1	-72.2	-90.8	153.6	0	0	109.8
242	E	42.7	Very low	42.5	Very low	165 Å²	165	165.8 Å²	165.8	77%	0.771	80%	0.801	S	S	*	*			trans	-90.2	104.3	163.7	-80.1	-157.7	153.3	0	0	110.4	S240 T244	S240-E242 PolarHBondContact O-N 3.13Å; E242-T244 VanDerWaalsContact C-N 3.28Å; E242-T244 PolarHBondContact O-N 3.32Å
243	D	35.9	Very low	43.6	Very low	121 Å²	121	165 Å²	165	65%	0.647	80%	0.799	S	S	*	*			trans	-72.5	74.3	-172.4	-158.3	-6.8	0	0	0	112.9	H245	D243-H245 VanDerWaalsContact CG-CE1 3.47Å; D243-H245 PolarHBondContact O-N 3.14Å; D243-H245 IonicContact OD1-CE1 3.68Å; D243-H245 PolarHBondContact OD1-CE1 3.31Å; D243-H245 IonicContact OD1-CG 2.84Å; D243-H245 IonicContact OD1-ND1 3.71Å; D243-H245 PolarHBondContact OD1-ND1 3.39Å; D243-H245 IonicContact OD2-CE1 2.65Å; D243-H245 PolarHBondContact OD2-CE1 3.25Å; D243-H245 VanDerWaalsContact OD2-CE1 3.31Å; D243-H245 IonicContact OD2-ND1 2.97Å
244	T	45.2	Very low	44.6	Very low	118 Å²	118	165 Å²	165	72%	0.724	80%	0.801	S	S	*	*			trans	-80.4	82.8	173.6	54.7	0	0	0	0	110.5	E242 R246	E242-T244 VanDerWaalsContact C-N 3.28Å; E242-T244 PolarHBondContact O-N 3.32Å; T244-R246 PolarHBondContact O-N 3.18Å
245	H	42.5	Very low	46.6	Very low	156 Å²	156	169 Å²	169	72%	0.722	81%	0.806	S	S	*	*			trans	-61.1	66.4	169.7	-78.9	1.6	0	0	0	113	D243 R247	D243-H245 VanDerWaalsContact CG-CE1 3.47Å; D243-H245 PolarHBondContact O-N 3.14Å; D243-H245 IonicContact OD1-CE1 3.68Å; D243-H245 PolarHBondContact OD1-CE1 3.31Å; D243-H245 IonicContact OD1-CG 2.84Å; D243-H245 IonicContact OD1-ND1 3.71Å; D243-H245 PolarHBondContact OD1-ND1 3.39Å; D243-H245 IonicContact OD2-CE1 2.65Å; D243-H245 PolarHBondContact OD2-CE1 3.25Å; D243-H245 VanDerWaalsContact OD2-CE1 3.31Å; D243-H245 IonicContact OD2-ND1 2.97Å; H245-R247 PolarHBondContact O-N 2.88Å
246	R	42.2	Very low	48.6	Very low	230 Å²	230	168.2 Å²	168.2	87%	0.868	80%	0.801	S	S	*	*			trans	-76.2	90.8	176.3	-156.3	177.9	-162.6	-127.7	5.7	108.1	T244 R248	T244-R246 PolarHBondContact O-N 3.18Å; R246-R248 PolarHBondContact O-N 3.28Å
247	R	44.6	Very low	50.8	Low	235 Å²	235	168 Å²	168	89%	0.887	81%	0.805	S	S	*	*			trans	-47	97.3	176.7	-73.9	-177.7	175.8	178.1	-2	110.9	H245 I249	H245-R247 PolarHBondContact O-N 2.88Å; R247-I249 PolarHBondContact O-N 2.9Å
248	R	45.3	Very low	53.1	Low	244 Å²	244	168.8 Å²	168.8	92%	0.921	80%	0.8	S	S	*	*			trans	-67.2	96.9	171.2	-84	-177.4	166	-178.2	-5.4	108	R246 K250	R246-R248 PolarHBondContact O-N 3.28Å; R248-K250 PolarHBondContact O-N 3.16Å
249	I	56.3	Low	55.5	Low	156 Å²	156	168.4 Å²	168.4	80%	0.8	79%	0.794	S	S	*	*			trans	-63	102.8	169.2	-59.6	174.6	0	0	0	106.8	R247 K251	R247-I249 PolarHBondContact O-N 2.9Å; I249-K251 PolarHBondContact O-N 3.38Å
250	K	55.2	Low	57.9	Low	199 Å²	199	169 Å²	169	87%	0.865	80%	0.796	S	S	*	*			trans	-62.8	106.3	172.2	-70.3	-176.9	178.3	179.1	0	107.7	R248 R252	R248-K250 PolarHBondContact O-N 3.16Å; K250-R252 PolarHBondContact O-N 2.94Å; K250-R252 VanDerWaalsContact O-N 3.08Å
251	K	57.5	Low	60.2	Low	198 Å²	198	170.5 Å²	170.5	86%	0.861	80%	0.795	S	S	*	*			trans	-58.8	113.2	168.4	-67.2	177.3	-178.3	172.4	0	107.1	I249 S253	I249-K251 PolarHBondContact O-N 3.38Å; K251-S253 PolarHBondContact O-N 2.63Å
252	R	59.4	Low	62.6	Low	231 Å²	231	167.2 Å²	167.2	87%	0.872	79%	0.789	S	S	*	*			trans	-63.2	117.7	163.9	-74.3	-176.6	172.7	-177.8	-3.2	106	K250 N254	K250-R252 PolarHBondContact O-N 2.94Å; K250-R252 VanDerWaalsContact O-N 3.08Å; R252-N254 PolarHBondContact O-N 3.29Å
253	S	59.3	Low	64.9	Low	93 Å²	93	169.4 Å²	169.4	65%	0.65	79%	0.79	S	S	*	*			trans	-68.8	114.6	169.2	39.7	0	0	0	0	107.4	K251 K255	K251-S253 PolarHBondContact O-N 2.63Å; S253-K255 PolarHBondContact O-N 3.39Å
254	N	61.6	Low	67.4	Low	155 Å²	155	168 Å²	168	83%	0.829	78%	0.782	S	S	*	*			trans	-69.2	80.8	170.6	-65.9	-12.6	0	0	0	107.5	R252 L256	R252-N254 PolarHBondContact O-N 3.29Å; N254-L256 PolarHBondContact O-N 2.91Å
255	K	74.4	Confident	69.7	Low	179 Å²	179	165.5 Å²	165.5	78%	0.778	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64.3	118.9	170.9	-66.1	-174.7	179.3	-175.4	0	106.8	S253 I257	S253-K255 PolarHBondContact O-N 3.39Å; K255-I257 PolarHBondContact O-N 2.8Å
256	L	79.5	Confident	72.2	Confident	154 Å²	154	160.1 Å²	160.1	81%	0.806	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-59.2	127	170.6	-68.3	168.2	0	0	0	107.8	N254 I258	N254-L256 PolarHBondContact O-N 2.91Å; L256-I258 HydrophobicContact CB-CG1 4.36Å; L256-I258 PolarHBondContact O-N 3.13Å
257	I	80.6	Confident	74.7	Confident	160 Å²	160	152.5 Å²	152.5	82%	0.821	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-75.3	120.8	165.4	-59.3	173.4	0	0	0	105.1	K255	K255-I257 PolarHBondContact O-N 2.8Å
258	I	84.1	Confident	77	Confident	142 Å²	142	145.3 Å²	145.3	73%	0.728	71%	0.711	S	S	*	*			trans	-113.9	118.9	177.4	-58.9	174.7	0	0	0	105.6	L256 E260	L256-I258 HydrophobicContact CB-CG1 4.36Å; L256-I258 PolarHBondContact O-N 3.13Å; I258-E260 PolarHBondContact O-N 3.1Å
259	D	85.3	Confident	79.3	Confident	119 Å²	119	138.2 Å²	138.2	64%	0.636	69%	0.691	S	S	*	*			trans	-68.5	130.5	178.7	-59.9	-37.5	0	0	0	110.2	I261	D259-I261 PolarHBondContact O-N 2.71Å
260	E	89.5	Confident	81.1	Confident	198 Å²	198	138.7 Å²	138.7	93%	0.925	68%	0.683	S	S	*	*	S	Bend	trans	-66.8	-29	178.4	-62.2	-174.1	167.2	0	0	112.2	I258	I258-E260 PolarHBondContact O-N 3.1Å
261	I	88	Confident	83	Confident	134 Å²	134	134.7 Å²	134.7	69%	0.687	66%	0.663	S	S	*	*			trans	-111.9	97.7	-177.2	-55.8	176.2	0	0	0	109.2	D259 R263	D259-I261 PolarHBondContact O-N 2.71Å; I261-R263 WeakPolarHBondContact CG2-O 3.48Å
262	T	86.6	Confident	84.7	Confident	125 Å²	125	127.8 Å²	127.8	77%	0.767	64%	0.635	S	S	*	*			trans	-89.2	-1.6	178.7	56.8	0	0	0	0	114
263	R	89.9	Confident	86.2	Confident	211 Å²	211	124.1 Å²	124.1	80%	0.796	63%	0.63	S	S	*	*	S	Bend	trans	-135.1	120.7	-175.9	-61.2	-175.4	72.3	169.3	5.2	111.4	I261	I261-R263 WeakPolarHBondContact CG2-O 3.48Å
264	L	89.2	Confident	87.8	Confident	92 Å²	92	125.7 Å²	125.7	48%	0.482	63%	0.63	S	S	.	*			trans	-72.1	137.3	173.1	-160.6	70.1	0	0	0	110.7	E268 L269	L264-E268 HydrophobicContact CD1-CB 3.55Å; L264-E268 HydrophobicContact CD1-CG 4.32Å; L264-E268 HydrophobicContact CD2-CB 4.26Å; L264-E268 HydrophobicContact CG-CB 3.64Å; L264-L269 HydrophobicContact CD2-CB 4.08Å; L264-L269 HydrophobicContact CD2-CD1 4.02Å
265	T	93.3	Very high	89.2	Confident	65 Å²	65	120.7 Å²	120.7	40%	0.399	60%	0.602	S	S	.	*			trans	-71.9	156.8	175.1	66.5	0	0	0	0	111.6	S267 E268 L269	T265-S267 PolarHBondContact O-N 3.4Å; T265-S267 PolarHBondContact OG1-OG 2.98Å; T265-E268 WeakPolarHBondContact CA-OE2 3.32Å; T265-E268 VanDerWaalsContact CB-OE2 3.23Å; T265-E268 WeakPolarHBondContact CB-OE2 3.47Å; T265-E268 VanDerWaalsContact CG2-OE2 3.31Å; T265-E268 WeakPolarHBondContact CG2-OE2 3.33Å; T265-E268 PolarHBondContact N-OE2 3.05Å; T265-E268 PolarHBondContact O-N 3.24Å; T265-E268 VanDerWaalsContact O-N 3.17Å; T265-E268 VanDerWaalsContact OG1-CG 3.27Å; T265-E268 WeakPolarHBondContact OG1-CG 3.47Å; T265-E268 PolarHBondContact OG1-N 2.85Å; T265-E268 PolarHBondContact OG1-OE2 3.31Å; T265-L269 PolarHBondContact O-N 3.07Å
266	G	95.2	Very high	89.9	Confident	42 Å²	42	113.1 Å²	113.1	43%	0.433	58%	0.575	S	S	.	*	H	α-helix	trans	-63	-22	177.1	0	0	0	0	0	114.1	R270	G266-R270 WeakPolarHBondContact O-CG 3.32Å; G266-R270 PolarHBondContact O-N 3.01Å; G266-R270 PolarHBondContact O-NE 3.08Å; G266-R270 PolarHBondContact O-NH1 2.99Å; G266-R270 VanDerWaalsContact O-NH1 3.08Å
267	S	93.9	Very high	90.4	Very high	70 Å²	70	112 Å²	112	49%	0.49	57%	0.566	S	S	.	*	H	α-helix	trans	-72.6	-49.6	171	23.9	0	0	0	0	112.1	T265 R270 W271	T265-S267 PolarHBondContact O-N 3.4Å; T265-S267 PolarHBondContact OG1-OG 2.98Å; S267-R270 PolarHBondContact O-N 3.29Å; S267-W271 PolarHBondContact O-N 3.25Å
268	E	93	Very high	90.6	Very high	84 Å²	84	110.7 Å²	110.7	39%	0.393	56%	0.556	S	S	.	*	H	α-helix	trans	-65.3	-38.3	178.2	-69.4	156.6	152.2	0	0	111.2	L264 T265 R270 W271 N272	L264-E268 HydrophobicContact CD1-CB 3.55Å; L264-E268 HydrophobicContact CD1-CG 4.32Å; L264-E268 HydrophobicContact CD2-CB 4.26Å; L264-E268 HydrophobicContact CG-CB 3.64Å; T265-E268 WeakPolarHBondContact CA-OE2 3.32Å; T265-E268 VanDerWaalsContact CB-OE2 3.23Å; T265-E268 WeakPolarHBondContact CB-OE2 3.47Å; T265-E268 VanDerWaalsContact CG2-OE2 3.31Å; T265-E268 WeakPolarHBondContact CG2-OE2 3.33Å; T265-E268 PolarHBondContact N-OE2 3.05Å; T265-E268 PolarHBondContact O-N 3.24Å; T265-E268 VanDerWaalsContact O-N 3.17Å; T265-E268 VanDerWaalsContact OG1-CG 3.27Å; T265-E268 WeakPolarHBondContact OG1-CG 3.47Å; T265-E268 PolarHBondContact OG1-N 2.85Å; T265-E268 PolarHBondContact OG1-OE2 3.31Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 3.41Å; E268-W271 PolarHBondContact O-N 2.71Å; E268-W271 VanDerWaalsContact O-N 3.12Å; E268-N272 WeakPolarHBondContact O-CB 3.42Å; E268-N272 VanDerWaalsContact O-CG 3.32Å; E268-N272 PolarHBondContact O-N 3.25Å; E268-N272 PolarHBondContact O-OD1 2.93Å
269	L	92.8	Very high	90.5	Very high	95 Å²	95	107.4 Å²	107.4	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-57.4	-46.7	173.3	-171.2	78.5	0	0	0	111.4	L264 T265 W271 M273	L264-L269 HydrophobicContact CD2-CB 4.08Å; L264-L269 HydrophobicContact CD2-CD1 4.02Å; T265-L269 PolarHBondContact O-N 3.07Å; L269-W271 VanDerWaalsContact C-N 3.31Å; L269-W271 PolarHBondContact O-N 2.95Å; L269-M273 HydrophobicContact CG-SD 4.44Å; L269-M273 WeakPolarHBondContact O-CB 3.46Å; L269-M273 VanDerWaalsContact O-CG 3.25Å; L269-M273 WeakPolarHBondContact O-CG 3.47Å; L269-M273 PolarHBondContact O-N 2.83Å
270	R	95	Very high	90.4	Very high	167 Å²	167	108.8 Å²	108.8	63%	0.63	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-33.4	176.2	-73.6	-173.1	-59.9	-93.1	2.7	112.5	G266 S267 E268 L274	G266-R270 WeakPolarHBondContact O-CG 3.32Å; G266-R270 PolarHBondContact O-N 3.01Å; G266-R270 PolarHBondContact O-NE 3.08Å; G266-R270 PolarHBondContact O-NH1 2.99Å; G266-R270 VanDerWaalsContact O-NH1 3.08Å; S267-R270 PolarHBondContact O-N 3.29Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 3.41Å; R270-L274 WeakPolarHBondContact O-CB 3.25Å; R270-L274 PolarHBondContact O-N 3.35Å
271	W	94.7	Very high	90.1	Very high	115 Å²	115	102.3 Å²	102.3	44%	0.436	52%	0.521	S	S	.	.	H	α-helix	trans	-70.1	-46.7	177.2	-171.7	92.1	0	0	0	111.1	S267 E268 L269 M273 L274 H275 E278	S267-W271 PolarHBondContact O-N 3.25Å; E268-W271 PolarHBondContact O-N 2.71Å; E268-W271 VanDerWaalsContact O-N 3.12Å; L269-W271 VanDerWaalsContact C-N 3.31Å; L269-W271 PolarHBondContact O-N 2.95Å; W271-M273 VanDerWaalsContact C-N 3.3Å; W271-M273 PolarHBondContact O-N 2.87Å; W271-L274 PolarHBondContact O-N 3.49Å; W271-H275 AromaticContact CD1-CE1 3.44Å; W271-H275 VanDerWaalsContact CD1-CE1 3.44Å; W271-H275 AromaticContact CD1-ND1 3.58Å; W271-H275 AromaticContact CD2-ND1 3.59Å; W271-H275 AromaticContact CE2-CE1 3.69Å; W271-H275 AromaticContact CE2-CG 3.8Å; W271-H275 AromaticContact CE2-ND1 3.41Å; W271-H275 HydrophobicContact CE3-CB 4.49Å; W271-H275 AromaticContact CG-ND1 3.7Å; W271-H275 HydrophobicContact CH2-CB 4.11Å; W271-H275 HydrophobicContact CZ2-CB 4.16Å; W271-H275 AromaticContact CZ2-CG 3.87Å; W271-H275 AromaticContact CZ2-ND1 3.96Å; W271-H275 HydrophobicContact CZ3-CB 4.27Å; W271-H275 AromaticContact NE1-CE1 3.2Å; W271-H275 PolarHBondContact NE1-CE1 3.11Å; W271-H275 AromaticContact NE1-ND1 3.4Å; W271-H275 PolarHBondContact NE1-ND1 2.9Å; W271-H275 AromaticContact NE1-NE2 3.81Å; W271-H275 PolarHBondContact O-N 3.31Å; W271-H275 PolarHBondContact O-ND1 3.28Å; W271-E278 HydrophobicContact CH2-CB 4.49Å; W271-E278 WeakPolarHBondContact CH2-OE2 3.25Å
272	N	92.7	Very high	89.8	Confident	52 Å²	52	100.2 Å²	100.2	28%	0.278	51%	0.514	S	S	.	.	H	α-helix	trans	-60.5	-36.5	173.9	-68.9	8.6	0	0	0	112.2	E268 L274 H275 G276 T279	E268-N272 WeakPolarHBondContact O-CB 3.42Å; E268-N272 VanDerWaalsContact O-CG 3.32Å; E268-N272 PolarHBondContact O-N 3.25Å; E268-N272 PolarHBondContact O-OD1 2.93Å; N272-L274 VanDerWaalsContact C-N 3.26Å; N272-L274 PolarHBondContact O-N 2.98Å; N272-H275 CarbonylContact O-C 3.59Å; N272-G276 WeakPolarHBondContact O-CA 3.43Å; N272-G276 PolarHBondContact O-N 2.69Å; N272-T279 HydrophobicContact CB-CG2 4.31Å
273	M	91.4	Very high	89.4	Confident	154 Å²	154	104.5 Å²	104.5	76%	0.759	52%	0.516	S	S	*	.	H	α-helix	trans	-69	-21.8	174.5	-74.5	178.7	72.8	0	0	113.6	L269 W271	L269-M273 HydrophobicContact CG-SD 4.44Å; L269-M273 WeakPolarHBondContact O-CB 3.46Å; L269-M273 VanDerWaalsContact O-CG 3.25Å; L269-M273 WeakPolarHBondContact O-CG 3.47Å; L269-M273 PolarHBondContact O-N 2.83Å; W271-M273 VanDerWaalsContact C-N 3.3Å; W271-M273 PolarHBondContact O-N 2.87Å
274	L	93.2	Very high	88.8	Confident	127 Å²	127	99.6 Å²	99.6	67%	0.665	51%	0.506	S	S	*	.	H	α-helix	trans	-95	-29.3	179.3	-173.7	63.2	0	0	0	112.7	R270 W271 N272	R270-L274 WeakPolarHBondContact O-CB 3.25Å; R270-L274 PolarHBondContact O-N 3.35Å; W271-L274 PolarHBondContact O-N 3.49Å; N272-L274 VanDerWaalsContact C-N 3.26Å; N272-L274 PolarHBondContact O-N 2.98Å
275	H	91.4	Very high	88.2	Confident	49 Å²	49	100 Å²	100	23%	0.227	51%	0.512	C	S	.	.			trans	-117.9	49.2	-178.8	-49.1	81.2	0	0	0	110.1	W271 N272 E277 E278	W271-H275 AromaticContact CD1-CE1 3.44Å; W271-H275 VanDerWaalsContact CD1-CE1 3.44Å; W271-H275 AromaticContact CD1-ND1 3.58Å; W271-H275 AromaticContact CD2-ND1 3.59Å; W271-H275 AromaticContact CE2-CE1 3.69Å; W271-H275 AromaticContact CE2-CG 3.8Å; W271-H275 AromaticContact CE2-ND1 3.41Å; W271-H275 HydrophobicContact CE3-CB 4.49Å; W271-H275 AromaticContact CG-ND1 3.7Å; W271-H275 HydrophobicContact CH2-CB 4.11Å; W271-H275 HydrophobicContact CZ2-CB 4.16Å; W271-H275 AromaticContact CZ2-CG 3.87Å; W271-H275 AromaticContact CZ2-ND1 3.96Å; W271-H275 HydrophobicContact CZ3-CB 4.27Å; W271-H275 AromaticContact NE1-CE1 3.2Å; W271-H275 PolarHBondContact NE1-CE1 3.11Å; W271-H275 AromaticContact NE1-ND1 3.4Å; W271-H275 PolarHBondContact NE1-ND1 2.9Å; W271-H275 AromaticContact NE1-NE2 3.81Å; W271-H275 PolarHBondContact O-N 3.31Å; W271-H275 PolarHBondContact O-ND1 3.28Å; N272-H275 CarbonylContact O-C 3.59Å; H275-E277 PolarHBondContact O-N 3.38Å; H275-E278 HydrophobicContact CB-CG 4.4Å; H275-E278 PolarHBondContact O-N 3.25Å; H275-E278 VanDerWaalsContact O-N 3.08Å
276	G	89.2	Confident	87	Confident	21 Å²	21	105.3 Å²	105.3	22%	0.216	53%	0.526	C	S	.	.	H	α-helix	trans	-58	-35.9	-174.5	0	0	0	0	0	112.1	N272 E278 T279 M280	N272-G276 WeakPolarHBondContact O-CA 3.43Å; N272-G276 PolarHBondContact O-N 2.69Å; G276-E278 VanDerWaalsContact C-N 3.26Å; G276-E278 PolarHBondContact O-N 3.27Å; G276-T279 CarbonylContact O-C 3.55Å; G276-T279 WeakPolarHBondContact O-CA 3.27Å; G276-T279 PolarHBondContact O-N 3.12Å; G276-T279 PolarHBondContact O-OG1 3.42Å; G276-M280 VanDerWaalsContact O-CG 3.32Å; G276-M280 WeakPolarHBondContact O-CG 3.35Å; G276-M280 PolarHBondContact O-N 2.64Å
277	E	88.7	Confident	85.8	Confident	131 Å²	131	109 Å²	109	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-56.4	-30.4	175.7	62	-81.1	-171.8	0	0	114.6	H275 T279	H275-E277 PolarHBondContact O-N 3.38Å; E277-T279 VanDerWaalsContact C-N 3.34Å
278	E	84.8	Confident	84.3	Confident	131 Å²	131	109.7 Å²	109.7	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-77.5	-23.5	175.4	-63.5	-169.2	-148.7	0	0	112	W271 H275 G276	W271-E278 HydrophobicContact CH2-CB 4.49Å; W271-E278 WeakPolarHBondContact CH2-OE2 3.25Å; H275-E278 HydrophobicContact CB-CG 4.4Å; H275-E278 PolarHBondContact O-N 3.25Å; H275-E278 VanDerWaalsContact O-N 3.08Å; G276-E278 VanDerWaalsContact C-N 3.26Å; G276-E278 PolarHBondContact O-N 3.27Å
279	T	83.2	Confident	82.9	Confident	73 Å²	73	114.3 Å²	114.3	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-95	-12.5	176	68.7	0	0	0	0	113.6	N272 G276 E277 V281	N272-T279 HydrophobicContact CB-CG2 4.31Å; G276-T279 CarbonylContact O-C 3.55Å; G276-T279 WeakPolarHBondContact O-CA 3.27Å; G276-T279 PolarHBondContact O-N 3.12Å; G276-T279 PolarHBondContact O-OG1 3.42Å; E277-T279 VanDerWaalsContact C-N 3.34Å; T279-V281 PolarHBondContact O-N 3.27Å
280	M	83.7	Confident	81.2	Confident	149 Å²	149	113.6 Å²	113.6	73%	0.734	57%	0.569	S	S	*	*			trans	-87.6	105.6	-177.9	-80.7	-174.4	68.6	0	0	111.4	G276	G276-M280 VanDerWaalsContact O-CG 3.32Å; G276-M280 WeakPolarHBondContact O-CG 3.35Å; G276-M280 PolarHBondContact O-N 2.64Å
281	V	81.8	Confident	79.5	Confident	62 Å²	62	109.6 Å²	109.6	38%	0.376	56%	0.564	S	S	.	*			trans	-101.5	131.2	176.4	173.7	0	0	0	0	109.6	T279 V285 Y286	T279-V281 PolarHBondContact O-N 3.27Å; V281-V285 HydrophobicContact CG1-CB 3.49Å; V281-V285 VanDerWaalsContact CG1-CB 3.49Å; V281-V285 HydrophobicContact CG1-CG1 3.54Å; V281-V285 HydrophobicContact CG1-CG2 4.28Å; V281-Y286 HydrophobicContact CB-CD2 4.22Å; V281-Y286 HydrophobicContact CB-CE2 3.52Å; V281-Y286 HydrophobicContact CG1-CD2 3.8Å; V281-Y286 HydrophobicContact CG1-CE1 4.38Å; V281-Y286 HydrophobicContact CG1-CE2 3.53Å; V281-Y286 HydrophobicContact CG1-CG 4.35Å; V281-Y286 HydrophobicContact CG2-CE2 4.36Å
282	T	81.3	Confident	77.8	Confident	89 Å²	89	107.8 Å²	107.8	55%	0.546	57%	0.567	S	S	.	*			trans	-69	150.3	179.3	50.7	0	0	0	0	111.2	D284 V285	T282-D284 WeakPolarHBondContact CB-OD1 3.38Å; T282-D284 PolarHBondContact O-N 3.28Å; T282-D284 VanDerWaalsContact O-N 3.17Å; T282-D284 PolarHBondContact OG1-OD1 3.14Å; T282-V285 WeakPolarHBondContact O-CB 3.49Å; T282-V285 PolarHBondContact O-N 2.9Å
283	R	78.9	Confident	76	Confident	216 Å²	216	114.7 Å²	114.7	82%	0.815	59%	0.589	S	S	*	*	H	α-helix	trans	-62.9	-29.8	-166.7	-159.8	178.9	-157.7	128.5	3.5	113.4	V285 Y286 L287	R283-V285 VanDerWaalsContact C-N 3.32Å; R283-Y286 PolarHBondContact O-N 3.38Å; R283-L287 VanDerWaalsContact O-CG 3.27Å; R283-L287 WeakPolarHBondContact O-CG 3.16Å; R283-L287 PolarHBondContact O-N 3.44Å; R283-L287 VanDerWaalsContact O-N 3.07Å
284	D	77.2	Confident	74.4	Confident	107 Å²	107	109.8 Å²	109.8	57%	0.572	57%	0.57	S	S	*	*	H	α-helix	trans	-62.8	-30.3	173.3	57	-25.3	0	0	0	113.9	T282 L287	T282-D284 WeakPolarHBondContact CB-OD1 3.38Å; T282-D284 PolarHBondContact O-N 3.28Å; T282-D284 VanDerWaalsContact O-N 3.17Å; T282-D284 PolarHBondContact OG1-OD1 3.14Å; D284-L287 PolarHBondContact O-N 2.83Å; D284-L287 VanDerWaalsContact O-O 3.08Å
285	V	76.9	Confident	72.9	Confident	100 Å²	100	109.7 Å²	109.7	61%	0.606	57%	0.566	S	S	*	*	H	α-helix	trans	-74.4	-30.9	178.5	176.8	0	0	0	0	112.2	V281 T282 R283	V281-V285 HydrophobicContact CG1-CB 3.49Å; V281-V285 VanDerWaalsContact CG1-CB 3.49Å; V281-V285 HydrophobicContact CG1-CG1 3.54Å; V281-V285 HydrophobicContact CG1-CG2 4.28Å; T282-V285 WeakPolarHBondContact O-CB 3.49Å; T282-V285 PolarHBondContact O-N 2.9Å; R283-V285 VanDerWaalsContact C-N 3.32Å
286	Y	68.4	Low	71.5	Confident	178 Å²	178	107.4 Å²	107.4	70%	0.698	56%	0.555	S	S	*	*	H	α-helix	trans	-86.9	-20.7	172.5	-71.3	-57	0	0	0	113.8	V281 R283 A288	V281-Y286 HydrophobicContact CB-CD2 4.22Å; V281-Y286 HydrophobicContact CB-CE2 3.52Å; V281-Y286 HydrophobicContact CG1-CD2 3.8Å; V281-Y286 HydrophobicContact CG1-CE1 4.38Å; V281-Y286 HydrophobicContact CG1-CE2 3.53Å; V281-Y286 HydrophobicContact CG1-CG 4.35Å; V281-Y286 HydrophobicContact CG2-CE2 4.36Å; R283-Y286 PolarHBondContact O-N 3.38Å; Y286-A288 VanDerWaalsContact C-N 3.32Å; Y286-A288 PolarHBondContact O-N 3.36Å
287	L	68.8	Low	70.3	Confident	118 Å²	118	113.6 Å²	113.6	62%	0.618	58%	0.579	S	S	*	*	S	Bend	trans	-70.9	95.1	166.9	-73	169.7	0	0	0	107.5	R283 D284 E289	R283-L287 VanDerWaalsContact O-CG 3.27Å; R283-L287 WeakPolarHBondContact O-CG 3.16Å; R283-L287 PolarHBondContact O-N 3.44Å; R283-L287 VanDerWaalsContact O-N 3.07Å; D284-L287 PolarHBondContact O-N 2.83Å; D284-L287 VanDerWaalsContact O-O 3.08Å; L287-E289 PolarHBondContact O-N 3.43Å
288	A	63.1	Low	69.1	Low	85 Å²	85	108.1 Å²	108.1	70%	0.702	55%	0.552	S	S	*	*			trans	-42	133.8	170.8	0	0	0	0	0	109.9	Y286 S290	Y286-A288 VanDerWaalsContact C-N 3.32Å; Y286-A288 PolarHBondContact O-N 3.36Å; A288-S290 PolarHBondContact O-N 3.4Å; A288-S290 VanDerWaalsContact O-N 3.07Å
289	E	63.6	Low	68.1	Low	181 Å²	181	104.8 Å²	104.8	85%	0.846	54%	0.538	S	S	*	.			trans	-40.1	122	-177.8	-74.6	-170.6	162.2	0	0	109.6	L287 T291	L287-E289 PolarHBondContact O-N 3.43Å; E289-T291 PolarHBondContact O-N 3.19Å
290	S	58.2	Low	67.3	Low	80 Å²	80	107.4 Å²	107.4	56%	0.559	55%	0.549	S	S	*	.			trans	-48.4	109.6	-170.8	-75	0	0	0	0	108.5	A288	A288-S290 PolarHBondContact O-N 3.4Å; A288-S290 VanDerWaalsContact O-N 3.07Å
291	T	59.1	Low	66.6	Low	84 Å²	84	101.3 Å²	101.3	52%	0.515	52%	0.521	S	S	.	.			trans	-45	151.2	-170.5	56.5	0	0	0	0	110.4	E289 R293 S294	E289-T291 PolarHBondContact O-N 3.19Å; T291-R293 CarbonylContact O-C 3.31Å; T291-R293 PolarHBondContact O-N 3.34Å; T291-S294 PolarHBondContact N-OG 3.25Å; T291-S294 PolarHBondContact O-N 3.36Å; T291-S294 PolarHBondContact O-OG 3.38Å; T291-S294 PolarHBondContact OG1-OG 3.13Å
292	P	58.1	Low	66.2	Low	76 Å²	76	109.4 Å²	109.4	49%	0.494	55%	0.545	S	S	.	.	H	α-helix	trans	-50.2	-27.6	-178.1	-30.3	35.8	0	0	0	113.9	S294 Q295 T316	P292-S294 PolarHBondContact O-N 2.93Å; P292-Q295 PolarHBondContact O-N 2.98Å; P292-T316 HydrophobicContact CB-CG2 3.46Å; P292-T316 VanDerWaalsContact CB-CG2 3.46Å
293	R	56.2	Low	66	Low	197 Å²	197	108.2 Å²	108.2	74%	0.743	54%	0.54	S	S	*	.	H	α-helix	trans	-57.8	-34	171.1	-160.8	173.5	-171.7	142.6	1.3	115.2	T291 T296 L299	T291-R293 CarbonylContact O-C 3.31Å; T291-R293 PolarHBondContact O-N 3.34Å; R293-T296 PolarHBondContact O-OG1 2.84Å; R293-L299 HydrophobicContact CG-CD1 4.47Å
294	S	57.6	Low	66	Low	51 Å²	51	103.6 Å²	103.6	36%	0.357	53%	0.53	S	S	.	.	H	α-helix	trans	-86.5	-16.6	174.6	18.9	0	0	0	0	114.1	T291 P292 T296	T291-S294 PolarHBondContact N-OG 3.25Å; T291-S294 PolarHBondContact O-N 3.36Å; T291-S294 PolarHBondContact O-OG 3.38Å; T291-S294 PolarHBondContact OG1-OG 3.13Å; P292-S294 PolarHBondContact O-N 2.93Å; S294-T296 VanDerWaalsContact C-N 3.34Å
295	Q	60.1	Low	65.9	Low	125 Å²	125	103.2 Å²	103.2	58%	0.584	54%	0.536	S	S	*	.	H	α-helix	trans	-72.9	-27.9	173	-67.9	-177.8	-7.6	0	0	112.6	P292 Q297	P292-Q295 PolarHBondContact O-N 2.98Å; Q295-Q297 PolarHBondContact O-N 2.91Å
296	T	62.9	Low	65.6	Low	1 Å²	1	104.8 Å²	104.8	1%	0.006	53%	0.531	C	S	.	.			trans	-63.7	88.1	-179.3	57.8	0	0	0	0	113.3	R293 S294 Y298 L299 E315	R293-T296 PolarHBondContact O-OG1 2.84Å; S294-T296 VanDerWaalsContact C-N 3.34Å; T296-Y298 VanDerWaalsContact CB-CE1 3.45Å; T296-Y298 HydrophobicContact CG2-CE1 3.68Å; T296-Y298 PolarHBondContact O-N 3.24Å; T296-L299 PolarHBondContact O-N 3.37Å; T296-L299 WeakPolarHBondContact OG1-CD1 3.41Å; T296-L299 VanDerWaalsContact OG1-CG 3.25Å; T296-L299 WeakPolarHBondContact OG1-CG 3.35Å; T296-E315 WeakPolarHBondContact CA-OE2 3.43Å; T296-E315 HydrophobicContact CG2-CB 4.4Å; T296-E315 WeakPolarHBondContact CG2-OE2 3.37Å
297	Q	63.5	Low	65.8	Low	152 Å²	152	99.6 Å²	99.6	71%	0.71	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.1	-175.8	-69.5	-165.3	-6	0	0	114.5	Q295 L300 S301	Q295-Q297 PolarHBondContact O-N 2.91Å; Q297-L300 PolarHBondContact O-N 3.38Å; Q297-S301 PolarHBondContact O-N 2.82Å
298	Y	62.9	Low	66	Low	15 Å²	15	101.4 Å²	101.4	6%	0.059	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-25.5	176.4	62.9	-85.1	0	0	0	113.3	T296 L300 S301 V310 P311 G312 N313 L314 E315	T296-Y298 VanDerWaalsContact CB-CE1 3.45Å; T296-Y298 HydrophobicContact CG2-CE1 3.68Å; T296-Y298 PolarHBondContact O-N 3.24Å; Y298-L300 VanDerWaalsContact C-N 3.31Å; Y298-S301 WeakPolarHBondContact O-CB 3.48Å; Y298-S301 PolarHBondContact O-N 2.86Å; Y298-S301 PolarHBondContact O-OG 2.82Å; Y298-V310 HydrophobicContact CD1-CB 4.47Å; Y298-V310 HydrophobicContact CD1-CG1 4.24Å; Y298-V310 HydrophobicContact CD2-CB 3.84Å; Y298-V310 HydrophobicContact CD2-CG1 4.11Å; Y298-V310 HydrophobicContact CE1-CG1 3.85Å; Y298-V310 HydrophobicContact CE2-CB 3.84Å; Y298-V310 HydrophobicContact CE2-CG1 3.67Å; Y298-V310 WeakPolarHBondContact CE2-O 3.36Å; Y298-V310 HydrophobicContact CG-CB 4.16Å; Y298-V310 HydrophobicContact CG-CG1 4.37Å; Y298-P311 WeakPolarHBondContact CE2-O 3.32Å; Y298-P311 PolarHBondContact OH-O 3.43Å; Y298-G312 VanDerWaalsContact OH-C 3.27Å; Y298-G312 WeakPolarHBondContact OH-CA 3.28Å; Y298-N313 PolarHBondContact OH-N 2.95Å; Y298-L314 PolarHBondContact OH-N 3.38Å; Y298-E315 WeakPolarHBondContact CE1-OE1 3.27Å
299	L	64.2	Low	66.4	Low	61 Å²	61	98.9 Å²	98.9	32%	0.319	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.7	169.2	-65.3	-168.3	0	0	0	112.3	R293 T296 S301 L307	R293-L299 HydrophobicContact CG-CD1 4.47Å; T296-L299 PolarHBondContact O-N 3.37Å; T296-L299 WeakPolarHBondContact OG1-CD1 3.41Å; T296-L299 VanDerWaalsContact OG1-CG 3.25Å; T296-L299 WeakPolarHBondContact OG1-CG 3.35Å; L299-S301 VanDerWaalsContact C-N 3.27Å; L299-L307 HydrophobicContact CD2-CD2 4.4Å
300	L	66.9	Low	66.7	Low	129 Å²	129	91.9 Å²	91.9	68%	0.675	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-5.6	171.9	-58	178.3	0	0	0	112.9	Q297 Y298	Q297-L300 PolarHBondContact O-N 3.38Å; Y298-L300 VanDerWaalsContact C-N 3.31Å
301	S	69.8	Low	67.3	Low	20 Å²	20	89.9 Å²	89.9	14%	0.14	45%	0.45	C	S	.	.			trans	-80.7	125.8	-177.6	77.1	0	0	0	0	111.9	Q297 Y298 L299 S303 R306 L307	Q297-S301 PolarHBondContact O-N 2.82Å; Y298-S301 WeakPolarHBondContact O-CB 3.48Å; Y298-S301 PolarHBondContact O-N 2.86Å; Y298-S301 PolarHBondContact O-OG 2.82Å; L299-S301 VanDerWaalsContact C-N 3.27Å; S301-S303 PolarHBondContact O-N 2.91Å; S301-R306 WeakPolarHBondContact OG-CB 3.36Å; S301-R306 WeakPolarHBondContact OG-CG 3.4Å; S301-L307 VanDerWaalsContact O-CD1 3.32Å; S301-L307 WeakPolarHBondContact O-CD1 3.15Å
302	R	73.4	Confident	67.6	Low	233 Å²	233	87.9 Å²	87.9	88%	0.879	45%	0.447	S	S	*	.			trans	-69.8	-11.2	177.6	-70.1	-174.8	176.5	-120.3	3	114.1
303	S	75.8	Confident	67.9	Low	64 Å²	64	87.4 Å²	87.4	45%	0.448	44%	0.44	S	S	.	.			trans	-87.2	120.3	-178.7	71.5	0	0	0	0	111.6	S301 S305 R306 L307	S301-S303 PolarHBondContact O-N 2.91Å; S303-S305 PolarHBondContact O-N 2.93Å; S303-R306 WeakPolarHBondContact O-CA 3.27Å; S303-R306 PolarHBondContact O-N 3.48Å; S303-R306 WeakPolarHBondContact OG-CB 3.45Å; S303-L307 PolarHBondContact O-N 2.87Å
304	I	79.8	Confident	68.3	Low	118 Å²	118	80.2 Å²	80.2	61%	0.605	42%	0.416	S	S	*	.	H	α-helix	trans	-52.5	-42.5	-179.1	-62	171.3	0	0	0	111.3	R306 L307 F308	I304-R306 PolarHBondContact O-N 3.21Å; I304-L307 PolarHBondContact O-N 2.8Å; I304-F308 HydrophobicContact CG2-CD2 3.72Å; I304-F308 HydrophobicContact CG2-CE2 3.61Å; I304-F308 VanDerWaalsContact O-CD2 3.27Å; I304-F308 WeakPolarHBondContact O-CD2 3.44Å; I304-F308 PolarHBondContact O-N 3.1Å
305	S	75	Confident	68.4	Low	100 Å²	100	83.4 Å²	83.4	70%	0.699	43%	0.425	S	S	*	.	H	α-helix	trans	-61.2	-28.4	176.9	-53.9	0	0	0	0	113.7	S303 S309	S303-S305 PolarHBondContact O-N 2.93Å; S305-S309 WeakPolarHBondContact O-CA 3.12Å; S305-S309 VanDerWaalsContact O-CB 3.28Å; S305-S309 WeakPolarHBondContact O-CB 3.46Å; S305-S309 PolarHBondContact O-N 3.45Å; S305-S309 VanDerWaalsContact O-N 3.1Å
306	R	70.4	Confident	68.5	Low	133 Å²	133	79.8 Å²	79.8	50%	0.502	41%	0.411	S	S	.	.	H	α-helix	trans	-89.4	-35.6	179.6	-166.2	170.1	-174.1	149.4	-2.3	112.5	S301 S303 I304 F308 S309	S301-R306 WeakPolarHBondContact OG-CB 3.36Å; S301-R306 WeakPolarHBondContact OG-CG 3.4Å; S303-R306 WeakPolarHBondContact O-CA 3.27Å; S303-R306 PolarHBondContact O-N 3.48Å; S303-R306 WeakPolarHBondContact OG-CB 3.45Å; I304-R306 PolarHBondContact O-N 3.21Å; R306-F308 VanDerWaalsContact C-N 3.28Å; R306-F308 PolarHBondContact O-N 2.97Å; R306-S309 WeakPolarHBondContact CA-OG 3.3Å; R306-S309 WeakPolarHBondContact O-CB 3.47Å; R306-S309 PolarHBondContact O-N 3.02Å; R306-S309 PolarHBondContact O-OG 2.91Å
307	L	72.7	Confident	68.3	Low	69 Å²	69	81.6 Å²	81.6	36%	0.361	43%	0.427	S	S	.	.	H	α-helix	trans	-53.6	-44	165.2	-93.3	152.2	0	0	0	112.1	L299 S301 S303 I304	L299-L307 HydrophobicContact CD2-CD2 4.4Å; S301-L307 VanDerWaalsContact O-CD1 3.32Å; S301-L307 WeakPolarHBondContact O-CD1 3.15Å; S303-L307 PolarHBondContact O-N 2.87Å; I304-L307 PolarHBondContact O-N 2.8Å
308	F	73.4	Confident	68.4	Low	156 Å²	156	81.7 Å²	81.7	68%	0.684	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	6.3	172.7	-59	-58.2	0	0	0	113.8	I304 R306 R330	I304-F308 HydrophobicContact CG2-CD2 3.72Å; I304-F308 HydrophobicContact CG2-CE2 3.61Å; I304-F308 VanDerWaalsContact O-CD2 3.27Å; I304-F308 WeakPolarHBondContact O-CD2 3.44Å; I304-F308 PolarHBondContact O-N 3.1Å; R306-F308 VanDerWaalsContact C-N 3.28Å; R306-F308 PolarHBondContact O-N 2.97Å; F308-R330 PolarHBondContact O-NH1 3.44Å
309	S	71.9	Confident	69	Low	32 Å²	32	83 Å²	83	22%	0.224	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-20.9	-179.5	70.7	0	0	0	0	114.2	S305 R306 W326 R330	S305-S309 WeakPolarHBondContact O-CA 3.12Å; S305-S309 VanDerWaalsContact O-CB 3.28Å; S305-S309 WeakPolarHBondContact O-CB 3.46Å; S305-S309 PolarHBondContact O-N 3.45Å; S305-S309 VanDerWaalsContact O-N 3.1Å; R306-S309 WeakPolarHBondContact CA-OG 3.3Å; R306-S309 WeakPolarHBondContact O-CB 3.47Å; R306-S309 PolarHBondContact O-N 3.02Å; R306-S309 PolarHBondContact O-OG 2.91Å; S309-W326 WeakPolarHBondContact O-CH2 3.21Å; S309-R330 VanDerWaalsContact CA-NH1 3.33Å; S309-R330 PolarHBondContact O-NH1 2.9Å; S309-R330 VanDerWaalsContact O-NH1 3.13Å
310	V	69.2	Low	69.7	Low	34 Å²	34	86.6 Å²	86.6	21%	0.206	46%	0.461	C	S	.	.	S	Bend	trans	-150.6	134.3	-174.4	173.6	0	0	0	0	106.4	Y298 L314	Y298-V310 HydrophobicContact CD1-CB 4.47Å; Y298-V310 HydrophobicContact CD1-CG1 4.24Å; Y298-V310 HydrophobicContact CD2-CB 3.84Å; Y298-V310 HydrophobicContact CD2-CG1 4.11Å; Y298-V310 HydrophobicContact CE1-CG1 3.85Å; Y298-V310 HydrophobicContact CE2-CB 3.84Å; Y298-V310 HydrophobicContact CE2-CG1 3.67Å; Y298-V310 WeakPolarHBondContact CE2-O 3.36Å; Y298-V310 HydrophobicContact CG-CB 4.16Å; Y298-V310 HydrophobicContact CG-CG1 4.37Å; V310-L314 HydrophobicContact CG1-CB 3.35Å; V310-L314 HydrophobicContact CG1-CD2 3.78Å; V310-L314 HydrophobicContact CG1-CG 4.08Å
311	P	69.7	Low	70.4	Confident	37 Å²	37	89.2 Å²	89.2	24%	0.24	46%	0.462	C	S	.	.			trans	-65.1	143.4	176.8	28.6	-32.4	0	0	0	109	Y298 N313 L314 W326	Y298-P311 WeakPolarHBondContact CE2-O 3.32Å; Y298-P311 PolarHBondContact OH-O 3.43Å; P311-N313 PolarHBondContact O-N 2.87Å; P311-L314 HydrophobicContact CG-CB 4.01Å; P311-L314 HydrophobicContact CG-CD1 3.69Å; P311-L314 HydrophobicContact CG-CG 4.48Å; P311-L314 PolarHBondContact O-N 3.21Å; P311-W326 HydrophobicContact CG-CD2 3.95Å; P311-W326 HydrophobicContact CG-CE3 4.26Å; P311-W326 HydrophobicContact CG-CG 4.2Å
312	G	65.7	Low	70.9	Confident	43 Å²	43	94 Å²	94	44%	0.443	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	10	-177	0	0	0	0	0	117.6	Y298	Y298-G312 VanDerWaalsContact OH-C 3.27Å; Y298-G312 WeakPolarHBondContact OH-CA 3.28Å
313	N	64.3	Low	71.2	Confident	66 Å²	66	84 Å²	84	35%	0.353	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.3	12.2	179.2	-159.1	-100.6	0	0	0	112.7	Y298 P311 E315 T316 A317 L318	Y298-N313 PolarHBondContact OH-N 2.95Å; P311-N313 PolarHBondContact O-N 2.87Å; N313-E315 VanDerWaalsContact C-N 3.32Å; N313-E315 PolarHBondContact O-N 3.41Å; N313-T316 VanDerWaalsContact ND2-CB 3.3Å; N313-T316 WeakPolarHBondContact ND2-CB 3.32Å; N313-T316 PolarHBondContact ND2-OG1 2.98Å; N313-T316 CarbonylContact O-C 3.32Å; N313-T316 VanDerWaalsContact O-C 3.32Å; N313-T316 PolarHBondContact O-N 2.93Å; N313-T316 VanDerWaalsContact O-N 3.13Å; N313-T316 PolarHBondContact OD1-O 2.79Å; N313-T316 PolarHBondContact OD1-OG1 3.33Å; N313-A317 VanDerWaalsContact O-CA 3.22Å; N313-A317 WeakPolarHBondContact O-CA 3.21Å; N313-A317 PolarHBondContact O-N 3.3Å; N313-L318 PolarHBondContact OD1-N 3.11Å
314	L	65.1	Low	71.6	Confident	45 Å²	45	85.6 Å²	85.6	24%	0.236	45%	0.452	C	S	.	.	S	Bend	trans	-63.4	-36.6	-175.3	-160	88.5	0	0	0	112.6	Y298 V310 P311 A317 C323	Y298-L314 PolarHBondContact OH-N 3.38Å; V310-L314 HydrophobicContact CG1-CB 3.35Å; V310-L314 HydrophobicContact CG1-CD2 3.78Å; V310-L314 HydrophobicContact CG1-CG 4.08Å; P311-L314 HydrophobicContact CG-CB 4.01Å; P311-L314 HydrophobicContact CG-CD1 3.69Å; P311-L314 HydrophobicContact CG-CG 4.48Å; P311-L314 PolarHBondContact O-N 3.21Å; L314-A317 VanDerWaalsContact O-CB 3.28Å; L314-A317 WeakPolarHBondContact O-CB 3.46Å; L314-C323 HydrophobicContact CD1-CB 3.84Å
315	E	59.9	Low	71.8	Confident	119 Å²	119	84.8 Å²	84.8	56%	0.556	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-34.1	174.1	-69.2	164.9	-160.1	0	0	111.6	T296 Y298 N313 A317	T296-E315 WeakPolarHBondContact CA-OE2 3.43Å; T296-E315 HydrophobicContact CG2-CB 4.4Å; T296-E315 WeakPolarHBondContact CG2-OE2 3.37Å; Y298-E315 WeakPolarHBondContact CE1-OE1 3.27Å; N313-E315 VanDerWaalsContact C-N 3.32Å; N313-E315 PolarHBondContact O-N 3.41Å; E315-A317 PolarHBondContact O-N 2.72Å
316	T	61.6	Low	72.2	Confident	48 Å²	48	83.8 Å²	83.8	29%	0.294	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	7.7	177.4	164.4	0	0	0	0	113	P292 N313 L318	P292-T316 HydrophobicContact CB-CG2 3.46Å; P292-T316 VanDerWaalsContact CB-CG2 3.46Å; N313-T316 VanDerWaalsContact ND2-CB 3.3Å; N313-T316 WeakPolarHBondContact ND2-CB 3.32Å; N313-T316 PolarHBondContact ND2-OG1 2.98Å; N313-T316 CarbonylContact O-C 3.32Å; N313-T316 VanDerWaalsContact O-C 3.32Å; N313-T316 PolarHBondContact O-N 2.93Å; N313-T316 VanDerWaalsContact O-N 3.13Å; N313-T316 PolarHBondContact OD1-O 2.79Å; N313-T316 PolarHBondContact OD1-OG1 3.33Å; T316-L318 PolarHBondContact O-N 2.9Å
317	A	59.9	Low	72.6	Confident	39 Å²	39	79 Å²	79	32%	0.322	42%	0.415	S	S	.	.			trans	-44.1	92.1	-155.9	0	0	0	0	0	115	N313 L314 E315 S319 C323	N313-A317 VanDerWaalsContact O-CA 3.22Å; N313-A317 WeakPolarHBondContact O-CA 3.21Å; N313-A317 PolarHBondContact O-N 3.3Å; L314-A317 VanDerWaalsContact O-CB 3.28Å; L314-A317 WeakPolarHBondContact O-CB 3.46Å; E315-A317 PolarHBondContact O-N 2.72Å; A317-S319 PolarHBondContact O-N 2.83Å; A317-C323 WeakPolarHBondContact CB-SG 3.28Å
318	L	64	Low	73	Confident	155 Å²	155	82.5 Å²	82.5	81%	0.812	43%	0.425	S	S	*	.	S	Bend	trans	-62.2	-10.1	177.6	-61.9	175.2	0	0	0	112.8	N313 T316	N313-L318 PolarHBondContact OD1-N 3.11Å; T316-L318 PolarHBondContact O-N 2.9Å
319	S	76.2	Confident	73.3	Confident	41 Å²	41	79.8 Å²	79.8	29%	0.287	41%	0.414	S	S	.	.			trans	-154.3	117.9	172	170.4	0	0	0	0	111.2	A317 R321 L322 C323	A317-S319 PolarHBondContact O-N 2.83Å; S319-R321 VanDerWaalsContact C-N 3.25Å; S319-R321 PolarHBondContact O-N 3.1Å; S319-R321 PolarHBondContact OG-N 2.95Å; S319-L322 PolarHBondContact O-N 3.09Å; S319-L322 PolarHBondContact OG-N 2.94Å; S319-C323 PolarHBondContact O-N 3.29Å; S319-C323 PolarHBondContact O-SG 2.92Å
320	L	78.3	Confident	73.5	Confident	138 Å²	138	81.9 Å²	81.9	72%	0.723	42%	0.417	S	S	*	.	H	α-helix	trans	-53.5	-42.2	167.4	-92.2	156.1	0	0	0	111.7	L322 C323 E324	L320-L322 VanDerWaalsContact C-N 3.35Å; L320-L322 PolarHBondContact O-N 2.57Å; L320-C323 WeakPolarHBondContact O-CB 3.42Å; L320-C323 PolarHBondContact O-N 3.47Å; L320-C323 VanDerWaalsContact O-N 3.11Å; L320-E324 WeakPolarHBondContact O-CG 3.48Å; L320-E324 PolarHBondContact O-N 2.98Å
321	R	82.4	Confident	73.7	Confident	183 Å²	183	86.4 Å²	86.4	69%	0.691	43%	0.43	S	S	*	.	H	α-helix	trans	-62.5	-38.1	179.6	-72.1	-53.8	-160.1	-175.1	2.1	112.9	S319 C323 E324 L325	S319-R321 VanDerWaalsContact C-N 3.25Å; S319-R321 PolarHBondContact O-N 3.1Å; S319-R321 PolarHBondContact OG-N 2.95Å; R321-C323 VanDerWaalsContact C-N 3.34Å; R321-E324 WeakPolarHBondContact CD-OE2 3.34Å; R321-E324 IonicContact CZ-OE2 3.85Å; R321-E324 IonicContact NE-OE2 3.86Å; R321-E324 IonicContact NH1-OE1 3.84Å; R321-E324 IonicContact NH1-OE2 3.31Å; R321-E324 PolarHBondContact NH1-OE2 3.09Å; R321-L325 VanDerWaalsContact O-CB 3.3Å; R321-L325 WeakPolarHBondContact O-CB 3.47Å; R321-L325 PolarHBondContact O-N 2.75Å
322	L	80.9	Confident	73.6	Confident	121 Å²	121	88.3 Å²	88.3	63%	0.634	44%	0.438	S	S	*	.	H	α-helix	trans	-66.6	-37.4	174.8	-90.2	160	0	0	0	111.6	S319 L320 W326	S319-L322 PolarHBondContact O-N 3.09Å; S319-L322 PolarHBondContact OG-N 2.94Å; L320-L322 VanDerWaalsContact C-N 3.35Å; L320-L322 PolarHBondContact O-N 2.57Å; L322-W326 VanDerWaalsContact O-CB 3.27Å; L322-W326 WeakPolarHBondContact O-CB 3.42Å; L322-W326 PolarHBondContact O-N 2.96Å
323	C	80.1	Confident	73.7	Confident	23 Å²	23	90.1 Å²	90.1	16%	0.155	44%	0.443	C	S	.	.	H	α-helix	trans	-68.3	-43	176.2	-62.6	0	0	0	0	112	L314 A317 S319 L320 R321 W326 C327	L314-C323 HydrophobicContact CD1-CB 3.84Å; A317-C323 WeakPolarHBondContact CB-SG 3.28Å; S319-C323 PolarHBondContact O-N 3.29Å; S319-C323 PolarHBondContact O-SG 2.92Å; L320-C323 WeakPolarHBondContact O-CB 3.42Å; L320-C323 PolarHBondContact O-N 3.47Å; L320-C323 VanDerWaalsContact O-N 3.11Å; R321-C323 VanDerWaalsContact C-N 3.34Å; C323-W326 PolarHBondContact O-N 3.46Å; C323-C327 WeakPolarHBondContact O-CB 3.25Å; C323-C327 PolarHBondContact O-N 3.39Å; C323-C327 PolarHBondContact O-SG 3.21Å
324	E	82.7	Confident	74.1	Confident	98 Å²	98	91.1 Å²	91.1	46%	0.458	45%	0.446	S	S	.	.	H	α-helix	trans	-59	-48.2	172.6	-72.6	-179.4	153.3	0	0	111.8	L320 R321 C327 Y328	L320-E324 WeakPolarHBondContact O-CG 3.48Å; L320-E324 PolarHBondContact O-N 2.98Å; R321-E324 WeakPolarHBondContact CD-OE2 3.34Å; R321-E324 IonicContact CZ-OE2 3.85Å; R321-E324 IonicContact NE-OE2 3.86Å; R321-E324 IonicContact NH1-OE1 3.84Å; R321-E324 IonicContact NH1-OE2 3.31Å; R321-E324 PolarHBondContact NH1-OE2 3.09Å; E324-C327 PolarHBondContact O-N 3.21Å; E324-Y328 WeakPolarHBondContact O-CB 3.22Å; E324-Y328 PolarHBondContact O-N 3.36Å
325	L	84.6	Confident	74.3	Confident	101 Å²	101	95.8 Å²	95.8	53%	0.529	46%	0.464	S	S	.	.	H	α-helix	trans	-63.8	-43.7	-179	-157.5	104.2	0	0	0	111.2	R321 Y328 H329	R321-L325 VanDerWaalsContact O-CB 3.3Å; R321-L325 WeakPolarHBondContact O-CB 3.47Å; R321-L325 PolarHBondContact O-N 2.75Å; L325-Y328 WeakPolarHBondContact O-CB 3.49Å; L325-Y328 PolarHBondContact O-N 2.96Å; L325-H329 PolarHBondContact O-CD2 3.21Å; L325-H329 PolarHBondContact O-N 2.83Å
326	W	82.9	Confident	74.7	Confident	79 Å²	79	93.7 Å²	93.7	30%	0.299	46%	0.462	S	S	.	.	H	α-helix	trans	-63	-43.9	174.9	177	94.1	0	0	0	111.6	S309 P311 L322 C323 Y328 H329 R330	S309-W326 WeakPolarHBondContact O-CH2 3.21Å; P311-W326 HydrophobicContact CG-CD2 3.95Å; P311-W326 HydrophobicContact CG-CE3 4.26Å; P311-W326 HydrophobicContact CG-CG 4.2Å; L322-W326 VanDerWaalsContact O-CB 3.27Å; L322-W326 WeakPolarHBondContact O-CB 3.42Å; L322-W326 PolarHBondContact O-N 2.96Å; C323-W326 PolarHBondContact O-N 3.46Å; W326-Y328 VanDerWaalsContact C-N 3.3Å; W326-Y328 PolarHBondContact O-N 3.07Å; W326-H329 PolarHBondContact O-N 2.88Å; W326-R330 HydrophobicContact CH2-CB 4.45Å; W326-R330 HydrophobicContact CH2-CG 4.34Å; W326-R330 HydrophobicContact CZ2-CG 4.42Å; W326-R330 VanDerWaalsContact CZ2-NH1 3.32Å; W326-R330 WeakPolarHBondContact O-CB 3.38Å; W326-R330 PolarHBondContact O-N 3.37Å
327	C	78.4	Confident	75.1	Confident	31 Å²	31	95.9 Å²	95.9	21%	0.209	47%	0.472	C	S	.	.	H	α-helix	trans	-60.4	-40.4	175.3	-73.3	0	0	0	0	111.9	C323 E324 R331	C323-C327 WeakPolarHBondContact O-CB 3.25Å; C323-C327 PolarHBondContact O-N 3.39Å; C323-C327 PolarHBondContact O-SG 3.21Å; E324-C327 PolarHBondContact O-N 3.21Å; C327-R331 VanDerWaalsContact O-CG 3.32Å; C327-R331 WeakPolarHBondContact O-CG 3.29Å; C327-R331 PolarHBondContact O-N 3.04Å
328	Y	82	Confident	75.6	Confident	143 Å²	143	100.6 Å²	100.6	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-63.9	-51.7	177.1	177.9	-102.8	0	0	0	111.7	E324 L325 W326 R330 R331 L332	E324-Y328 WeakPolarHBondContact O-CB 3.22Å; E324-Y328 PolarHBondContact O-N 3.36Å; L325-Y328 WeakPolarHBondContact O-CB 3.49Å; L325-Y328 PolarHBondContact O-N 2.96Å; W326-Y328 VanDerWaalsContact C-N 3.3Å; W326-Y328 PolarHBondContact O-N 3.07Å; Y328-R330 PolarHBondContact O-N 3.35Å; Y328-R331 PolarHBondContact O-N 3.37Å; Y328-L332 HydrophobicContact CD1-CD1 4.01Å; Y328-L332 HydrophobicContact CE1-CD1 3.52Å; Y328-L332 HydrophobicContact CE1-CG 4.44Å; Y328-L332 PolarHBondContact O-N 2.9Å; Y328-L332 VanDerWaalsContact O-N 3.15Å
329	H	78.9	Confident	75.9	Confident	99 Å²	99	100.5 Å²	100.5	46%	0.458	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-36.9	179.2	-76.5	-67.3	0	0	0	112.9	L325 W326 L332 C333	L325-H329 PolarHBondContact O-CD2 3.21Å; L325-H329 PolarHBondContact O-N 2.83Å; W326-H329 PolarHBondContact O-N 2.88Å; H329-L332 WeakPolarHBondContact O-CB 3.42Å; H329-L332 PolarHBondContact O-N 2.92Å; H329-C333 PolarHBondContact O-N 3.39Å; H329-C333 VanDerWaalsContact O-N 3.15Å
330	R	77.3	Confident	75.4	Confident	76 Å²	76	106.5 Å²	106.5	29%	0.287	50%	0.497	S	S	.	.	H	α-helix	trans	-59	-48.8	174	-168.9	-154.2	-178.4	74.8	9.1	111.9	F308 S309 W326 Y328 L332 C333 E334	F308-R330 PolarHBondContact O-NH1 3.44Å; S309-R330 VanDerWaalsContact CA-NH1 3.33Å; S309-R330 PolarHBondContact O-NH1 2.9Å; S309-R330 VanDerWaalsContact O-NH1 3.13Å; W326-R330 HydrophobicContact CH2-CB 4.45Å; W326-R330 HydrophobicContact CH2-CG 4.34Å; W326-R330 HydrophobicContact CZ2-CG 4.42Å; W326-R330 VanDerWaalsContact CZ2-NH1 3.32Å; W326-R330 WeakPolarHBondContact O-CB 3.38Å; W326-R330 PolarHBondContact O-N 3.37Å; Y328-R330 PolarHBondContact O-N 3.35Å; R330-L332 PolarHBondContact O-N 3.08Å; R330-C333 WeakPolarHBondContact O-CB 3.19Å; R330-C333 PolarHBondContact O-N 3.24Å; R330-C333 VanDerWaalsContact O-N 3.08Å; R330-E334 IonicContact CZ-OE1 3.63Å; R330-E334 IonicContact NE-OE1 3.79Å; R330-E334 PolarHBondContact NE-OE1 3.26Å; R330-E334 IonicContact NH2-OE1 2.71Å; R330-E334 PolarHBondContact O-N 3.3Å
331	R	72.8	Confident	75	Confident	129 Å²	129	106.6 Å²	106.6	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-62	-30.2	178.1	-73	173.3	-179.6	177.3	2.2	112.6	C327 Y328 K335	C327-R331 VanDerWaalsContact O-CG 3.32Å; C327-R331 WeakPolarHBondContact O-CG 3.29Å; C327-R331 PolarHBondContact O-N 3.04Å; Y328-R331 PolarHBondContact O-N 3.37Å; R331-K335 WeakPolarHBondContact O-CB 3.44Å; R331-K335 VanDerWaalsContact O-CG 3.3Å; R331-K335 WeakPolarHBondContact O-CG 3.3Å; R331-K335 PolarHBondContact O-N 2.95Å; R331-K335 VanDerWaalsContact O-N 3.12Å
332	L	66.5	Low	74	Confident	77 Å²	77	105.8 Å²	105.8	40%	0.403	49%	0.493	S	S	.	.	H	α-helix	trans	-68.2	-40.5	173	-70.9	173.7	0	0	0	112	Y328 H329 R330 K335 S336	Y328-L332 HydrophobicContact CD1-CD1 4.01Å; Y328-L332 HydrophobicContact CE1-CD1 3.52Å; Y328-L332 HydrophobicContact CE1-CG 4.44Å; Y328-L332 PolarHBondContact O-N 2.9Å; Y328-L332 VanDerWaalsContact O-N 3.15Å; H329-L332 WeakPolarHBondContact O-CB 3.42Å; H329-L332 PolarHBondContact O-N 2.92Å; R330-L332 PolarHBondContact O-N 3.08Å; L332-K335 PolarHBondContact O-N 3.42Å; L332-S336 WeakPolarHBondContact O-CB 3.29Å; L332-S336 PolarHBondContact O-N 3.02Å; L332-S336 PolarHBondContact O-OG 3.26Å
333	C	68.3	Low	73.1	Confident	81 Å²	81	104.4 Å²	104.4	55%	0.547	49%	0.486	S	S	.	.	H	α-helix	trans	-65.5	-40.2	174.9	-66.8	0	0	0	0	112.7	H329 R330 S336 L337	H329-C333 PolarHBondContact O-N 3.39Å; H329-C333 VanDerWaalsContact O-N 3.15Å; R330-C333 WeakPolarHBondContact O-CB 3.19Å; R330-C333 PolarHBondContact O-N 3.24Å; R330-C333 VanDerWaalsContact O-N 3.08Å; C333-S336 PolarHBondContact O-N 3.44Å; C333-S336 PolarHBondContact O-OG 3.47Å; C333-S336 VanDerWaalsContact O-OG 3.06Å; C333-L337 WeakPolarHBondContact O-CB 3.25Å; C333-L337 PolarHBondContact O-N 2.99Å
334	E	73.2	Confident	72.4	Confident	88 Å²	88	107.7 Å²	107.7	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-42.6	176.3	-71.6	168.5	-178.2	0	0	111.4	R330 L337 Q338	R330-E334 IonicContact CZ-OE1 3.63Å; R330-E334 IonicContact NE-OE1 3.79Å; R330-E334 PolarHBondContact NE-OE1 3.26Å; R330-E334 IonicContact NH2-OE1 2.71Å; R330-E334 PolarHBondContact O-N 3.3Å; E334-L337 PolarHBondContact O-N 3.47Å; E334-Q338 WeakPolarHBondContact O-CG 3.45Å; E334-Q338 PolarHBondContact O-N 2.91Å
335	K	70.1	Confident	71.2	Confident	142 Å²	142	109.9 Å²	109.9	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-65.3	-39.9	174.8	-73.6	176.6	179.5	-173.8	0	113.1	R331 L332 K339	R331-K335 WeakPolarHBondContact O-CB 3.44Å; R331-K335 VanDerWaalsContact O-CG 3.3Å; R331-K335 WeakPolarHBondContact O-CG 3.3Å; R331-K335 PolarHBondContact O-N 2.95Å; R331-K335 VanDerWaalsContact O-N 3.12Å; L332-K335 PolarHBondContact O-N 3.42Å; K335-K339 WeakPolarHBondContact O-CB 3.26Å; K335-K339 PolarHBondContact O-N 3.34Å
336	S	67.1	Low	69.8	Low	75 Å²	75	108.5 Å²	108.5	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-70.8	-35.9	178.5	69.7	0	0	0	0	112	L332 C333 K339 R340	L332-S336 WeakPolarHBondContact O-CB 3.29Å; L332-S336 PolarHBondContact O-N 3.02Å; L332-S336 PolarHBondContact O-OG 3.26Å; C333-S336 PolarHBondContact O-N 3.44Å; C333-S336 PolarHBondContact O-OG 3.47Å; C333-S336 VanDerWaalsContact O-OG 3.06Å; S336-K339 PolarHBondContact O-N 3.3Å; S336-R340 PolarHBondContact O-N 2.91Å
337	L	70.7	Confident	68.3	Low	95 Å²	95	109 Å²	109	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-67.8	-40.9	174.1	-164	76.3	0	0	0	112	C333 E334 R340 K341	C333-L337 WeakPolarHBondContact O-CB 3.25Å; C333-L337 PolarHBondContact O-N 2.99Å; E334-L337 PolarHBondContact O-N 3.47Å; L337-R340 PolarHBondContact O-N 3.32Å; L337-K341 PolarHBondContact O-N 2.92Å
338	Q	71	Confident	66.9	Low	137 Å²	137	113.7 Å²	113.7	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-61.6	-43.8	172.6	-76.2	177.8	0	0	0	111.6	E334 R340 K341 F342	E334-Q338 WeakPolarHBondContact O-CG 3.45Å; E334-Q338 PolarHBondContact O-N 2.91Å; Q338-R340 VanDerWaalsContact C-N 3.32Å; Q338-R340 PolarHBondContact O-N 2.92Å; Q338-K341 PolarHBondContact O-N 2.86Å; Q338-F342 PolarHBondContact O-N 3.47Å
339	K	69.8	Low	65.2	Low	153 Å²	153	113.3 Å²	113.3	67%	0.665	56%	0.555	S	S	*	*	H	α-helix	trans	-62.9	-37	176.3	-167.5	172.8	-176.3	177.9	0	112.3	K335 S336 N343	K335-K339 WeakPolarHBondContact O-CB 3.26Å; K335-K339 PolarHBondContact O-N 3.34Å; S336-K339 PolarHBondContact O-N 3.3Å; K339-N343 PolarHBondContact O-N 3.08Å; K339-N343 PolarHBondContact O-OD1 3.46Å
340	R	66.1	Low	63.8	Low	168 Å²	168	115.3 Å²	115.3	63%	0.634	57%	0.569	S	S	*	*	H	α-helix	trans	-67.7	-48	173.8	-168.3	178	-69.5	165.5	-2.6	111.6	S336 L337 Q338 F342 N343 D344	S336-R340 PolarHBondContact O-N 2.91Å; L337-R340 PolarHBondContact O-N 3.32Å; Q338-R340 VanDerWaalsContact C-N 3.32Å; Q338-R340 PolarHBondContact O-N 2.92Å; R340-F342 VanDerWaalsContact C-N 3.28Å; R340-F342 PolarHBondContact O-N 2.99Å; R340-N343 PolarHBondContact O-N 2.94Å; R340-N343 VanDerWaalsContact O-N 3.11Å; R340-D344 VanDerWaalsContact O-CG 3.29Å; R340-D344 PolarHBondContact O-N 2.9Å
341	K	69.6	Low	62.2	Low	139 Å²	139	118.4 Å²	118.4	60%	0.604	59%	0.59	S	S	*	*	H	α-helix	trans	-57.4	-37.2	175.9	-77.9	-173.1	174.2	-172.8	0	113.3	L337 Q338 M345	L337-K341 PolarHBondContact O-N 2.92Å; Q338-K341 PolarHBondContact O-N 2.86Å; K341-M345 WeakPolarHBondContact O-CB 3.15Å; K341-M345 PolarHBondContact O-N 2.9Å; K341-M345 VanDerWaalsContact O-N 3.09Å
342	F	60.8	Low	60.8	Low	166 Å²	166	119.6 Å²	119.6	73%	0.728	60%	0.604	S	S	*	*	H	α-helix	trans	-69.4	-38.5	177.5	-146.8	-84.8	0	0	0	112	Q338 R340 S346	Q338-F342 PolarHBondContact O-N 3.47Å; R340-F342 VanDerWaalsContact C-N 3.28Å; R340-F342 PolarHBondContact O-N 2.99Å; F342-S346 WeakPolarHBondContact O-CB 3.43Å; F342-S346 PolarHBondContact O-N 3.47Å; F342-S346 VanDerWaalsContact O-N 3.16Å
343	N	61.4	Low	59.8	Low	93 Å²	93	124.5 Å²	124.5	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-66.5	-46.6	174.2	-72.3	6.6	0	0	0	111.7	K339 R340 M345 S346 V347	K339-N343 PolarHBondContact O-N 3.08Å; K339-N343 PolarHBondContact O-OD1 3.46Å; R340-N343 PolarHBondContact O-N 2.94Å; R340-N343 VanDerWaalsContact O-N 3.11Å; N343-M345 VanDerWaalsContact C-N 3.29Å; N343-M345 PolarHBondContact O-N 3.25Å; N343-S346 PolarHBondContact O-N 2.98Å; N343-S346 VanDerWaalsContact O-N 3.1Å; N343-V347 WeakPolarHBondContact O-CG2 3.36Å; N343-V347 PolarHBondContact O-N 3.47Å; N343-V347 VanDerWaalsContact O-N 3.07Å
344	D	65.4	Low	58.5	Low	91 Å²	91	128 Å²	128	49%	0.487	64%	0.644	S	S	.	*	H	α-helix	trans	-65.7	-32	-178.3	-61.8	-22.8	0	0	0	112.1	R340 N348	R340-D344 VanDerWaalsContact O-CG 3.29Å; R340-D344 PolarHBondContact O-N 2.9Å; D344-N348 PolarHBondContact O-ND2 3.48Å; D344-N348 VanDerWaalsContact O-ND2 3.07Å
345	M	58.5	Low	56.9	Low	145 Å²	145	133.3 Å²	133.3	71%	0.714	67%	0.666	S	S	*	*	H	α-helix	trans	-74.1	-30.1	173.5	-150.4	83.8	76.9	0	0	112.7	K341 N343	K341-M345 WeakPolarHBondContact O-CB 3.15Å; K341-M345 PolarHBondContact O-N 2.9Å; K341-M345 VanDerWaalsContact O-N 3.09Å; N343-M345 VanDerWaalsContact C-N 3.29Å; N343-M345 PolarHBondContact O-N 3.25Å
346	S	54	Low	55.3	Low	72 Å²	72	138 Å²	138	50%	0.503	68%	0.68	S	S	.	*	H	α-helix	trans	-78.9	-31.2	-179.3	-170.3	0	0	0	0	113.3	F342 N343	F342-S346 WeakPolarHBondContact O-CB 3.43Å; F342-S346 PolarHBondContact O-N 3.47Å; F342-S346 VanDerWaalsContact O-N 3.16Å; N343-S346 PolarHBondContact O-N 2.98Å; N343-S346 VanDerWaalsContact O-N 3.1Å
347	V	53.3	Low	53.9	Low	88 Å²	88	139.4 Å²	139.4	53%	0.533	69%	0.687	S	S	.	*	H	α-helix	trans	-78.4	-23.3	-175.9	172.3	0	0	0	0	112.6	N343 N349	N343-V347 WeakPolarHBondContact O-CG2 3.36Å; N343-V347 PolarHBondContact O-N 3.47Å; N343-V347 VanDerWaalsContact O-N 3.07Å; V347-N349 VanDerWaalsContact C-N 3.32Å; V347-N349 PolarHBondContact O-N 3Å
348	N	49.1	Very low	52.3	Low	131 Å²	131	139.2 Å²	139.2	70%	0.701	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-0.9	-173.4	-77.1	-29.7	0	0	0	115.7	D344	D344-N348 PolarHBondContact O-ND2 3.48Å; D344-N348 VanDerWaalsContact O-ND2 3.07Å
349	N	44.7	Very low	50.9	Low	135 Å²	135	142.8 Å²	142.8	72%	0.722	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-16.7	179.8	-71	-26.6	0	0	0	114.5	V347	V347-N349 VanDerWaalsContact C-N 3.32Å; V347-N349 PolarHBondContact O-N 3Å
350	D	49.4	Very low	49.5	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	72%	0.722	S	S	*	*	S	Bend	trans	-107.5	9.6	-167.1	-69.4	-22.5	0	0	0	114.9
351	I	44.4	Very low	48.2	Very low	140 Å²	140	138.8 Å²	138.8	72%	0.718	73%	0.73	S	S	*	*			trans	-120.2	70.1	-174.9	-46.3	-177.4	0	0	0	112.1
352	I	44	Very low	46.6	Very low	154 Å²	154	137 Å²	137	79%	0.79	74%	0.735	S	S	*	*			trans	-128.5	137.5	156.5	-52.1	-178.2	0	0	0	107.7
353	Q	43.9	Very low	45.7	Very low	181 Å²	181	136.5 Å²	136.5	85%	0.846	74%	0.738	S	S	*	*			trans	81.2	82	178.9	-45	-170.8	49.7	0	0	117.9
354	T	41.2	Very low	44.6	Very low	153 Å²	153	140.4 Å²	140.4	94%	0.939	75%	0.751	S	S	*	*			trans	-152.3	153.5	130.4	33.5	0	0	0	0	110.6
355	K	40.3	Very low	43.4	Very low	201 Å²	201	144.6 Å²	144.6	87%	0.874	77%	0.77	S	S	*	*			trans	-97.5	132.5	-168	-65.8	169.4	176.4	169.6	0	112.6
356	R	37.4	Very low	42.6	Very low	239 Å²	239	143.9 Å²	143.9	90%	0.902	77%	0.769	S	S	*	*			trans	48.2	163.9	142.8	-90.6	-170.4	174.6	159.6	-0.3	120.7
357	P	37.9	Very low	41.9	Very low	105 Å²	105	144.4 Å²	144.4	68%	0.682	78%	0.777	S	S	*	*			cis	-134.1	158.6	-25.3	35.6	-18.3	0	0	0	115.2
358	A	36.6	Very low	41.6	Very low	91 Å²	91	147.8 Å²	147.8	75%	0.752	79%	0.791	S	S	*	*			trans	34.6	107.6	145.5	0	0	0	0	0	121.1
359	K	41.6	Very low	41.3	Very low	212 Å²	212	145.8 Å²	145.8	92%	0.922	78%	0.783	S	S	*	*				170.5	97.5	118.2	-93.1	168.7	-176.7	179.7	0	111.3
360	S	40.1	Very low	41.5	Very low	124 Å²	124	148 Å²	148	87%	0.867	79%	0.789	S	S	*	*			trans	-155.6	144.1	158.5	43.5	0	0	0	0	110.1
361	S	39	Very low	41.6	Very low	114 Å²	114	147.7 Å²	147.7	80%	0.797	78%	0.783	S	S	*	*			trans	-63.6	140.6	-170	-172.1	0	0	0	0	112.6	I363	S361-I363 PolarHBondContact O-N 2.93Å
362	S	34.8	Very low	42.1	Very low	101 Å²	101	147.2 Å²	147.2	71%	0.706	78%	0.782	S	S	*	*			trans	-72	97.2	175.8	57.7	0	0	0	0	111.1	K364	S362-K364 VanDerWaalsContact C-N 3.27Å; S362-K364 PolarHBondContact O-N 2.96Å
363	I	42.9	Very low	42.3	Very low	156 Å²	156	148.5 Å²	148.5	80%	0.8	79%	0.785	S	S	*	*			trans	-73.2	91.7	156.6	-60.2	176.6	0	0	0	106.4	S361 M365	S361-I363 PolarHBondContact O-N 2.93Å; I363-M365 PolarHBondContact O-N 3.22Å
364	K	39.2	Very low	42.5	Very low	174 Å²	174	142.9 Å²	142.9	76%	0.757	77%	0.765	S	S	*	*			trans	-65	100.3	162.6	-88	-173.5	172.3	-176.3	0	107.4	S362 N366	S362-K364 VanDerWaalsContact C-N 3.27Å; S362-K364 PolarHBondContact O-N 2.96Å; K364-N366 VanDerWaalsContact C-N 3.31Å; K364-N366 PolarHBondContact O-N 2.81Å; K364-N366 VanDerWaalsContact O-N 3.1Å
365	M	39.9	Very low	43.3	Very low	180 Å²	180	137.9 Å²	137.9	89%	0.887	74%	0.737	S	S	*	*			trans	-64.7	104.4	147.6	-86.5	-163	173.8	0	0	106.2	I363 A367	I363-M365 PolarHBondContact O-N 3.22Å; M365-A367 PolarHBondContact O-N 3.45Å; M365-A367 VanDerWaalsContact O-N 3.12Å
366	N	40.9	Very low	43.9	Very low	130 Å²	130	132 Å²	132	70%	0.695	72%	0.718	S	S	*	*			trans	-65.4	111.5	163.8	-68.8	-16.4	0	0	0	106.2	K364 I368	K364-N366 VanDerWaalsContact C-N 3.31Å; K364-N366 PolarHBondContact O-N 2.81Å; K364-N366 VanDerWaalsContact O-N 3.1Å; N366-I368 PolarHBondContact O-N 2.96Å
367	A	40.3	Very low	44.6	Very low	82 Å²	82	125.9 Å²	125.9	68%	0.678	70%	0.699	S	S	*	*			trans	-55.4	121.6	160.5	0	0	0	0	0	106.8	M365 T369	M365-A367 PolarHBondContact O-N 3.45Å; M365-A367 VanDerWaalsContact O-N 3.12Å; A367-T369 PolarHBondContact O-N 2.79Å
368	I	45.2	Very low	45.5	Very low	159 Å²	159	125.9 Å²	125.9	82%	0.815	69%	0.693	S	S	*	*			trans	-74.2	94.6	168.3	-60.9	174.9	0	0	0	105.1	N366 E370	N366-I368 PolarHBondContact O-N 2.96Å; I368-E370 PolarHBondContact O-N 3.09Å
369	T	44.5	Very low	46.4	Very low	89 Å²	89	128.6 Å²	128.6	55%	0.546	69%	0.69	S	S	.	*			trans	-67.8	106.2	172	47.1	0	0	0	0	107.6	A367 E371	A367-T369 PolarHBondContact O-N 2.79Å; T369-E371 WeakPolarHBondContact CB-OE1 3.17Å; T369-E371 HydrophobicContact CG2-CG 4.47Å; T369-E371 PolarHBondContact O-N 3.12Å
370	E	47.8	Very low	46.8	Very low	182 Å²	182	126.6 Å²	126.6	85%	0.85	68%	0.676	S	S	*	*			trans	-69.5	39.7	176.3	-69	-173.8	150.1	0	0	112.8	I368	I368-E370 PolarHBondContact O-N 3.09Å
371	E	51.7	Low	47.6	Very low	135 Å²	135	127.2 Å²	127.2	63%	0.631	67%	0.669	S	S	*	*			trans	-117.5	81.6	-176.9	34.3	-168.4	131	0	0	107.3	T369	T369-E371 WeakPolarHBondContact CB-OE1 3.17Å; T369-E371 HydrophobicContact CG2-CG 4.47Å; T369-E371 PolarHBondContact O-N 3.12Å
372	N	54.1	Low	48.3	Very low	130 Å²	130	125.3 Å²	125.3	70%	0.695	66%	0.661	S	S	*	*	S	Bend	trans	-169.6	-30.3	155.1	-90.9	-32.5	0	0	0	111.8
373	E	49.6	Very low	48.8	Very low	181 Å²	181	123.3 Å²	123.3	85%	0.846	66%	0.655	S	S	*	*	H	α-helix	trans	-78.2	-29	-178.9	-64.9	-171	163.4	0	0	113.7
374	S	48.1	Very low	48.7	Very low	62 Å²	62	122.4 Å²	122.4	43%	0.434	65%	0.652	S	S	.	*	H	α-helix	trans	-72.8	-32.2	172.3	53.8	0	0	0	0	112.9	V376 E377 I378	S374-V376 VanDerWaalsContact C-N 3.34Å; S374-V376 PolarHBondContact O-N 2.9Å; S374-E377 PolarHBondContact O-N 2.88Å; S374-I378 WeakPolarHBondContact O-CB 3.32Å; S374-I378 VanDerWaalsContact O-CG1 3.25Å; S374-I378 WeakPolarHBondContact O-CG1 3.33Å; S374-I378 PolarHBondContact O-N 3.48Å
375	S	56.9	Low	48.8	Very low	49 Å²	49	122.6 Å²	122.6	34%	0.343	66%	0.655	S	S	.	*	H	α-helix	trans	-63.2	-34.4	-177.9	-62.6	0	0	0	0	113.7	Q379	S375-Q379 VanDerWaalsContact O-CB 3.27Å; S375-Q379 WeakPolarHBondContact O-CB 3.43Å; S375-Q379 VanDerWaalsContact O-CG 3.25Å; S375-Q379 WeakPolarHBondContact O-CG 3.35Å; S375-Q379 PolarHBondContact O-N 2.99Å
376	V	53.9	Low	48.6	Very low	77 Å²	77	119.3 Å²	119.3	47%	0.467	65%	0.651	S	S	.	*	H	α-helix	trans	-72.7	-32.6	-178.8	-178.6	0	0	0	0	112	S374	S374-V376 VanDerWaalsContact C-N 3.34Å; S374-V376 PolarHBondContact O-N 2.9Å
377	E	51.3	Low	48.4	Very low	111 Å²	111	119.2 Å²	119.2	52%	0.519	66%	0.655	S	S	.	*	H	α-helix	trans	-84.1	-31.9	176.2	-162.1	152.4	136.7	0	0	112	S374 R380	S374-E377 PolarHBondContact O-N 2.88Å; E377-R380 PolarHBondContact O-N 3.11Å
378	I	57.9	Low	48.1	Very low	105 Å²	105	122.9 Å²	122.9	54%	0.538	66%	0.662	S	S	.	*	H	α-helix	trans	-69.6	-37.8	172.9	-66.8	167.8	0	0	0	111.5	S374 R380 L381 A382	S374-I378 WeakPolarHBondContact O-CB 3.32Å; S374-I378 VanDerWaalsContact O-CG1 3.25Å; S374-I378 WeakPolarHBondContact O-CG1 3.33Å; S374-I378 PolarHBondContact O-N 3.48Å; I378-R380 PolarHBondContact O-N 2.77Å; I378-L381 PolarHBondContact O-N 2.87Å; I378-A382 PolarHBondContact O-N 3.27Å; I378-A382 VanDerWaalsContact O-N 3.07Å
379	Q	55.4	Low	47.8	Very low	148 Å²	148	122.5 Å²	122.5	69%	0.692	67%	0.667	S	S	*	*	H	α-helix	trans	-64.4	-25.3	176	-81	177.8	-7.2	0	0	113.4	S375	S375-Q379 VanDerWaalsContact O-CB 3.27Å; S375-Q379 WeakPolarHBondContact O-CB 3.43Å; S375-Q379 VanDerWaalsContact O-CG 3.25Å; S375-Q379 WeakPolarHBondContact O-CG 3.35Å; S375-Q379 PolarHBondContact O-N 2.99Å
380	R	49.9	Very low	47.3	Very low	169 Å²	169	120.8 Å²	120.8	64%	0.638	67%	0.667	S	S	*	*	H	α-helix	trans	-76	-21.7	171.5	-64.9	-177.8	-154.1	138.6	3.9	113.5	E377 I378	E377-R380 PolarHBondContact O-N 3.11Å; I378-R380 PolarHBondContact O-N 2.77Å
381	L	55.9	Low	46.7	Very low	137 Å²	137	117.4 Å²	117.4	72%	0.717	66%	0.663	S	S	*	*	H	α-helix	trans	-95.2	-11.9	178.7	-68.3	169.9	0	0	0	113.3	I378	I378-L381 PolarHBondContact O-N 2.87Å
382	A	54.3	Low	46.1	Very low	75 Å²	75	117.9 Å²	117.9	62%	0.62	67%	0.67	S	S	*	*	S	Bend	trans	-94.7	-3.8	-177.3	0	0	0	0	0	114.7	I378	I378-A382 PolarHBondContact O-N 3.27Å; I378-A382 VanDerWaalsContact O-N 3.07Å
383	G	44.7	Very low	45.1	Very low	58 Å²	58	116.3 Å²	116.3	60%	0.598	67%	0.67	S	S	*	*	S	Bend	trans	-76.8	-25.1	-175.8	0	0	0	0	0	115.6	H385	G383-H385 PolarHBondContact O-N 3.31Å
384	D	40.4	Very low	44.7	Very low	138 Å²	138	114.6 Å²	114.6	74%	0.738	67%	0.665	S	S	*	*	S	Bend	trans	-97.4	28.4	-158.4	-68.4	-22.5	0	0	0	115.5
385	H	41.7	Very low	44.1	Very low	177 Å²	177	121 Å²	121	82%	0.819	69%	0.686	S	S	*	*			trans	-136.2	65.1	180	-64.1	-32.9	0	0	0	114.2	G383	G383-H385 PolarHBondContact O-N 3.31Å
386	S	35.3	Very low	42.9	Very low	112 Å²	112	122.2 Å²	122.2	78%	0.783	71%	0.706	S	S	*	*			trans	-151.8	103.1	157.1	-171.8	0	0	0	0	114	L388	S386-L388 PolarHBondContact O-N 2.67Å
387	T	37.4	Very low	42.2	Very low	127 Å²	127	124.7 Å²	124.7	78%	0.779	72%	0.722	S	S	*	*			trans	-33.8	126.8	154.2	39.9	0	0	0	0	113.2
388	L	34.7	Very low	41.5	Very low	159 Å²	159	124 Å²	124	83%	0.832	73%	0.729	S	S	*	*				73.2	77.8	78.1	-166.1	136.7	0	0	0	114.3	S386	S386-L388 PolarHBondContact O-N 2.67Å
389	V	38.3	Very low	40.6	Very low	151 Å²	151	127.3 Å²	127.3	92%	0.915	75%	0.748	S	S	*	*			trans	-162.9	136.8	146.7	179.8	0	0	0	0	104.2
390	G	33.8	Very low	39.6	Very low	54 Å²	54	127.3 Å²	127.3	56%	0.557	75%	0.751	S	S	*	*			cis	154.5	151.9	0.5	0	0	0	0	0	108.5
391	S	36.2	Very low	39.3	Very low	110 Å²	110	126.9 Å²	126.9	77%	0.769	76%	0.76	S	S	*	*			trans	60.1	151.1	175.2	35.5	0	0	0	0	116.6
392	D	37.7	Very low	38.4	Very low	146 Å²	146	126.7 Å²	126.7	78%	0.781	76%	0.76	S	S	*	*			cis	-156.5	133.2	-13.3	-95.1	-26.8	0	0	0	105.8
393	S	34.5	Very low	37.8	Very low	97 Å²	97	130 Å²	130	68%	0.678	77%	0.772	S	S	*	*				80.9	130.9	93.4	-148.5	0	0	0	0	116.4
394	L	41.3	Very low	37.7	Very low	144 Å²	144	132.8 Å²	132.8	75%	0.754	78%	0.777	S	S	*	*			trans	77.5	109.6	156.5	-59.1	156.8	0	0	0	121.7
395	F	34.8	Very low	37.7	Very low	196 Å²	196	134.4 Å²	134.4	86%	0.86	78%	0.78	S	S	*	*			trans	30.7	107.8	138.5	-58.6	-85.1	0	0	0	122.1
396	G	31.7	Very low	37.7	Very low	75 Å²	75	131.1 Å²	131.1	77%	0.773	77%	0.769	S	S	*	*				53.9	110.3	103.9	0	0	0	0	0	121.7
397	T	39.1	Very low	37.9	Very low	130 Å²	130	134.2 Å²	134.2	80%	0.798	77%	0.771	S	S	*	*			trans	-150	108.2	150.8	46.3	0	0	0	0	107.9
398	S	36	Very low	37.6	Very low	96 Å²	96	134.6 Å²	134.6	67%	0.671	77%	0.773	S	S	*	*				79.3	118.6	98.3	75.5	0	0	0	0	115.6
399	N	40.6	Very low	37.8	Very low	174 Å²	174	134.6 Å²	134.6	93%	0.93	77%	0.772	S	S	*	*			trans	-144.7	108.3	147.6	-89.7	-34.1	0	0	0	107.6
400	I	34.5	Very low	37.6	Very low	149 Å²	149	132.3 Å²	132.3	76%	0.764	76%	0.763	S	S	*	*			trans	-118.4	127.9	173.5	-64.5	170.5	0	0	0	106.4
401	I	43.3	Very low	37.9	Very low	159 Å²	159	136.6 Å²	136.6	82%	0.815	78%	0.778	S	S	*	*			trans	-166.8	103.3	155.8	-85.6	129.3	0	0	0	103.5
402	D	36	Very low	37.9	Very low	134 Å²	134	142.1 Å²	142.1	72%	0.717	78%	0.782	S	S	*	*				62.1	122.3	85.7	-91.5	-19.9	0	0	0	115.7
403	V	42.9	Very low	38	Very low	145 Å²	145	144.6 Å²	144.6	88%	0.879	79%	0.789	S	S	*	*				-178.7	134.4	119.3	149.9	0	0	0	0	110.7
404	T	41.8	Very low	38.2	Very low	116 Å²	116	145.4 Å²	145.4	71%	0.712	80%	0.795	S	S	*	*			trans	-100.1	150.2	-172.3	51.7	0	0	0	0	114.8
405	H	40.8	Very low	37.8	Very low	171 Å²	171	146.1 Å²	146.1	79%	0.792	80%	0.798	S	S	*	*			trans	-152.8	105.5	155.4	-146.6	75.4	0	0	0	109.6
406	N	41.3	Very low	37.8	Very low	109 Å²	109	142.1 Å²	142.1	58%	0.583	79%	0.79	S	S	*	*				61.7	138.3	98.1	-61.7	-32.4	0	0	0	114.6
407	Q	38.9	Very low	38.2	Very low	177 Å²	177	146.4 Å²	146.4	83%	0.827	79%	0.79	S	S	*	*			cis	-162.5	163	4.3	-126.5	172.7	7.2	0	0	111.3
408	T	30.9	Very low	38	Very low	135 Å²	135	148 Å²	148	83%	0.828	79%	0.79	S	S	*	*			trans	-84.3	134.1	177.3	43.4	0	0	0	0	114.9
409	I	40.4	Very low	37.9	Very low	158 Å²	158	152.1 Å²	152.1	81%	0.81	80%	0.796	S	S	*	*			trans	-144.4	112.2	160.4	-55.3	178.2	0	0	0	106
410	S	33.7	Very low	37.7	Very low	103 Å²	103	152.1 Å²	152.1	72%	0.72	79%	0.79	S	S	*	*				73.7	84.9	52.4	-176.7	0	0	0	0	115.7
411	V	39.5	Very low	38	Very low	145 Å²	145	149.2 Å²	149.2	88%	0.879	78%	0.783	S	S	*	*			trans	-136.9	138.4	144.2	-169.3	0	0	0	0	109
412	R	35.8	Very low	37.5	Very low	225 Å²	225	151.4 Å²	151.4	85%	0.849	79%	0.787	S	S	*	*			trans	-100.7	148.3	177.9	-56.9	168.4	173.8	-169.7	-3.8	109
413	E	40.7	Very low	37.4	Very low	198 Å²	198	148.6 Å²	148.6	93%	0.925	79%	0.79	S	S	*	*				176	161.3	129.8	-99.5	166.9	-165.9	0	0	114.5
414	S	39.3	Very low	37	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	79%	0.79	S	S	*	*			trans	78.5	47	162.1	-150.3	0	0	0	0	122.7
415	L	32.3	Very low	36.8	Very low	158 Å²	158	144.4 Å²	144.4	83%	0.827	79%	0.791	S	S	*	*				16.9	127.3	117.6	-164.2	66.5	0	0	0	121.3
416	V	35.3	Very low	36.8	Very low	113 Å²	113	142.3 Å²	142.3	69%	0.685	79%	0.79	S	S	*	*			trans	90	147.9	141.7	156.1	0	0	0	0	123.3
417	Q	38.2	Very low	36.7	Very low	164 Å²	164	144 Å²	144	77%	0.766	80%	0.799	S	S	*	*			trans	80.4	132.9	173.5	-80.2	161.9	28.7	0	0	117
418	M	36.3	Very low	36.9	Very low	164 Å²	164	143.9 Å²	143.9	81%	0.808	80%	0.799	S	S	*	*			cis	-150.1	161.5	-4.4	-159	177.9	-71.8	0	0	111.2
419	K	33.2	Very low	37.2	Very low	182 Å²	182	142.4 Å²	142.4	79%	0.791	79%	0.792	S	S	*	*			trans	-120.6	138.1	-177.6	155.3	-173.9	172.7	-178.8	0	109
420	E	36.7	Very low	37	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	79%	0.792	S	S	*	*			trans	152.7	147.9	162.6	-91.1	159.3	-161.7	0	0	108.5
421	S	39.9	Very low	37.2	Very low	89 Å²	89	142.3 Å²	142.3	62%	0.622	79%	0.788	S	S	*	*			cis	-149.2	147.8	4.1	-97.9	0	0	0	0	109.9
422	F	34.5	Very low	36.8	Very low	204 Å²	204	142.2 Å²	142.2	90%	0.895	78%	0.783	S	S	*	*				34.9	134.2	103.4	-62.2	-86	0	0	0	116
423	G	33.9	Very low	37	Very low	76 Å²	76	139.8 Å²	139.8	78%	0.784	79%	0.785	S	S	*	*			cis	155.1	149.5	-2.1	0	0	0	0	0	112.2
424	G	33.4	Very low	36.8	Very low	85 Å²	85	136.1 Å²	136.1	88%	0.876	78%	0.776	S	S	*	*			trans	79.5	156.9	174.4	0	0	0	0	0	116
425	A	37.9	Very low	36.7	Very low	87 Å²	87	135 Å²	135	72%	0.719	77%	0.768	S	S	*	*			cis	-162.8	179.4	-4.5	0	0	0	0	0	110.8
426	T	41.2	Very low	36.9	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	77%	0.771	S	S	*	*			trans	75.2	142.3	173.7	71.7	0	0	0	0	117.8
427	D	38.9	Very low	36.8	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	78%	0.781	S	S	*	*			cis	-168.9	168.5	-35.7	-114.2	-35.9	0	0	0	109.4
428	Q	42.1	Very low	36.5	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	78%	0.782	S	S	*	*			trans	95.8	110.5	171.1	-59.3	-63.5	-26	0	0	118.5
429	P	37.3	Very low	36.5	Very low	104 Å²	104	137.4 Å²	137.4	68%	0.675	77%	0.77	S	S	*	*			trans	-113.3	178.5	171.8	37.8	-26.2	0	0	0	114.2
430	I	36.4	Very low	36.8	Very low	159 Å²	159	136.5 Å²	136.5	82%	0.815	77%	0.774	S	S	*	*			trans	130.1	139.7	147.7	-68.9	158.4	0	0	0	114.4
431	P	38.8	Very low	36.9	Very low	100 Å²	100	135.1 Å²	135.1	65%	0.649	77%	0.77	S	S	*	*			trans	-123.8	-172.4	-156.6	42.8	-25.9	0	0	0	115.6
432	D	31.3	Very low	36.7	Very low	143 Å²	143	135 Å²	135	77%	0.765	77%	0.774	S	S	*	*			trans	51.9	119.2	155.8	-62.4	-20.3	0	0	0	121.1
433	I	38.9	Very low	37	Very low	173 Å²	173	131.4 Å²	131.4	89%	0.887	78%	0.775	S	S	*	*			trans	-126.2	112.3	156.1	-62.7	-179.4	0	0	0	109.3
434	V	37.6	Very low	37	Very low	122 Å²	122	136.8 Å²	136.8	74%	0.739	78%	0.78	S	S	*	*			trans	-93.6	148.1	172.3	167.4	0	0	0	0	110
435	S	35.8	Very low	37.4	Very low	92 Å²	92	138 Å²	138	64%	0.643	78%	0.775	S	S	*	*			trans	66.6	128	164.5	67.9	0	0	0	0	118.7
436	N	37.2	Very low	37.3	Very low	167 Å²	167	139.5 Å²	139.5	89%	0.893	78%	0.775	S	S	*	*				-157	99.6	122	-94.7	-45.9	0	0	0	110.1
437	L	33.1	Very low	36.9	Very low	170 Å²	170	145 Å²	145	89%	0.89	78%	0.782	S	S	*	*			trans	-62.8	147.3	157	-168.7	83.4	0	0	0	108.1
438	R	32.9	Very low	36.9	Very low	209 Å²	209	147.5 Å²	147.5	79%	0.789	79%	0.789	S	S	*	*				153.5	133.3	126.5	-173.3	156.7	-154.8	166.9	7	116.2
439	N	36.4	Very low	36.4	Very low	102 Å²	102	143.4 Å²	143.4	55%	0.545	79%	0.785	S	S	.	*			trans	61.2	121.7	158.2	-66.7	-0.4	0	0	0	119.8
440	N	38.4	Very low	36.7	Very low	163 Å²	163	147 Å²	147	87%	0.872	80%	0.798	S	S	*	*				-159.3	164.2	93.5	-95	-26.8	0	0	0	112.4
441	I	38.8	Very low	36.6	Very low	145 Å²	145	146.5 Å²	146.5	74%	0.744	80%	0.797	S	S	*	*			trans	-123.1	153.9	-153.6	-75.1	166.2	0	0	0	111.6
442	A	35	Very low	36.5	Very low	86 Å²	86	150 Å²	150	71%	0.711	81%	0.809	S	S	*	*			trans	69	122.1	161.7	0	0	0	0	0	119.5
443	S	40.9	Very low	36.6	Very low	130 Å²	130	148.6 Å²	148.6	91%	0.909	81%	0.808	S	S	*	*				-154.1	145.2	103.4	-78.2	0	0	0	0	110.6
444	E	34.8	Very low	36.6	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	81%	0.809	S	S	*	*			trans	-129.3	130.2	-164.2	174.1	-179.1	-152.2	0	0	109
445	S	40.9	Very low	36.3	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	82%	0.815	S	S	*	*			trans	-160.9	116.5	159	-113.5	0	0	0	0	115.7
446	T	36.9	Very low	36.3	Very low	118 Å²	118	146.6 Å²	146.6	72%	0.724	82%	0.819	S	S	*	*			trans	71	97.8	130.9	-48.1	0	0	0	0	118.6
447	R	32.5	Very low	36.1	Very low	243 Å²	243	145 Å²	145	92%	0.917	82%	0.816	S	S	*	*			trans	-75.1	145.1	150.9	-63.1	177.1	170.7	-166.4	-4.5	110.1
448	Q	39.1	Very low	36.2	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	81%	0.81	S	S	*	*			trans	-137.5	136.4	145.7	-94.8	-176.6	-12.5	0	0	109.2
449	A	32.3	Very low	36.2	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	81%	0.808	S	S	*	*			trans	-115.9	145.8	-178.3	0	0	0	0	0	109.7
450	L	42.8	Very low	36.2	Very low	179 Å²	179	139.3 Å²	139.3	94%	0.937	82%	0.817	S	S	*	*			trans	-142	124.2	161.7	-87.6	171.1	0	0	0	108.1
451	D	33.7	Very low	36.1	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	81%	0.814	S	S	*	*			trans	-76.3	152.4	179.7	-59.8	-66.3	0	0	0	112.3
452	L	38.3	Very low	35.9	Very low	173 Å²	173	137 Å²	137	91%	0.906	81%	0.811	S	S	*	*				175	147.3	121.2	-89.9	151.4	0	0	0	110.9
453	P	32.7	Very low	36	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	82%	0.816	S	S	*	*			trans	-104.7	150.9	-162.2	38.8	-34	0	0	0	115
454	V	38.9	Very low	35.8	Very low	149 Å²	149	141.3 Å²	141.3	90%	0.903	81%	0.811	S	S	*	*			trans	-139.3	133.7	161.4	179.3	0	0	0	0	109.8
455	S	31.2	Very low	36	Very low	125 Å²	125	137.4 Å²	137.4	87%	0.874	80%	0.804	S	S	*	*			trans	-74.1	141	179.4	-51.9	0	0	0	0	112.7
456	G	35	Very low	35.8	Very low	70 Å²	70	138.2 Å²	138.2	72%	0.722	80%	0.804	S	S	*	*			trans	-167.8	98.1	172.1	0	0	0	0	0	111	S458	G456-S458 PolarHBondContact O-N 2.99Å; G456-S458 VanDerWaalsContact O-N 3.12Å
457	T	34.5	Very low	35.8	Very low	135 Å²	135	138.8 Å²	138.8	83%	0.828	81%	0.808	S	S	*	*			trans	-66.6	106.5	-174.6	-51.5	0	0	0	0	111.8	I459	T457-I459 HydrophobicContact CG2-CG1 4.4Å; T457-I459 PolarHBondContact O-N 3.05Å
458	S	34.6	Very low	36	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	80%	0.802	S	S	*	*			trans	-81.3	106.8	166.9	57.1	0	0	0	0	110	G456 S460	G456-S458 PolarHBondContact O-N 2.99Å; G456-S458 VanDerWaalsContact O-N 3.12Å; S458-S460 PolarHBondContact O-N 2.79Å
459	I	33.8	Very low	36.3	Very low	144 Å²	144	132.3 Å²	132.3	74%	0.738	80%	0.795	S	S	*	*			trans	-74.9	107.4	171.1	-63.8	173	0	0	0	108.2	T457	T457-I459 HydrophobicContact CG2-CG1 4.4Å; T457-I459 PolarHBondContact O-N 3.05Å
460	S	36.2	Very low	36.7	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.6	117.8	166.2	53	0	0	0	0	109.5	S458	S458-S460 PolarHBondContact O-N 2.79Å
461	L	34.6	Very low	36.7	Very low	154 Å²	154	131.6 Å²	131.6	81%	0.806	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.7	132.5	167.5	-76.1	87.1	0	0	0	109.4
462	P	35.1	Very low	37.7	Very low	106 Å²	106	132 Å²	132	69%	0.688	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.8	137.9	167.7	31.3	-32.3	0	0	0	110.4	E464	P462-E464 PolarHBondContact O-N 2.61Å
463	T	38.4	Very low	38.3	Very low	131 Å²	131	132.5 Å²	132.5	80%	0.804	79%	0.789	S	S	*	*			trans	-74.4	108	172.2	-50.3	0	0	0	0	109.6
464	E	36.2	Very low	39.2	Very low	174 Å²	174	135.7 Å²	135.7	81%	0.813	79%	0.794	S	S	*	*			trans	-91	108.3	172.7	-69.6	-172.5	-174.5	0	0	110.9	P462 T466	P462-E464 PolarHBondContact O-N 2.61Å; E464-T466 PolarHBondContact O-N 3.49Å
465	C	37.7	Very low	39.8	Very low	107 Å²	107	134.6 Å²	134.6	72%	0.723	79%	0.79	S	S	*	*			trans	-81.4	107.4	172.2	-71.8	0	0	0	0	110.3	T467	C465-T467 PolarHBondContact O-N 2.98Å; C465-T467 VanDerWaalsContact O-N 3.08Å
466	T	37.1	Very low	40.6	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	79%	0.787	S	S	*	*			trans	-59.2	110.8	174.4	-46	0	0	0	0	111.1	E464 L468	E464-T466 PolarHBondContact O-N 3.49Å; T466-L468 HydrophobicContact CG2-CD2 4.32Å
467	T	37.8	Very low	41.1	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	80%	0.796	S	S	*	*			trans	-96.5	115.9	168.3	-56.8	0	0	0	0	108.2	C465	C465-T467 PolarHBondContact O-N 2.98Å; C465-T467 VanDerWaalsContact O-N 3.08Å
468	L	35.7	Very low	41.2	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.3	129.7	178.9	-65.8	173.1	0	0	0	110.3	T466	T466-L468 HydrophobicContact CG2-CD2 4.32Å
469	I	46.9	Very low	41.4	Very low	150 Å²	150	145.1 Å²	145.1	77%	0.769	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.9	129.3	170.1	-61.7	173.6	0	0	0	107.8	V471	I469-V471 PolarHBondContact O-N 3.31Å
470	P	39	Very low	41.6	Very low	118 Å²	118	145.7 Å²	145.7	77%	0.766	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.1	131.4	173.3	-19	31.9	0	0	0	110.9
471	V	43.2	Very low	41.7	Very low	137 Å²	137	150.4 Å²	150.4	83%	0.83	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.3	138.5	172.8	174.7	0	0	0	0	109.1	I469	I469-V471 PolarHBondContact O-N 3.31Å
472	I	55.2	Low	41.7	Very low	157 Å²	157	151.2 Å²	151.2	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.2	-178.2	-65.6	162.8	0	0	0	110.2
473	E	50.2	Low	41.7	Very low	184 Å²	184	153.3 Å²	153.3	86%	0.86	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-78	134.4	170.7	-64.5	176.1	141.3	0	0	110.5
474	E	52.1	Low	41.9	Very low	181 Å²	181	156.5 Å²	156.5	85%	0.846	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-88.1	141	164.8	-72.3	-163.7	148.4	0	0	110.1
475	P	51.3	Low	42.1	Very low	126 Å²	126	157.1 Å²	157.1	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-79.8	129.1	-174.1	31.1	-34.4	0	0	0	112.8
476	E	48.2	Very low	41.9	Very low	171 Å²	171	158.6 Å²	158.6	80%	0.799	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.8	125.1	171.2	-68.6	-169	149.1	0	0	112.1	N478	E476-N478 PolarHBondContact O-N 3.17Å; E476-N478 VanDerWaalsContact O-N 3.12Å
477	E	45.7	Very low	41.9	Very low	196 Å²	196	157 Å²	157	92%	0.916	81%	0.809	S	S	*	*			trans	-74.1	96.1	169.1	-69.4	-172.2	139.6	0	0	111.3
478	N	35.8	Very low	41.8	Very low	131 Å²	131	162.1 Å²	162.1	70%	0.701	81%	0.814	S	S	*	*			trans	-105.2	91.7	165.7	-79.7	-76.8	0	0	0	110.2	E476	E476-N478 PolarHBondContact O-N 3.17Å; E476-N478 VanDerWaalsContact O-N 3.12Å
479	L	40	Very low	41.7	Very low	163 Å²	163	159.6 Å²	159.6	85%	0.853	81%	0.809	S	S	*	*			trans	-94.5	133.5	169.2	-100.4	169.8	0	0	0	111.3
480	Q	38.1	Very low	41.5	Very low	157 Å²	157	158.9 Å²	158.9	73%	0.734	81%	0.812	S	S	*	*			trans	-64.5	140	-172.8	-65	85.9	-9.3	0	0	113.3
481	Q	37.3	Very low	41.7	Very low	204 Å²	204	159.5 Å²	159.5	95%	0.953	81%	0.813	S	S	*	*			trans	-156.5	88.9	142	-114.3	156.1	76.1	0	0	111.5
482	Q	33.9	Very low	41.7	Very low	172 Å²	172	157.7 Å²	157.7	80%	0.804	80%	0.804	S	S	*	*			trans	-110	145.9	155.1	-86.4	-173.3	-30.4	0	0	108.3
483	N	35.5	Very low	40.9	Very low	150 Å²	150	156.8 Å²	156.8	80%	0.802	80%	0.801	S	S	*	*			trans	67	111.7	171.4	-48.2	-33.3	0	0	0	116.1
484	E	42.8	Very low	40.4	Very low	198 Å²	198	154.9 Å²	154.9	93%	0.925	80%	0.796	S	S	*	*				-156.7	156.2	94.3	-130.7	177.1	156.6	0	0	112.2
485	F	40.9	Very low	40.1	Very low	187 Å²	187	150.9 Å²	150.9	82%	0.82	78%	0.784	S	S	*	*			trans	-98.8	135.4	-174.4	-111.4	-101.3	0	0	0	111.2
486	D	32.6	Very low	39.7	Very low	137 Å²	137	153.6 Å²	153.6	73%	0.733	79%	0.786	S	S	*	*			trans	70.9	149.7	140.3	-125.2	-37.9	0	0	0	122.6
487	S	38.8	Very low	39.4	Very low	96 Å²	96	149.3 Å²	149.3	67%	0.671	78%	0.779	S	S	*	*			trans	76.8	86.6	150	-70.4	0	0	0	0	122.7
488	R	34.1	Very low	39.4	Very low	236 Å²	236	147.9 Å²	147.9	89%	0.891	78%	0.778	S	S	*	*				72.5	118.3	112.5	-132.1	179.9	-170.2	173	3.8	120.1
489	S	34.5	Very low	39.8	Very low	100 Å²	100	147.1 Å²	147.1	70%	0.699	78%	0.78	S	S	*	*				125.6	132.9	110.9	-134.9	0	0	0	0	118.9
490	V	43	Very low	39.7	Very low	135 Å²	135	146.6 Å²	146.6	82%	0.818	78%	0.778	S	S	*	*			trans	78	99.7	155.9	-163.2	0	0	0	0	120.2
491	V	43.2	Very low	39.8	Very low	132 Å²	132	147.2 Å²	147.2	80%	0.8	78%	0.781	S	S	*	*			trans	-76.8	-179.4	155.3	-121.8	0	0	0	0	110.4
492	P	42.6	Very low	39.4	Very low	98 Å²	98	143.3 Å²	143.3	64%	0.636	77%	0.774	S	S	*	*			cis	-144.9	-172.2	4.2	38.5	-15.8	0	0	0	118.4
493	N	37.9	Very low	39.4	Very low	138 Å²	138	141.2 Å²	141.2	74%	0.738	78%	0.776	S	S	*	*			trans	76.1	149.5	146.2	-76.9	-2.4	0	0	0	118.2
494	L	39.2	Very low	39.6	Very low	144 Å²	144	141.3 Å²	141.3	75%	0.754	78%	0.775	S	S	*	*			cis	-162.1	145.7	11.4	-114.4	157.7	0	0	0	105.8
495	T	46.6	Very low	39.2	Very low	98 Å²	98	137.9 Å²	137.9	60%	0.601	77%	0.77	S	S	*	*				154.7	141.4	78.4	-99.1	0	0	0	0	109.9
496	E	42.2	Very low	38.9	Very low	182 Å²	182	136 Å²	136	85%	0.85	77%	0.767	S	S	*	*			trans	40	151.1	150.8	-61.4	173.7	128.1	0	0	122.5
497	A	43.6	Very low	39.1	Very low	81 Å²	81	138.1 Å²	138.1	67%	0.669	77%	0.773	S	S	*	*			cis	-161	151.5	10.9	0	0	0	0	0	115
498	L	45.9	Very low	38.9	Very low	167 Å²	167	139.2 Å²	139.2	87%	0.874	78%	0.775	S	S	*	*			trans	65.5	160.3	145.8	-95.4	71.5	0	0	0	121.2
499	P	43.2	Very low	38.8	Very low	115 Å²	115	131 Å²	131	75%	0.747	75%	0.754	S	S	*	*			trans	-141.4	162.5	-131.2	39.9	-18.4	0	0	0	117
500	D	38.5	Very low	38.5	Very low	151 Å²	151	131.6 Å²	131.6	81%	0.807	76%	0.758	S	S	*	*			trans	-163.7	169.1	141.3	-143.7	-22.3	0	0	0	111.1
501	Q	40.7	Very low	38.2	Very low	171 Å²	171	132.7 Å²	132.7	80%	0.799	75%	0.752	S	S	*	*			trans	80.4	90	170.9	-60.4	173.9	69.8	0	0	117.9
502	C	28.8	Very low	38.3	Very low	121 Å²	121	131.4 Å²	131.4	82%	0.818	75%	0.746	S	S	*	*			trans	28.9	103.4	133.8	-56.3	0	0	0	0	119.9
503	P	32	Very low	38.9	Very low	129 Å²	129	133.5 Å²	133.5	84%	0.838	75%	0.748	S	S	*	*			trans	-81.4	121.4	157.1	-1.6	20.4	0	0	0	110.4
504	L	39.8	Very low	40.4	Very low	152 Å²	152	130.5 Å²	130.5	80%	0.796	73%	0.728	S	S	*	*			trans	-64	150.1	160.8	-75.4	161.1	0	0	0	109.5	I506	L504-I506 PolarHBondContact O-N 3.47Å
505	P	34.7	Very low	42.5	Very low	125 Å²	125	127.3 Å²	127.3	81%	0.812	71%	0.709	S	S	*	*			trans	-66.9	96.3	-178.8	-20.2	33.4	0	0	0	112.3	E507	P505-E507 PolarHBondContact O-N 3.07Å
506	I	34.9	Very low	44.5	Very low	149 Å²	149	123.3 Å²	123.3	76%	0.764	68%	0.683	S	S	*	*			trans	-77.4	74.5	165.1	-56.5	177.4	0	0	0	107.5	L504 V508	L504-I506 PolarHBondContact O-N 3.47Å; I506-V508 HydrophobicContact CG2-CB 4.37Å; I506-V508 HydrophobicContact CG2-CG2 3.67Å; I506-V508 PolarHBondContact O-N 2.97Å
507	E	38.1	Very low	46.6	Very low	180 Å²	180	121.3 Å²	121.3	84%	0.841	67%	0.674	S	S	*	*			trans	-82.8	74.9	156	-81.9	-155.3	148.1	0	0	108.8	P505 S509	P505-E507 PolarHBondContact O-N 3.07Å; E507-S509 PolarHBondContact O-N 2.65Å
508	V	34.7	Very low	48.9	Very low	120 Å²	120	120.8 Å²	120.8	73%	0.727	66%	0.66	S	S	*	*			trans	-72.2	76	153.9	178.5	0	0	0	0	106.4	I506 S510	I506-V508 HydrophobicContact CG2-CB 4.37Å; I506-V508 HydrophobicContact CG2-CG2 3.67Å; I506-V508 PolarHBondContact O-N 2.97Å; V508-S510 PolarHBondContact O-N 3.34Å
509	S	31.2	Very low	51.1	Low	63 Å²	63	116.3 Å²	116.3	44%	0.441	63%	0.633	S	S	.	*			trans	-58.9	108.5	160.6	172	0	0	0	0	106.4	E507 F511	E507-S509 PolarHBondContact O-N 2.65Å; S509-F511 VanDerWaalsContact O-CD2 3.32Å; S509-F511 WeakPolarHBondContact O-CD2 3.4Å; S509-F511 PolarHBondContact O-N 2.97Å; S509-F511 WeakPolarHBondContact OG-CD2 3.4Å; S509-F511 WeakPolarHBondContact OG-CE2 3.47Å; S509-F511 WeakPolarHBondContact OG-CZ 3.21Å
510	S	28.1	Very low	53.4	Low	112 Å²	112	114.6 Å²	114.6	78%	0.783	62%	0.624	S	S	*	*			trans	-70.4	73.4	174.6	58.1	0	0	0	0	109.1	V508	V508-S510 PolarHBondContact O-N 3.34Å
511	F	37	Very low	56	Low	159 Å²	159	111.8 Å²	111.8	70%	0.697	61%	0.606	S	S	*	*			trans	-59.6	124.5	170.9	-74.2	-77.7	0	0	0	107.9	S509 E513	S509-F511 VanDerWaalsContact O-CD2 3.32Å; S509-F511 WeakPolarHBondContact O-CD2 3.4Å; S509-F511 PolarHBondContact O-N 2.97Å; S509-F511 WeakPolarHBondContact OG-CD2 3.4Å; S509-F511 WeakPolarHBondContact OG-CE2 3.47Å; S509-F511 WeakPolarHBondContact OG-CZ 3.21Å; F511-E513 PolarHBondContact O-N 2.76Å; F511-E513 VanDerWaalsContact O-N 3.11Å
512	P	45.8	Very low	58.5	Low	104 Å²	104	103.7 Å²	103.7	68%	0.675	57%	0.568	S	S	*	*			trans	-63.6	119.2	178.6	25.7	-33	0	0	0	108.4	K514	P512-K514 PolarHBondContact O-N 2.86Å
513	E	55.2	Low	61.5	Low	143 Å²	143	100.7 Å²	100.7	67%	0.668	54%	0.54	S	S	*	.			trans	-57	110.5	178.1	-77.3	-163.2	110.4	0	0	109.9	F511 H515	F511-E513 PolarHBondContact O-N 2.76Å; F511-E513 VanDerWaalsContact O-N 3.11Å; E513-H515 VanDerWaalsContact C-N 3.29Å; E513-H515 PolarHBondContact O-N 3.35Å
514	K	68.1	Low	64.3	Low	74 Å²	74	104.3 Å²	104.3	32%	0.322	54%	0.536	S	S	.	.			trans	-80.3	82.9	176.2	-66	179	-162.6	154.9	0	109.3	P512 F516 Y525 N542	P512-K514 PolarHBondContact O-N 2.86Å; K514-F516 HydrophobicContact CB-CE2 3.99Å; K514-F516 HydrophobicContact CB-CZ 4.05Å; K514-Y525 HydrophobicContact CD-CE2 4.2Å; K514-Y525 PolarHBondContact NZ-OH 3.49Å; K514-N542 PolarHBondContact NZ-O 2.91Å
515	H	82.6	Confident	66.7	Low	78 Å²	78	99.3 Å²	99.3	36%	0.361	51%	0.507	S	S	.	.			trans	-83.4	123.3	171.6	-149.1	96.6	0	0	0	109.8	E513 H517 Q552	E513-H515 VanDerWaalsContact C-N 3.29Å; E513-H515 PolarHBondContact O-N 3.35Å; H515-H517 AromaticContact CD2-CE1 3.23Å; H515-H517 PolarHBondContact CD2-CE1 2.95Å; H515-H517 AromaticContact CD2-ND1 3.56Å; H515-H517 AromaticContact CD2-NE2 3.6Å; H515-H517 AromaticContact NE2-CE1 3.76Å; H515-H517 AromaticContact NE2-ND1 3.94Å; H515-Q552 PolarHBondContact CD2-OE1 3.43Å; H515-Q552 PolarHBondContact CE1-OE1 3.25Å; H515-Q552 PolarHBondContact NE2-OE1 3.11Å
516	F	89.2	Confident	69.3	Low	14 Å²	14	93.4 Å²	93.4	6%	0.061	47%	0.469	C	S	.	.			trans	-109.9	116.1	175.9	-55.1	-82.1	0	0	0	108.6	K514 Q521 L522 Y525 L543 Q552 F555 V556	K514-F516 HydrophobicContact CB-CE2 3.99Å; K514-F516 HydrophobicContact CB-CZ 4.05Å; F516-Q521 HydrophobicContact CD1-CB 4.38Å; F516-L522 HydrophobicContact CB-CB 4.46Å; F516-L522 HydrophobicContact CB-CD1 4.28Å; F516-L522 HydrophobicContact CD1-CB 4.32Å; F516-L522 HydrophobicContact CD1-CD1 3.92Å; F516-L522 HydrophobicContact CD2-CD1 3.48Å; F516-L522 VanDerWaalsContact CD2-CD1 3.48Å; F516-L522 HydrophobicContact CE1-CD1 4.06Å; F516-L522 HydrophobicContact CE2-CD1 3.63Å; F516-L522 HydrophobicContact CG-CB 4.38Å; F516-L522 HydrophobicContact CG-CD1 3.63Å; F516-L522 HydrophobicContact CZ-CD1 3.92Å; F516-Y525 AromaticContact CE1-CD1 3.96Å; F516-Y525 HydrophobicContact CE1-CD1 3.96Å; F516-Y525 HydrophobicContact CE1-CD2 4.35Å; F516-Y525 AromaticContact CE1-CG 3.71Å; F516-Y525 HydrophobicContact CE1-CG 3.71Å; F516-Y525 AromaticContact CZ-CD1 3.64Å; F516-Y525 HydrophobicContact CZ-CD1 3.64Å; F516-Y525 HydrophobicContact CZ-CD2 4.47Å; F516-Y525 HydrophobicContact CZ-CE1 4.14Å; F516-Y525 AromaticContact CZ-CG 3.84Å; F516-Y525 HydrophobicContact CZ-CG 3.84Å; F516-L543 HydrophobicContact CE2-CB 4.27Å; F516-Q552 PolarHBondContact O-NE2 3.24Å; F516-Q552 PolarHBondContact O-OE1 3.35Å; F516-F555 HydrophobicContact CB-CE1 4.18Å; F516-F555 WeakPolarHBondContact O-CD1 3.45Å; F516-F555 VanDerWaalsContact O-CE1 3.29Å; F516-F555 WeakPolarHBondContact O-CE1 3.33Å; F516-V556 HydrophobicContact CD2-CG2 3.87Å; F516-V556 HydrophobicContact CE2-CG2 4.45Å
517	H	86.5	Confident	71.9	Confident	140 Å²	140	91.6 Å²	91.6	65%	0.648	45%	0.453	S	S	*	.			trans	-90.1	-20	-178.6	-62.6	-78.7	0	0	0	113.3	H515	H515-H517 AromaticContact CD2-CE1 3.23Å; H515-H517 PolarHBondContact CD2-CE1 2.95Å; H515-H517 AromaticContact CD2-ND1 3.56Å; H515-H517 AromaticContact CD2-NE2 3.6Å; H515-H517 AromaticContact NE2-CE1 3.76Å; H515-H517 AromaticContact NE2-ND1 3.94Å
518	D	91.5	Very high	74.1	Confident	70 Å²	70	84.5 Å²	84.5	37%	0.374	42%	0.424	S	S	.	.	S	Bend	trans	-140.9	153.7	-179.6	177.4	45.2	0	0	0	112.4	S520 Q521 L522	D518-S520 PolarHBondContact O-N 2.99Å; D518-S520 WeakPolarHBondContact OD2-CB 3.32Å; D518-S520 PolarHBondContact OD2-N 3.39Å; D518-S520 PolarHBondContact OD2-OG 3.3Å; D518-Q521 HydrophobicContact CB-CG 4.47Å; D518-Q521 WeakPolarHBondContact O-CB 3.42Å; D518-Q521 PolarHBondContact O-N 3.36Å; D518-Q521 VanDerWaalsContact O-N 3.13Å; D518-L522 PolarHBondContact O-N 3.17Å
519	K	93.1	Very high	76.5	Confident	73 Å²	73	84.9 Å²	84.9	32%	0.317	41%	0.412	S	S	.	.	H	α-helix	trans	-57	-35.6	176.4	-53.7	-175.5	-174	177.7	0	111.6	Q521 L522 W523 F555 T559 E562 F563	K519-Q521 VanDerWaalsContact C-N 3.34Å; K519-Q521 PolarHBondContact O-N 3.4Å; K519-L522 PolarHBondContact O-N 3.23Å; K519-W523 WeakPolarHBondContact O-CB 3.29Å; K519-W523 PolarHBondContact O-N 3.43Å; K519-F555 HydrophobicContact CG-CZ 4.4Å; K519-T559 HydrophobicContact CB-CG2 3.87Å; K519-T559 HydrophobicContact CD-CG2 4.25Å; K519-T559 HydrophobicContact CG-CG2 3.74Å; K519-E562 WeakPolarHBondContact CE-OE2 3.47Å; K519-E562 IonicContact NZ-OE1 2.76Å; K519-E562 PolarHBondContact NZ-OE1 3.22Å; K519-E562 IonicContact NZ-OE2 3.02Å; K519-E562 PolarHBondContact NZ-OE2 3.2Å; K519-F563 HydrophobicContact CB-CZ 4.27Å
520	S	92.1	Very high	79.1	Confident	79 Å²	79	82.7 Å²	82.7	55%	0.552	40%	0.395	S	S	*	.	H	α-helix	trans	-66.7	-35.9	179.3	-43.4	0	0	0	0	112	D518 R524	D518-S520 PolarHBondContact O-N 2.99Å; D518-S520 WeakPolarHBondContact OD2-CB 3.32Å; D518-S520 PolarHBondContact OD2-N 3.39Å; D518-S520 PolarHBondContact OD2-OG 3.3Å; S520-R524 VanDerWaalsContact O-CB 3.3Å; S520-R524 WeakPolarHBondContact O-CB 3.31Å; S520-R524 PolarHBondContact O-N 2.96Å
521	Q	91.9	Very high	81.6	Confident	92 Å²	92	81.9 Å²	81.9	43%	0.43	38%	0.382	S	S	.	.	H	α-helix	trans	-66.6	-46.3	174.8	-63.3	178	-12.2	0	0	110.6	F516 D518 K519 R524 Y525	F516-Q521 HydrophobicContact CD1-CB 4.38Å; D518-Q521 HydrophobicContact CB-CG 4.47Å; D518-Q521 WeakPolarHBondContact O-CB 3.42Å; D518-Q521 PolarHBondContact O-N 3.36Å; D518-Q521 VanDerWaalsContact O-N 3.13Å; K519-Q521 VanDerWaalsContact C-N 3.34Å; K519-Q521 PolarHBondContact O-N 3.4Å; Q521-R524 PolarHBondContact O-N 3.12Å; Q521-Y525 WeakPolarHBondContact O-CB 3.5Å; Q521-Y525 PolarHBondContact O-N 3.1Å
522	L	93.1	Very high	83.3	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-44.6	177	-168.5	73.3	0	0	0	111.8	F516 D518 K519 Y525 L526 L543 V556 T559 F563	F516-L522 HydrophobicContact CB-CB 4.46Å; F516-L522 HydrophobicContact CB-CD1 4.28Å; F516-L522 HydrophobicContact CD1-CB 4.32Å; F516-L522 HydrophobicContact CD1-CD1 3.92Å; F516-L522 HydrophobicContact CD2-CD1 3.48Å; F516-L522 VanDerWaalsContact CD2-CD1 3.48Å; F516-L522 HydrophobicContact CE1-CD1 4.06Å; F516-L522 HydrophobicContact CE2-CD1 3.63Å; F516-L522 HydrophobicContact CG-CB 4.38Å; F516-L522 HydrophobicContact CG-CD1 3.63Å; F516-L522 HydrophobicContact CZ-CD1 3.92Å; D518-L522 PolarHBondContact O-N 3.17Å; K519-L522 PolarHBondContact O-N 3.23Å; L522-Y525 PolarHBondContact O-N 3.36Å; L522-L526 HydrophobicContact CG-CD1 4.34Å; L522-L526 WeakPolarHBondContact O-CB 3.18Å; L522-L526 WeakPolarHBondContact O-CG 3.29Å; L522-L526 PolarHBondContact O-N 3Å; L522-L543 HydrophobicContact CD1-CD2 3.57Å; L522-L543 HydrophobicContact CG-CD2 4.37Å; L522-V556 HydrophobicContact CD1-CG1 4.23Å; L522-V556 HydrophobicContact CD1-CG2 4.05Å; L522-V556 HydrophobicContact CD2-CG1 4.45Å; L522-T559 HydrophobicContact CD2-CG2 3.61Å; L522-F563 HydrophobicContact CD2-CE2 4.22Å
523	W	92.3	Very high	84.3	Confident	59 Å²	59	79 Å²	79	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-61.7	-46.8	176.4	179.9	-109.5	0	0	0	111.9	K519 Y525 L526 Y527 F563 R568 I569 I584	K519-W523 WeakPolarHBondContact O-CB 3.29Å; K519-W523 PolarHBondContact O-N 3.43Å; W523-Y525 VanDerWaalsContact C-N 3.29Å; W523-Y525 PolarHBondContact O-N 3.37Å; W523-L526 PolarHBondContact O-N 3.01Å; W523-Y527 AromaticContact CZ2-CD2 3.92Å; W523-Y527 HydrophobicContact CZ2-CD2 3.92Å; W523-Y527 VanDerWaalsContact O-CB 3.27Å; W523-Y527 WeakPolarHBondContact O-CB 3.44Å; W523-Y527 PolarHBondContact O-N 3.42Å; W523-F563 HydrophobicContact CB-CE2 4.05Å; W523-F563 HydrophobicContact CB-CZ 3.76Å; W523-F563 AromaticContact CE3-CD2 3.94Å; W523-F563 HydrophobicContact CE3-CD2 3.94Å; W523-F563 AromaticContact CE3-CE2 3.93Å; W523-F563 HydrophobicContact CE3-CE2 3.93Å; W523-F563 HydrophobicContact CE3-CG 4.3Å; W523-F563 HydrophobicContact CE3-CZ 4.29Å; W523-F563 HydrophobicContact CZ3-CD2 4.49Å; W523-R568 HydrophobicContact CH2-CB 3.78Å; W523-R568 HydrophobicContact CH2-CG 4.49Å; W523-R568 HydrophobicContact CZ3-CB 3.81Å; W523-I569 HydrophobicContact CZ3-CG2 3.82Å; W523-I584 HydrophobicContact CH2-CD1 4.35Å; W523-I584 HydrophobicContact CH2-CG1 4.25Å
524	R	90.6	Very high	84.9	Confident	204 Å²	204	77.9 Å²	77.9	77%	0.77	36%	0.364	S	S	*	.	H	α-helix	trans	-62.2	-38.9	179.7	-163.1	178.7	-168.7	110.1	1.2	111.5	S520 Q521 S528	S520-R524 VanDerWaalsContact O-CB 3.3Å; S520-R524 WeakPolarHBondContact O-CB 3.31Å; S520-R524 PolarHBondContact O-N 2.96Å; Q521-R524 PolarHBondContact O-N 3.12Å; R524-S528 WeakPolarHBondContact O-CB 3.37Å; R524-S528 PolarHBondContact O-N 2.96Å; R524-S528 PolarHBondContact O-OG 2.96Å; R524-S528 VanDerWaalsContact O-OG 3.1Å
525	Y	90.2	Very high	85.2	Confident	48 Å²	48	76.7 Å²	76.7	19%	0.188	37%	0.365	C	S	.	.	H	α-helix	trans	-67.3	-44.2	175.1	179.7	-97	0	0	0	113.2	K514 F516 Q521 L522 W523 S528 R529 L543	K514-Y525 HydrophobicContact CD-CE2 4.2Å; K514-Y525 PolarHBondContact NZ-OH 3.49Å; F516-Y525 AromaticContact CE1-CD1 3.96Å; F516-Y525 HydrophobicContact CE1-CD1 3.96Å; F516-Y525 HydrophobicContact CE1-CD2 4.35Å; F516-Y525 AromaticContact CE1-CG 3.71Å; F516-Y525 HydrophobicContact CE1-CG 3.71Å; F516-Y525 AromaticContact CZ-CD1 3.64Å; F516-Y525 HydrophobicContact CZ-CD1 3.64Å; F516-Y525 HydrophobicContact CZ-CD2 4.47Å; F516-Y525 HydrophobicContact CZ-CE1 4.14Å; F516-Y525 AromaticContact CZ-CG 3.84Å; F516-Y525 HydrophobicContact CZ-CG 3.84Å; Q521-Y525 WeakPolarHBondContact O-CB 3.5Å; Q521-Y525 PolarHBondContact O-N 3.1Å; L522-Y525 PolarHBondContact O-N 3.36Å; W523-Y525 VanDerWaalsContact C-N 3.29Å; W523-Y525 PolarHBondContact O-N 3.37Å; Y525-S528 PolarHBondContact O-OG 3.1Å; Y525-R529 WeakPolarHBondContact O-CB 3.17Å; Y525-R529 PolarHBondContact O-N 2.78Å; Y525-L543 HydrophobicContact CD1-CD2 4Å; Y525-L543 HydrophobicContact CD1-CG 4.38Å; Y525-L543 HydrophobicContact CE1-CD2 4.24Å; Y525-L543 HydrophobicContact CE1-CG 4.12Å
526	L	89.8	Confident	85	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-46.3	174.2	-80	167.1	0	0	0	111.4	L522 W523 R529 L530 L543 L560 F563 I582	L522-L526 HydrophobicContact CG-CD1 4.34Å; L522-L526 WeakPolarHBondContact O-CB 3.18Å; L522-L526 WeakPolarHBondContact O-CG 3.29Å; L522-L526 PolarHBondContact O-N 3Å; W523-L526 PolarHBondContact O-N 3.01Å; L526-R529 PolarHBondContact O-N 3.02Å; L526-L530 WeakPolarHBondContact O-CB 3.36Å; L526-L530 WeakPolarHBondContact O-CG 3.29Å; L526-L530 PolarHBondContact O-N 2.76Å; L526-L543 HydrophobicContact CD1-CD2 4.45Å; L526-L543 HydrophobicContact CD2-CD1 4.2Å; L526-L543 HydrophobicContact CD2-CD2 3.69Å; L526-L543 HydrophobicContact CG-CD2 3.87Å; L526-L560 HydrophobicContact CD1-CD2 3.74Å; L526-F563 HydrophobicContact CD1-CD2 4.09Å; L526-F563 HydrophobicContact CD1-CE2 4.14Å; L526-I582 HydrophobicContact CD2-CD1 4.31Å; L526-I582 HydrophobicContact CD2-CG2 3.97Å
527	Y	88	Confident	84.9	Confident	112 Å²	112	83.5 Å²	83.5	44%	0.439	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-48.8	-177.5	-168.3	-89.2	0	0	0	111.8	W523 R529 L531 I584	W523-Y527 AromaticContact CZ2-CD2 3.92Å; W523-Y527 HydrophobicContact CZ2-CD2 3.92Å; W523-Y527 VanDerWaalsContact O-CB 3.27Å; W523-Y527 WeakPolarHBondContact O-CB 3.44Å; W523-Y527 PolarHBondContact O-N 3.42Å; Y527-R529 VanDerWaalsContact C-N 3.34Å; Y527-R529 PolarHBondContact O-N 3.08Å; Y527-L531 HydrophobicContact CD1-CD2 4.36Å; Y527-L531 HydrophobicContact CE1-CD2 3.53Å; Y527-L531 WeakPolarHBondContact O-CB 3.49Å; Y527-L531 PolarHBondContact O-N 3.01Å; Y527-I584 HydrophobicContact CD2-CD1 3.93Å
528	S	85.4	Confident	85.1	Confident	31 Å²	31	77.2 Å²	77.2	22%	0.217	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-46	175.1	66.1	0	0	0	0	110.6	R524 Y525 E532	R524-S528 WeakPolarHBondContact O-CB 3.37Å; R524-S528 PolarHBondContact O-N 2.96Å; R524-S528 PolarHBondContact O-OG 2.96Å; R524-S528 VanDerWaalsContact O-OG 3.1Å; Y525-S528 PolarHBondContact O-OG 3.1Å; S528-E532 VanDerWaalsContact CB-OE1 3.3Å; S528-E532 WeakPolarHBondContact CB-OE1 3.08Å; S528-E532 WeakPolarHBondContact O-CA 3.5Å; S528-E532 WeakPolarHBondContact O-CB 3.16Å; S528-E532 WeakPolarHBondContact O-CG 3.21Å; S528-E532 PolarHBondContact O-N 3.43Å
529	R	85.2	Confident	85.1	Confident	128 Å²	128	76.7 Å²	76.7	48%	0.483	37%	0.365	S	S	.	.	H	α-helix	trans	-68.6	-42.9	-176.1	-166.8	63.7	175.2	-168.1	1.6	112.8	Y525 L526 Y527 S533 I538	Y525-R529 WeakPolarHBondContact O-CB 3.17Å; Y525-R529 PolarHBondContact O-N 2.78Å; L526-R529 PolarHBondContact O-N 3.02Å; Y527-R529 VanDerWaalsContact C-N 3.34Å; Y527-R529 PolarHBondContact O-N 3.08Å; R529-S533 WeakPolarHBondContact O-CB 3.46Å; R529-S533 PolarHBondContact O-N 2.64Å; R529-S533 PolarHBondContact O-OG 2.94Å; R529-I538 HydrophobicContact CB-CD1 3.48Å; R529-I538 VanDerWaalsContact CB-CD1 3.48Å; R529-I538 HydrophobicContact CG-CD1 3.35Å; R529-I538 HydrophobicContact CG-CG1 4.2Å
530	L	84.9	Confident	85	Confident	17 Å²	17	74.6 Å²	74.6	9%	0.089	36%	0.357	C	S	.	.	H	α-helix	trans	-69.4	-39.9	178	-73.7	166.3	0	0	0	112.1	L526 S535 I538 I584	L526-L530 WeakPolarHBondContact O-CB 3.36Å; L526-L530 WeakPolarHBondContact O-CG 3.29Å; L526-L530 PolarHBondContact O-N 2.76Å; L530-S535 WeakPolarHBondContact CD2-O 3.35Å; L530-I538 HydrophobicContact CD1-CD1 4.46Å; L530-I538 HydrophobicContact CD2-CB 4.28Å; L530-I538 HydrophobicContact CD2-CD1 3.81Å; L530-I538 HydrophobicContact CD2-CG1 3.64Å; L530-I538 HydrophobicContact CG-CD1 3.6Å; L530-I538 HydrophobicContact CG-CG1 4.03Å; L530-I584 HydrophobicContact CB-CD1 3.96Å; L530-I584 HydrophobicContact CD1-CB 4.11Å; L530-I584 HydrophobicContact CD1-CD1 3.51Å; L530-I584 HydrophobicContact CD1-CG1 3.48Å; L530-I584 VanDerWaalsContact CD1-CG1 3.48Å; L530-I584 HydrophobicContact CG-CD1 4.33Å
531	L	80.4	Confident	84.8	Confident	95 Å²	95	75.8 Å²	75.8	50%	0.497	35%	0.354	S	S	.	.	H	α-helix	trans	-81.6	-44.1	-176.5	-166.8	67.9	0	0	0	113.3	Y527	Y527-L531 HydrophobicContact CD1-CD2 4.36Å; Y527-L531 HydrophobicContact CE1-CD2 3.53Å; Y527-L531 WeakPolarHBondContact O-CB 3.49Å; Y527-L531 PolarHBondContact O-N 3.01Å
532	E	72.7	Confident	84.6	Confident	159 Å²	159	74.8 Å²	74.8	74%	0.743	35%	0.351	S	S	*	.	H	α-helix	trans	-79.4	-33.1	-175.2	-59.5	166	-173.6	0	0	112.6	S528 N534	S528-E532 VanDerWaalsContact CB-OE1 3.3Å; S528-E532 WeakPolarHBondContact CB-OE1 3.08Å; S528-E532 WeakPolarHBondContact O-CA 3.5Å; S528-E532 WeakPolarHBondContact O-CB 3.16Å; S528-E532 WeakPolarHBondContact O-CG 3.21Å; S528-E532 PolarHBondContact O-N 3.43Å; E532-N534 VanDerWaalsContact C-N 3.31Å; E532-N534 PolarHBondContact O-N 3.28Å
533	S	68.2	Low	84.3	Confident	42 Å²	42	74.9 Å²	74.9	29%	0.294	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	10	-178.2	78.9	0	0	0	0	114.5	R529 S535	R529-S533 WeakPolarHBondContact O-CB 3.46Å; R529-S533 PolarHBondContact O-N 2.64Å; R529-S533 PolarHBondContact O-OG 2.94Å; S533-S535 PolarHBondContact O-N 3.13Å; S533-S535 PolarHBondContact O-OG 3.14Å; S533-S535 WeakPolarHBondContact OG-CB 3.43Å; S533-S535 PolarHBondContact OG-OG 3Å
534	N	66.9	Low	84.1	Confident	120 Å²	120	73.3 Å²	73.3	64%	0.642	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	29.7	-177.3	-164.7	35.8	0	0	0	113.6	E532	E532-N534 VanDerWaalsContact C-N 3.31Å; E532-N534 PolarHBondContact O-N 3.28Å
535	S	74.5	Confident	83.9	Confident	49 Å²	49	65.8 Å²	65.8	34%	0.343	33%	0.327	S	S	.	.			trans	-103.9	110.1	-174.3	-66.6	0	0	0	0	107.4	L530 S533 S537	L530-S535 WeakPolarHBondContact CD2-O 3.35Å; S533-S535 PolarHBondContact O-N 3.13Å; S533-S535 PolarHBondContact O-OG 3.14Å; S533-S535 WeakPolarHBondContact OG-CB 3.43Å; S533-S535 PolarHBondContact OG-OG 3Å; S535-S537 PolarHBondContact O-N 3.03Å; S535-S537 VanDerWaalsContact O-N 3.1Å
536	Y	79.6	Confident	83.3	Confident	185 Å²	185	71.3 Å²	71.3	73%	0.725	36%	0.359	S	S	*	.	S	Bend	trans	-64.7	-15.1	-176.2	-59.7	-71.7	0	0	0	113.9	T583	Y536-T583 WeakPolarHBondContact O-CB 3.23Å; Y536-T583 WeakPolarHBondContact O-CG2 3.46Å
537	S	86.6	Confident	82.9	Confident	51 Å²	51	75 Å²	75	36%	0.357	40%	0.397	S	S	.	.			trans	-143.2	148.6	179.5	56.5	0	0	0	0	112.7	S535 I582	S535-S537 PolarHBondContact O-N 3.03Å; S535-S537 VanDerWaalsContact O-N 3.1Å; S537-I582 CarbonylContact C-O 3.47Å; S537-I582 VanDerWaalsContact CA-O 3.29Å; S537-I582 WeakPolarHBondContact CA-O 3.3Å
538	I	90.1	Very high	82.8	Confident	8 Å²	8	71.1 Å²	71.1	4%	0.041	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129	170	-70.4	171.3	0	0	0	109.8	R529 L530 N542 L543 I582	R529-I538 HydrophobicContact CB-CD1 3.48Å; R529-I538 VanDerWaalsContact CB-CD1 3.48Å; R529-I538 HydrophobicContact CG-CD1 3.35Å; R529-I538 HydrophobicContact CG-CG1 4.2Å; L530-I538 HydrophobicContact CD1-CD1 4.46Å; L530-I538 HydrophobicContact CD2-CB 4.28Å; L530-I538 HydrophobicContact CD2-CD1 3.81Å; L530-I538 HydrophobicContact CD2-CG1 3.64Å; L530-I538 HydrophobicContact CG-CD1 3.6Å; L530-I538 HydrophobicContact CG-CG1 4.03Å; I538-N542 HydrophobicContact CG2-CB 3.84Å; I538-L543 HydrophobicContact CG2-CD1 3.76Å; I538-I582 PolarHBondContact N-O 3.19Å; I538-I582 WeakPolarHBondContact O-CB 3.31Å; I538-I582 PolarHBondContact O-N 3.17Å
539	D	91.2	Very high	83.1	Confident	58 Å²	58	74.1 Å²	74.1	31%	0.31	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	139.3	171.9	-55.6	43.3	0	0	0	110.5	E541 N542 I580 L581	D539-E541 PolarHBondContact O-N 3.05Å; D539-E541 VanDerWaalsContact O-N 3.09Å; D539-N542 PolarHBondContact N-ND2 3.23Å; D539-N542 VanDerWaalsContact O-CB 3.32Å; D539-N542 WeakPolarHBondContact O-CB 3.36Å; D539-N542 PolarHBondContact O-N 3.2Å; D539-N542 PolarHBondContact O-ND2 3.21Å; D539-N542 VanDerWaalsContact O-ND2 3.1Å; D539-I580 WeakPolarHBondContact CA-O 3.49Å; D539-L581 HydrophobicContact CB-CD2 4.32Å; D539-L581 VanDerWaalsContact CG-CD2 3.44Å; D539-L581 VanDerWaalsContact OD1-CD2 3.29Å; D539-L581 WeakPolarHBondContact OD1-CD2 3.45Å
540	I	91	Very high	83.4	Confident	29 Å²	29	77 Å²	77	15%	0.149	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-55.3	-29.7	-178.9	-164.7	167.1	0	0	0	113.6	N542 L543 C544 F557 L560 I580 I582	I540-N542 PolarHBondContact O-N 2.79Å; I540-L543 WeakPolarHBondContact O-CB 3.27Å; I540-L543 PolarHBondContact O-N 2.97Å; I540-C544 PolarHBondContact O-N 3.27Å; I540-F557 HydrophobicContact CD1-CD2 4.02Å; I540-L560 HydrophobicContact CD1-CD1 3.72Å; I540-L560 HydrophobicContact CG1-CD1 3.96Å; I540-I580 HydrophobicContact CB-CB 4.18Å; I540-I580 HydrophobicContact CD1-CD1 4.34Å; I540-I580 HydrophobicContact CG2-CB 3.9Å; I540-I580 HydrophobicContact CG2-CG1 4.42Å; I540-I580 PolarHBondContact N-O 3.17Å; I540-I582 HydrophobicContact CB-CD1 4.37Å
541	E	88.6	Confident	83.8	Confident	104 Å²	104	85 Å²	85	49%	0.486	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-60.3	-26.4	176.3	-62.9	-178.2	-169.2	0	0	112.9	D539 L543 C544 P545	D539-E541 PolarHBondContact O-N 3.05Å; D539-E541 VanDerWaalsContact O-N 3.09Å; E541-L543 VanDerWaalsContact C-N 3.26Å; E541-L543 PolarHBondContact O-N 3.08Å; E541-C544 CarbonylContact O-C 3.55Å; E541-C544 VanDerWaalsContact O-C 3.31Å; E541-C544 PolarHBondContact O-N 3.22Å; E541-P545 WeakPolarHBondContact O-CA 2.97Å; E541-P545 VanDerWaalsContact O-N 3.16Å
542	N	86.6	Confident	84.4	Confident	72 Å²	72	81 Å²	81	39%	0.385	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-69.8	-23.7	174.8	-68.1	-74.7	0	0	0	113.4	K514 I538 D539 I540	K514-N542 PolarHBondContact NZ-O 2.91Å; I538-N542 HydrophobicContact CG2-CB 3.84Å; D539-N542 PolarHBondContact N-ND2 3.23Å; D539-N542 VanDerWaalsContact O-CB 3.32Å; D539-N542 WeakPolarHBondContact O-CB 3.36Å; D539-N542 PolarHBondContact O-N 3.2Å; D539-N542 PolarHBondContact O-ND2 3.21Å; D539-N542 VanDerWaalsContact O-ND2 3.1Å; I540-N542 PolarHBondContact O-N 2.79Å
543	L	87.6	Confident	85.4	Confident	1 Å²	1	75 Å²	75	1%	0.005	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-34.4	174.5	-60.1	106.1	0	0	0	111.5	F516 L522 Y525 L526 I538 I540 E541 V556 I582	F516-L543 HydrophobicContact CE2-CB 4.27Å; L522-L543 HydrophobicContact CD1-CD2 3.57Å; L522-L543 HydrophobicContact CG-CD2 4.37Å; Y525-L543 HydrophobicContact CD1-CD2 4Å; Y525-L543 HydrophobicContact CD1-CG 4.38Å; Y525-L543 HydrophobicContact CE1-CD2 4.24Å; Y525-L543 HydrophobicContact CE1-CG 4.12Å; L526-L543 HydrophobicContact CD1-CD2 4.45Å; L526-L543 HydrophobicContact CD2-CD1 4.2Å; L526-L543 HydrophobicContact CD2-CD2 3.69Å; L526-L543 HydrophobicContact CG-CD2 3.87Å; I538-L543 HydrophobicContact CG2-CD1 3.76Å; I540-L543 WeakPolarHBondContact O-CB 3.27Å; I540-L543 PolarHBondContact O-N 2.97Å; E541-L543 VanDerWaalsContact C-N 3.26Å; E541-L543 PolarHBondContact O-N 3.08Å; L543-V556 HydrophobicContact CB-CG1 4.04Å; L543-I582 HydrophobicContact CD1-CD1 3.42Å; L543-I582 VanDerWaalsContact CD1-CD1 3.42Å
544	C	88.4	Confident	86.6	Confident	26 Å²	26	75.7 Å²	75.7	18%	0.176	42%	0.415	C	S	.	.	S	Bend	trans	-134.9	80.6	-173.3	-178.7	0	0	0	0	109	I540 E541 S548 A553	I540-C544 PolarHBondContact O-N 3.27Å; E541-C544 CarbonylContact O-C 3.55Å; E541-C544 VanDerWaalsContact O-C 3.31Å; E541-C544 PolarHBondContact O-N 3.22Å; C544-S548 PolarHBondContact SG-OG 3.27Å; C544-A553 VanDerWaalsContact SG-CA 3.51Å; C544-A553 WeakPolarHBondContact SG-CB 3.4Å
545	P	86.1	Confident	87.9	Confident	47 Å²	47	72.2 Å²	72.2	31%	0.305	39%	0.394	S	S	.	.			trans	-62.4	152.3	178.7	-23.2	34.6	0	0	0	111.9	E541 G547 S548	E541-P545 WeakPolarHBondContact O-CA 2.97Å; E541-P545 VanDerWaalsContact O-N 3.16Å; P545-G547 PolarHBondContact O-N 3.18Å; P545-G547 VanDerWaalsContact O-N 3.09Å; P545-S548 WeakPolarHBondContact O-CB 3.17Å; P545-S548 PolarHBondContact O-N 3.34Å; P545-S548 PolarHBondContact O-OG 3.36Å
546	L	78	Confident	88.9	Confident	163 Å²	163	69.9 Å²	69.9	85%	0.853	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	111.8	170.1	-71	149.5	0	0	0	109.1
547	G	81.1	Confident	89.6	Confident	77 Å²	77	65.6 Å²	65.6	79%	0.794	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.1	-15.7	-172.4	0	0	0	0	0	114.4	P545	P545-G547 PolarHBondContact O-N 3.18Å; P545-G547 VanDerWaalsContact O-N 3.09Å
548	S	86.2	Confident	90	Very high	31 Å²	31	68.1 Å²	68.1	22%	0.217	37%	0.37	C	S	.	.	S	Bend	trans	-69.3	145.6	176.6	56.2	0	0	0	0	113.2	C544 P545 K550	C544-S548 PolarHBondContact SG-OG 3.27Å; P545-S548 WeakPolarHBondContact O-CB 3.17Å; P545-S548 PolarHBondContact O-N 3.34Å; P545-S548 PolarHBondContact O-OG 3.36Å; S548-K550 PolarHBondContact O-N 3.38Å
549	N	90.3	Very high	90.3	Very high	94 Å²	94	67.8 Å²	67.8	50%	0.503	37%	0.369	S	S	.	.			trans	-50.6	135.3	-176.9	-77.3	-40.7	0	0	0	113.6	K551 Q552 A553	N549-K551 PolarHBondContact O-N 3.23Å; N549-K551 VanDerWaalsContact O-N 3.09Å; N549-Q552 HydrophobicContact CB-CB 4.24Å; N549-Q552 WeakPolarHBondContact O-CA 3.5Å; N549-Q552 VanDerWaalsContact O-CB 3.3Å; N549-Q552 WeakPolarHBondContact O-CB 3.33Å; N549-Q552 PolarHBondContact O-N 3.41Å; N549-A553 PolarHBondContact O-N 3.17Å
550	K	92.8	Very high	90.4	Very high	190 Å²	190	65 Å²	65	83%	0.826	35%	0.354	S	S	*	.	H	α-helix	trans	-50.4	-38.7	178.1	-175.6	178.8	-179.4	-179.9	0	113.3	S548 A554	S548-K550 PolarHBondContact O-N 3.38Å; K550-A554 WeakPolarHBondContact O-CB 3.27Å; K550-A554 PolarHBondContact O-N 3.33Å
551	K	92.8	Very high	90.7	Very high	184 Å²	184	67.7 Å²	67.7	80%	0.8	37%	0.368	S	S	*	.	H	α-helix	trans	-62.6	-40.6	174.4	-174.1	177.5	-179.7	179.4	0	112.3	N549 F555	N549-K551 PolarHBondContact O-N 3.23Å; N549-K551 VanDerWaalsContact O-N 3.09Å; K551-F555 WeakPolarHBondContact O-CB 3.3Å; K551-F555 PolarHBondContact O-N 3.43Å
552	Q	93	Very high	91	Very high	11 Å²	11	65.6 Å²	65.6	5%	0.051	36%	0.358	C	S	.	.	H	α-helix	trans	-70.4	-44.3	178.2	-168.8	57.3	30.5	0	0	111.6	H515 F516 N549 A554 F555 V556	H515-Q552 PolarHBondContact CD2-OE1 3.43Å; H515-Q552 PolarHBondContact CE1-OE1 3.25Å; H515-Q552 PolarHBondContact NE2-OE1 3.11Å; F516-Q552 PolarHBondContact O-NE2 3.24Å; F516-Q552 PolarHBondContact O-OE1 3.35Å; N549-Q552 HydrophobicContact CB-CB 4.24Å; N549-Q552 WeakPolarHBondContact O-CA 3.5Å; N549-Q552 VanDerWaalsContact O-CB 3.3Å; N549-Q552 WeakPolarHBondContact O-CB 3.33Å; N549-Q552 PolarHBondContact O-N 3.41Å; Q552-A554 PolarHBondContact O-N 3.39Å; Q552-F555 PolarHBondContact O-N 2.81Å; Q552-V556 WeakPolarHBondContact O-CG2 3.29Å; Q552-V556 PolarHBondContact O-N 3.3Å
553	A	93.5	Very high	91.4	Very high	32 Å²	32	62.7 Å²	62.7	26%	0.264	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-48.1	174.8	0	0	0	0	0	111.7	C544 N549 F555 V556 F557	C544-A553 VanDerWaalsContact SG-CA 3.51Å; C544-A553 WeakPolarHBondContact SG-CB 3.4Å; N549-A553 PolarHBondContact O-N 3.17Å; A553-F555 PolarHBondContact O-N 2.91Å; A553-V556 PolarHBondContact O-N 3.31Å; A553-F557 VanDerWaalsContact O-CB 3.29Å; A553-F557 WeakPolarHBondContact O-CB 3.43Å; A553-F557 PolarHBondContact O-N 3.47Å
554	A	94.4	Very high	91.7	Very high	58 Å²	58	64.1 Å²	64.1	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-41.8	176.3	0	0	0	0	0	112.5	K550 Q552 M558	K550-A554 WeakPolarHBondContact O-CB 3.27Å; K550-A554 PolarHBondContact O-N 3.33Å; Q552-A554 PolarHBondContact O-N 3.39Å; A554-M558 WeakPolarHBondContact O-CB 3.37Å; A554-M558 PolarHBondContact O-N 3.24Å
555	F	94.3	Very high	92	Very high	46 Å²	46	71.5 Å²	71.5	20%	0.202	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-48.4	176.9	175.8	-98.7	0	0	0	112.5	F516 K519 K551 Q552 A553 T559	F516-F555 HydrophobicContact CB-CE1 4.18Å; F516-F555 WeakPolarHBondContact O-CD1 3.45Å; F516-F555 VanDerWaalsContact O-CE1 3.29Å; F516-F555 WeakPolarHBondContact O-CE1 3.33Å; K519-F555 HydrophobicContact CG-CZ 4.4Å; K551-F555 WeakPolarHBondContact O-CB 3.3Å; K551-F555 PolarHBondContact O-N 3.43Å; Q552-F555 PolarHBondContact O-N 2.81Å; A553-F555 PolarHBondContact O-N 2.91Å; F555-T559 WeakPolarHBondContact O-CB 3.3Å; F555-T559 PolarHBondContact O-N 3.43Å; F555-T559 PolarHBondContact O-OG1 3.02Å
556	V	94.6	Very high	92.3	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-60.5	-49.9	177.3	170.5	0	0	0	0	110.1	F516 L522 L543 Q552 A553 T559 L560	F516-V556 HydrophobicContact CD2-CG2 3.87Å; F516-V556 HydrophobicContact CE2-CG2 4.45Å; L522-V556 HydrophobicContact CD1-CG1 4.23Å; L522-V556 HydrophobicContact CD1-CG2 4.05Å; L522-V556 HydrophobicContact CD2-CG1 4.45Å; L543-V556 HydrophobicContact CB-CG1 4.04Å; Q552-V556 WeakPolarHBondContact O-CG2 3.29Å; Q552-V556 PolarHBondContact O-N 3.3Å; A553-V556 PolarHBondContact O-N 3.31Å; V556-T559 PolarHBondContact O-N 2.99Å; V556-L560 HydrophobicContact CG1-CD1 3.9Å; V556-L560 HydrophobicContact CG1-CG 4.41Å; V556-L560 VanDerWaalsContact O-CG 3.29Å; V556-L560 WeakPolarHBondContact O-CG 3Å; V556-L560 PolarHBondContact O-N 3.4Å
557	F	94.2	Very high	92.9	Very high	96 Å²	96	75.6 Å²	75.6	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-46.3	-179.1	-174.2	-105.9	0	0	0	112.6	I540 A553 T559 L560 L561 I580	I540-F557 HydrophobicContact CD1-CD2 4.02Å; A553-F557 VanDerWaalsContact O-CB 3.29Å; A553-F557 WeakPolarHBondContact O-CB 3.43Å; A553-F557 PolarHBondContact O-N 3.47Å; F557-T559 VanDerWaalsContact C-N 3.34Å; F557-T559 PolarHBondContact O-N 3.12Å; F557-L560 PolarHBondContact O-N 3.24Å; F557-L561 HydrophobicContact CD1-CD1 4.02Å; F557-L561 HydrophobicContact CE1-CD1 3.6Å; F557-L561 HydrophobicContact CE1-CG 4.27Å; F557-L561 HydrophobicContact CZ-CD1 4.1Å; F557-L561 HydrophobicContact CZ-CD2 4.46Å; F557-L561 HydrophobicContact CZ-CG 4.41Å; F557-L561 WeakPolarHBondContact O-CG 3.45Å; F557-L561 PolarHBondContact O-N 3.44Å; F557-I580 HydrophobicContact CE2-CD1 4.11Å
558	M	95.4	Very high	93.4	Very high	104 Å²	104	77.8 Å²	77.8	51%	0.512	37%	0.372	S	S	.	.	H	α-helix	trans	-61.9	-41.1	177.3	-177.5	-102.8	-70	0	0	112	A554 L561 E562	A554-M558 WeakPolarHBondContact O-CB 3.37Å; A554-M558 PolarHBondContact O-N 3.24Å; M558-L561 PolarHBondContact O-N 3.44Å; M558-E562 PolarHBondContact O-N 3.27Å; M558-E562 VanDerWaalsContact O-N 3.08Å
559	T	95.4	Very high	93.8	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-68.6	-37.5	177.6	-53.7	0	0	0	0	112	K519 L522 F555 V556 F557 E562 F563	K519-T559 HydrophobicContact CB-CG2 3.87Å; K519-T559 HydrophobicContact CD-CG2 4.25Å; K519-T559 HydrophobicContact CG-CG2 3.74Å; L522-T559 HydrophobicContact CD2-CG2 3.61Å; F555-T559 WeakPolarHBondContact O-CB 3.3Å; F555-T559 PolarHBondContact O-N 3.43Å; F555-T559 PolarHBondContact O-OG1 3.02Å; V556-T559 PolarHBondContact O-N 2.99Å; F557-T559 VanDerWaalsContact C-N 3.34Å; F557-T559 PolarHBondContact O-N 3.12Å; T559-E562 WeakPolarHBondContact O-CB 3.32Å; T559-E562 PolarHBondContact O-N 2.84Å; T559-F563 HydrophobicContact CG2-CD2 4.29Å; T559-F563 HydrophobicContact CG2-CE1 3.95Å; T559-F563 HydrophobicContact CG2-CE2 3.68Å; T559-F563 HydrophobicContact CG2-CZ 3.48Å; T559-F563 VanDerWaalsContact CG2-CZ 3.48Å; T559-F563 WeakPolarHBondContact O-CG 3.41Å; T559-F563 PolarHBondContact O-N 3.4Å
560	L	95	Very high	93.9	Very high	1 Å²	1	76.3 Å²	76.3	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-61.7	-43.6	172.5	-73	169.8	0	0	0	111.7	L526 I540 V556 F557 E562 F563 A564 I569 L571 I582	L526-L560 HydrophobicContact CD1-CD2 3.74Å; I540-L560 HydrophobicContact CD1-CD1 3.72Å; I540-L560 HydrophobicContact CG1-CD1 3.96Å; V556-L560 HydrophobicContact CG1-CD1 3.9Å; V556-L560 HydrophobicContact CG1-CG 4.41Å; V556-L560 VanDerWaalsContact O-CG 3.29Å; V556-L560 WeakPolarHBondContact O-CG 3Å; V556-L560 PolarHBondContact O-N 3.4Å; F557-L560 PolarHBondContact O-N 3.24Å; L560-E562 VanDerWaalsContact C-N 3.29Å; L560-E562 PolarHBondContact O-N 3.22Å; L560-F563 PolarHBondContact O-N 2.9Å; L560-A564 WeakPolarHBondContact O-CB 3.4Å; L560-A564 PolarHBondContact O-N 2.8Å; L560-I569 HydrophobicContact CB-CD1 4.29Å; L560-I569 HydrophobicContact CD2-CD1 3.58Å; L560-I569 WeakPolarHBondContact O-CD1 3.48Å; L560-L571 HydrophobicContact CB-CD1 4.44Å; L560-L571 HydrophobicContact CB-CD2 4.5Å; L560-I582 HydrophobicContact CD1-CD1 3.78Å; L560-I582 HydrophobicContact CD1-CG1 4.44Å; L560-I582 HydrophobicContact CD2-CD1 3.81Å; L560-I582 HydrophobicContact CD2-CG1 4.21Å; L560-I582 HydrophobicContact CD2-CG2 4.29Å; L560-I582 HydrophobicContact CG-CD1 4.49Å
561	L	95.7	Very high	94	Very high	84 Å²	84	69.7 Å²	69.7	44%	0.44	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-36.7	175.1	-68.6	178.2	0	0	0	112.3	F557 M558 A564 K565 L571	F557-L561 HydrophobicContact CD1-CD1 4.02Å; F557-L561 HydrophobicContact CE1-CD1 3.6Å; F557-L561 HydrophobicContact CE1-CG 4.27Å; F557-L561 HydrophobicContact CZ-CD1 4.1Å; F557-L561 HydrophobicContact CZ-CD2 4.46Å; F557-L561 HydrophobicContact CZ-CG 4.41Å; F557-L561 WeakPolarHBondContact O-CG 3.45Å; F557-L561 PolarHBondContact O-N 3.44Å; M558-L561 PolarHBondContact O-N 3.44Å; L561-A564 PolarHBondContact O-N 3.28Å; L561-K565 VanDerWaalsContact O-CB 3.29Å; L561-K565 WeakPolarHBondContact O-CB 3.25Å; L561-K565 PolarHBondContact O-N 3.49Å; L561-L571 HydrophobicContact CD2-CD1 4.08Å
562	E	95.6	Very high	94	Very high	61 Å²	61	63.4 Å²	63.4	29%	0.285	31%	0.314	S	S	.	.	H	α-helix	trans	-67.4	-42.8	174.5	-173.4	178.9	-177.4	0	0	112.4	K519 M558 T559 L560 A564 K565 N566	K519-E562 WeakPolarHBondContact CE-OE2 3.47Å; K519-E562 IonicContact NZ-OE1 2.76Å; K519-E562 PolarHBondContact NZ-OE1 3.22Å; K519-E562 IonicContact NZ-OE2 3.02Å; K519-E562 PolarHBondContact NZ-OE2 3.2Å; M558-E562 PolarHBondContact O-N 3.27Å; M558-E562 VanDerWaalsContact O-N 3.08Å; T559-E562 WeakPolarHBondContact O-CB 3.32Å; T559-E562 PolarHBondContact O-N 2.84Å; L560-E562 VanDerWaalsContact C-N 3.29Å; L560-E562 PolarHBondContact O-N 3.22Å; E562-A564 VanDerWaalsContact C-N 3.33Å; E562-A564 PolarHBondContact O-N 3.37Å; E562-K565 PolarHBondContact O-N 3.48Å; E562-N566 VanDerWaalsContact O-CB 3.31Å; E562-N566 WeakPolarHBondContact O-CB 3.46Å; E562-N566 PolarHBondContact O-N 3.12Å; E562-N566 PolarHBondContact O-ND2 3.26Å
563	F	94.7	Very high	94.1	Very high	11 Å²	11	67.4 Å²	67.4	5%	0.048	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-37	174.1	-65.4	-20.7	0	0	0	112.5	K519 L522 W523 L526 T559 L560 N566 R567 R568 I569	K519-F563 HydrophobicContact CB-CZ 4.27Å; L522-F563 HydrophobicContact CD2-CE2 4.22Å; W523-F563 HydrophobicContact CB-CE2 4.05Å; W523-F563 HydrophobicContact CB-CZ 3.76Å; W523-F563 AromaticContact CE3-CD2 3.94Å; W523-F563 HydrophobicContact CE3-CD2 3.94Å; W523-F563 AromaticContact CE3-CE2 3.93Å; W523-F563 HydrophobicContact CE3-CE2 3.93Å; W523-F563 HydrophobicContact CE3-CG 4.3Å; W523-F563 HydrophobicContact CE3-CZ 4.29Å; W523-F563 HydrophobicContact CZ3-CD2 4.49Å; L526-F563 HydrophobicContact CD1-CD2 4.09Å; L526-F563 HydrophobicContact CD1-CE2 4.14Å; T559-F563 HydrophobicContact CG2-CD2 4.29Å; T559-F563 HydrophobicContact CG2-CE1 3.95Å; T559-F563 HydrophobicContact CG2-CE2 3.68Å; T559-F563 HydrophobicContact CG2-CZ 3.48Å; T559-F563 VanDerWaalsContact CG2-CZ 3.48Å; T559-F563 WeakPolarHBondContact O-CG 3.41Å; T559-F563 PolarHBondContact O-N 3.4Å; L560-F563 PolarHBondContact O-N 2.9Å; F563-N566 CarbonylContact O-C 3.5Å; F563-N566 PolarHBondContact O-N 2.93Å; F563-R567 PolarHBondContact O-N 3.42Å; F563-R568 HydrophobicContact CB-CB 4.46Å; F563-R568 PolarHBondContact O-N 3.48Å; F563-I569 HydrophobicContact CB-CD1 3.7Å; F563-I569 HydrophobicContact CB-CG1 3.78Å; F563-I569 HydrophobicContact CB-CG2 4.45Å; F563-I569 HydrophobicContact CD2-CD1 4.47Å
564	A	94.4	Very high	94.1	Very high	31 Å²	31	70.9 Å²	70.9	26%	0.256	36%	0.355	S	S	.	.	H	α-helix	trans	-67.4	-45.7	174.4	0	0	0	0	0	111.6	L560 L561 E562 N566 R567 I569 L571	L560-A564 WeakPolarHBondContact O-CB 3.4Å; L560-A564 PolarHBondContact O-N 2.8Å; L561-A564 PolarHBondContact O-N 3.28Å; E562-A564 VanDerWaalsContact C-N 3.33Å; E562-A564 PolarHBondContact O-N 3.37Å; A564-N566 VanDerWaalsContact C-N 3.25Å; A564-N566 PolarHBondContact O-N 3Å; A564-R567 PolarHBondContact O-N 3.27Å; A564-I569 HydrophobicContact CB-CG1 4.11Å; A564-L571 HydrophobicContact CB-CD1 4.02Å; A564-L571 HydrophobicContact CB-CG 4.18Å
565	K	94.5	Very high	94	Very high	180 Å²	180	73.9 Å²	73.9	78%	0.783	36%	0.361	S	S	*	.	H	α-helix	trans	-57.2	-39.1	173.5	-179.7	-177.8	177	-176.1	0	112.1	L561 E562 R567	L561-K565 VanDerWaalsContact O-CB 3.29Å; L561-K565 WeakPolarHBondContact O-CB 3.25Å; L561-K565 PolarHBondContact O-N 3.49Å; E562-K565 PolarHBondContact O-N 3.48Å; K565-R567 PolarHBondContact O-N 2.9Å
566	N	92.8	Very high	93.9	Very high	89 Å²	89	75.2 Å²	75.2	48%	0.476	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	8	177.4	-66.7	-18.2	0	0	0	113.7	E562 F563 A564 R568	E562-N566 VanDerWaalsContact O-CB 3.31Å; E562-N566 WeakPolarHBondContact O-CB 3.46Å; E562-N566 PolarHBondContact O-N 3.12Å; E562-N566 PolarHBondContact O-ND2 3.26Å; F563-N566 CarbonylContact O-C 3.5Å; F563-N566 PolarHBondContact O-N 2.93Å; A564-N566 VanDerWaalsContact C-N 3.25Å; A564-N566 PolarHBondContact O-N 3Å; N566-R568 VanDerWaalsContact C-N 3.29Å; N566-R568 PolarHBondContact O-N 3.4Å
567	R	91.1	Very high	93.6	Very high	207 Å²	207	85.2 Å²	85.2	78%	0.781	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.8	179.3	-55.5	-175.8	178.8	-168.8	-0.8	114.3	F563 A564 K565 I585	F563-R567 PolarHBondContact O-N 3.42Å; A564-R567 PolarHBondContact O-N 3.27Å; K565-R567 PolarHBondContact O-N 2.9Å; R567-I585 VanDerWaalsContact C-CD1 3.48Å; R567-I585 HydrophobicContact CB-CD1 4.22Å; R567-I585 VanDerWaalsContact O-CD1 3.25Å; R567-I585 WeakPolarHBondContact O-CD1 3.39Å
568	R	91.2	Very high	93.4	Very high	124 Å²	124	81.7 Å²	81.7	47%	0.468	42%	0.415	S	S	.	.	S	Bend	trans	-95	-29.6	171.6	-64	-171.6	178.1	-168.2	-1.3	113.1	W523 F563 N566 I585	W523-R568 HydrophobicContact CH2-CB 3.78Å; W523-R568 HydrophobicContact CH2-CG 4.49Å; W523-R568 HydrophobicContact CZ3-CB 3.81Å; F563-R568 HydrophobicContact CB-CB 4.46Å; F563-R568 PolarHBondContact O-N 3.48Å; N566-R568 VanDerWaalsContact C-N 3.29Å; N566-R568 PolarHBondContact O-N 3.4Å; R568-I585 PolarHBondContact O-N 2.96Å; R568-I585 VanDerWaalsContact O-N 3.11Å
569	I	93.5	Very high	93.2	Very high	3 Å²	3	79.8 Å²	79.8	2%	0.015	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158.5	178.1	66.6	179.9	0	0	0	111	W523 L560 F563 A564 L571 I582 T583 I584	W523-I569 HydrophobicContact CZ3-CG2 3.82Å; L560-I569 HydrophobicContact CB-CD1 4.29Å; L560-I569 HydrophobicContact CD2-CD1 3.58Å; L560-I569 WeakPolarHBondContact O-CD1 3.48Å; F563-I569 HydrophobicContact CB-CD1 3.7Å; F563-I569 HydrophobicContact CB-CG1 3.78Å; F563-I569 HydrophobicContact CB-CG2 4.45Å; F563-I569 HydrophobicContact CD2-CD1 4.47Å; A564-I569 HydrophobicContact CB-CG1 4.11Å; I569-L571 HydrophobicContact CD1-CD2 3.86Å; I569-L571 HydrophobicContact CD1-CG 4.38Å; I569-L571 HydrophobicContact CG1-CD2 4.47Å; I569-I582 HydrophobicContact CB-CG2 4.29Å; I569-I582 HydrophobicContact CD1-CG2 3.97Å; I569-I582 HydrophobicContact CG2-CG2 4.38Å; I569-T583 CarbonylContact C-O 3.56Å; I569-T583 WeakPolarHBondContact CA-O 3.49Å; I569-T583 VanDerWaalsContact CB-O 3.26Å; I569-T583 WeakPolarHBondContact CB-O 3.27Å; I569-I584 HydrophobicContact CG2-CG1 4.13Å
570	I	93.8	Very high	93.1	Very high	90 Å²	90	81.2 Å²	81.2	46%	0.462	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.3	164.6	-63.8	162.6	0	0	0	107.5	T583 I585	I570-T583 PolarHBondContact N-O 3.34Å; I570-T583 PolarHBondContact O-N 3.12Å; I570-I585 HydrophobicContact CD1-CD1 4.37Å; I570-I585 HydrophobicContact CD1-CG1 3.84Å; I570-I585 HydrophobicContact CG1-CD1 3.83Å; I570-I585 HydrophobicContact CG1-CG1 3.67Å
571	L	94.4	Very high	93	Very high	51 Å²	51	83.9 Å²	83.9	27%	0.267	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.9	171.1	-59	176.4	0	0	0	108	L560 L561 A564 I569 I580 L581 I582	L560-L571 HydrophobicContact CB-CD1 4.44Å; L560-L571 HydrophobicContact CB-CD2 4.5Å; L561-L571 HydrophobicContact CD2-CD1 4.08Å; A564-L571 HydrophobicContact CB-CD1 4.02Å; A564-L571 HydrophobicContact CB-CG 4.18Å; I569-L571 HydrophobicContact CD1-CD2 3.86Å; I569-L571 HydrophobicContact CD1-CG 4.38Å; I569-L571 HydrophobicContact CG1-CD2 4.47Å; L571-I580 HydrophobicContact CD2-CG2 4.45Å; L571-L581 WeakPolarHBondContact CA-O 3.23Å; L571-I582 HydrophobicContact CD2-CB 4.25Å; L571-I582 HydrophobicContact CD2-CG1 3.61Å; L571-I582 HydrophobicContact CD2-CG2 4.25Å
572	S	93.2	Very high	92.9	Very high	53 Å²	53	79.9 Å²	79.9	37%	0.371	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.7	175.1	61.7	0	0	0	0	111.2	L581	S572-L581 PolarHBondContact N-O 2.62Å; S572-L581 PolarHBondContact O-N 2.77Å
573	Q	95.2	Very high	92.8	Very high	95 Å²	95	78.6 Å²	78.6	44%	0.444	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	125.2	-179.1	-176.5	179.3	43.5	0	0	107.2	I575 G578 I580	Q573-I575 WeakPolarHBondContact CG-O 3.28Å; Q573-G578 PolarHBondContact NE2-O 3.25Å; Q573-I580 HydrophobicContact CB-CG1 4.44Å; Q573-I580 HydrophobicContact CG-CG1 4.31Å
574	S	92	Very high	92.5	Very high	105 Å²	105	79.5 Å²	79.5	73%	0.734	41%	0.413	S	S	*	.	S	Bend	trans	-87.3	-27.5	-173.5	52.9	0	0	0	0	113.8
575	I	94	Very high	92.1	Very high	120 Å²	120	81.4 Å²	81.4	62%	0.615	42%	0.418	S	S	*	.	S	Bend	trans	-137.5	138.8	-176.6	-54.9	174.6	0	0	0	107.5	Q573 F577 G578	Q573-I575 WeakPolarHBondContact CG-O 3.28Å; I575-F577 PolarHBondContact O-N 3.4Å; I575-G578 WeakPolarHBondContact O-CA 3.21Å; I575-G578 PolarHBondContact O-N 3.46Å
576	A	90.7	Very high	91.2	Very high	74 Å²	74	83.3 Å²	83.3	61%	0.612	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	133.5	174.5	0	0	0	0	0	110.8	G578	A576-G578 PolarHBondContact O-N 3.08Å; A576-G578 VanDerWaalsContact O-N 3.14Å
577	F	88.6	Confident	91.1	Very high	210 Å²	210	83 Å²	83	92%	0.921	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	10.5	-172.7	-48.6	-81.4	0	0	0	115.6	I575	I575-F577 PolarHBondContact O-N 3.4Å
578	G	89.5	Confident	91.1	Very high	22 Å²	22	76.5 Å²	76.5	23%	0.227	41%	0.408	C	S	.	.	S	Bend	trans	-82.3	-178.2	170.2	0	0	0	0	0	113.3	Q573 I575 A576	Q573-G578 PolarHBondContact NE2-O 3.25Å; I575-G578 WeakPolarHBondContact O-CA 3.21Å; I575-G578 PolarHBondContact O-N 3.46Å; A576-G578 PolarHBondContact O-N 3.08Å; A576-G578 VanDerWaalsContact O-N 3.14Å
579	P	91.1	Very high	91.1	Very high	65 Å²	65	73.8 Å²	73.8	42%	0.422	41%	0.405	S	S	.	.			trans	-60.3	139.8	-178.3	25.5	-34.8	0	0	0	112
580	I	94.1	Very high	91	Very high	29 Å²	29	78 Å²	78	15%	0.149	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.7	177.9	-56.6	174.9	0	0	0	108.1	D539 I540 F557 L571 Q573	D539-I580 WeakPolarHBondContact CA-O 3.49Å; I540-I580 HydrophobicContact CB-CB 4.18Å; I540-I580 HydrophobicContact CD1-CD1 4.34Å; I540-I580 HydrophobicContact CG2-CB 3.9Å; I540-I580 HydrophobicContact CG2-CG1 4.42Å; I540-I580 PolarHBondContact N-O 3.17Å; F557-I580 HydrophobicContact CE2-CD1 4.11Å; L571-I580 HydrophobicContact CD2-CG2 4.45Å; Q573-I580 HydrophobicContact CB-CG1 4.44Å; Q573-I580 HydrophobicContact CG-CG1 4.31Å
581	L	93.8	Very high	90.8	Very high	57 Å²	57	77.3 Å²	77.3	30%	0.298	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.4	178.5	-54.8	179.3	0	0	0	110.3	D539 L571 S572	D539-L581 HydrophobicContact CB-CD2 4.32Å; D539-L581 VanDerWaalsContact CG-CD2 3.44Å; D539-L581 VanDerWaalsContact OD1-CD2 3.29Å; D539-L581 WeakPolarHBondContact OD1-CD2 3.45Å; L571-L581 WeakPolarHBondContact CA-O 3.23Å; S572-L581 PolarHBondContact N-O 2.62Å; S572-L581 PolarHBondContact O-N 2.77Å
582	I	93.9	Very high	90.5	Very high	0 Å²	0	79 Å²	79	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.5	-178.9	-56.7	153.8	0	0	0	108.9	L526 S537 I538 I540 L543 L560 I569 L571	L526-I582 HydrophobicContact CD2-CD1 4.31Å; L526-I582 HydrophobicContact CD2-CG2 3.97Å; S537-I582 CarbonylContact C-O 3.47Å; S537-I582 VanDerWaalsContact CA-O 3.29Å; S537-I582 WeakPolarHBondContact CA-O 3.3Å; I538-I582 PolarHBondContact N-O 3.19Å; I538-I582 WeakPolarHBondContact O-CB 3.31Å; I538-I582 PolarHBondContact O-N 3.17Å; I540-I582 HydrophobicContact CB-CD1 4.37Å; L543-I582 HydrophobicContact CD1-CD1 3.42Å; L543-I582 VanDerWaalsContact CD1-CD1 3.42Å; L560-I582 HydrophobicContact CD1-CD1 3.78Å; L560-I582 HydrophobicContact CD1-CG1 4.44Å; L560-I582 HydrophobicContact CD2-CD1 3.81Å; L560-I582 HydrophobicContact CD2-CG1 4.21Å; L560-I582 HydrophobicContact CD2-CG2 4.29Å; L560-I582 HydrophobicContact CG-CD1 4.49Å; I569-I582 HydrophobicContact CB-CG2 4.29Å; I569-I582 HydrophobicContact CD1-CG2 3.97Å; I569-I582 HydrophobicContact CG2-CG2 4.38Å; L571-I582 HydrophobicContact CD2-CB 4.25Å; L571-I582 HydrophobicContact CD2-CG1 3.61Å; L571-I582 HydrophobicContact CD2-CG2 4.25Å
583	T	92.6	Very high	90.3	Very high	35 Å²	35	80.9 Å²	80.9	22%	0.215	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.9	175	70.2	0	0	0	0	110.3	Y536 I569 I570	Y536-T583 WeakPolarHBondContact O-CB 3.23Å; Y536-T583 WeakPolarHBondContact O-CG2 3.46Å; I569-T583 CarbonylContact C-O 3.56Å; I569-T583 WeakPolarHBondContact CA-O 3.49Å; I569-T583 VanDerWaalsContact CB-O 3.26Å; I569-T583 WeakPolarHBondContact CB-O 3.27Å; I570-T583 PolarHBondContact N-O 3.34Å; I570-T583 PolarHBondContact O-N 3.12Å
584	I	89.2	Confident	90	Very high	30 Å²	30	79.8 Å²	79.8	15%	0.154	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	144	175.5	-84.2	165.4	0	0	0	110.2	W523 Y527 L530 I569	W523-I584 HydrophobicContact CH2-CD1 4.35Å; W523-I584 HydrophobicContact CH2-CG1 4.25Å; Y527-I584 HydrophobicContact CD2-CD1 3.93Å; L530-I584 HydrophobicContact CB-CD1 3.96Å; L530-I584 HydrophobicContact CD1-CB 4.11Å; L530-I584 HydrophobicContact CD1-CD1 3.51Å; L530-I584 HydrophobicContact CD1-CG1 3.48Å; L530-I584 VanDerWaalsContact CD1-CG1 3.48Å; L530-I584 HydrophobicContact CG-CD1 4.33Å; I569-I584 HydrophobicContact CG2-CG1 4.13Å
585	I	84.8	Confident	89.8	Confident	71 Å²	71	77.7 Å²	77.7	36%	0.364	42%	0.416	S	S	.	.			trans	-83.2	117.9	169.2	-64.6	164.4	0	0	0	107.8	R567 R568 I570	R567-I585 VanDerWaalsContact C-CD1 3.48Å; R567-I585 HydrophobicContact CB-CD1 4.22Å; R567-I585 VanDerWaalsContact O-CD1 3.25Å; R567-I585 WeakPolarHBondContact O-CD1 3.39Å; R568-I585 PolarHBondContact O-N 2.96Å; R568-I585 VanDerWaalsContact O-N 3.11Å; I570-I585 HydrophobicContact CD1-CD1 4.37Å; I570-I585 HydrophobicContact CD1-CG1 3.84Å; I570-I585 HydrophobicContact CG1-CD1 3.83Å; I570-I585 HydrophobicContact CG1-CG1 3.67Å
586	H	75.6	Confident	89.4	Confident	219 Å²	219	73.8 Å²	73.8	100%	1.014	40%	0.398	S	S	*	.			trans	-84.8	0	171.2	-80.9	-76.7	0	0	0	111.9

Retrieved 586 of 586 residues in 393 ms (Link to these results)

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