G4VM64_SCHMA Loading...

Krueppel-like factor 10

AlphaFold DB , UniProt , Accession G4VM64, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 526 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	31.7	Very low	184 Å²	184	136.7 Å²	136.7	91%	0.906	79%	0.788	S	S	*	*				0	142.3	0	-73.4	-169.2	-78.8	0	0	109.2	I3	M1-I3 PolarHBondContact O-N 3.4Å
2	G	33.4	Very low	31.2	Very low	88 Å²	88	132.4 Å²	132.4	91%	0.907	80%	0.795	S	S	*	*			trans	-81.6	96.5	175.1	0	0	0	0	0	111.9
3	I	34.4	Very low	31	Very low	115 Å²	115	129.5 Å²	129.5	59%	0.59	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-80.8	116.5	165.5	-57.4	176.6	0	0	0	106.6	M1	M1-I3 PolarHBondContact O-N 3.4Å
4	A	34.2	Very low	30.4	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73	129.1	169.1	0	0	0	0	0	108.4	E6	A4-E6 PolarHBondContact O-N 3.14Å
5	Y	34.5	Very low	30.4	Very low	202 Å²	202	131.3 Å²	131.3	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-62.4	119.9	166.6	-84.8	-102.7	0	0	0	108.4	S7	Y5-S7 PolarHBondContact O-N 3.47Å
6	E	31.9	Very low	30	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.4	123.9	163.9	-70.2	-170.1	131.5	0	0	108.3	A4 I8	A4-E6 PolarHBondContact O-N 3.14Å; E6-I8 PolarHBondContact O-N 3.38Å
7	S	33.9	Very low	29.8	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	80%	0.8	S	S	*	*			trans	-64.7	107.8	178.1	-53.7	0	0	0	0	109.9	Y5 S9	Y5-S7 PolarHBondContact O-N 3.47Å; S7-S9 PolarHBondContact O-N 3.17Å
8	I	28	Very low	29.5	Very low	153 Å²	153	127.1 Å²	127.1	79%	0.785	79%	0.792	S	S	*	*			trans	-72.4	83.6	170.4	-56.5	178.4	0	0	0	107.9	E6 L10	E6-I8 PolarHBondContact O-N 3.38Å; I8-L10 VanDerWaalsContact C-N 3.33Å; I8-L10 PolarHBondContact O-N 3.23Å
9	S	29.7	Very low	29.4	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	80%	0.795	S	S	*	*			trans	-70.9	85.9	177	-64.6	0	0	0	0	110.7	S7 P11	S7-S9 PolarHBondContact O-N 3.17Å; S9-P11 WeakPolarHBondContact O-CD 3.41Å
10	L	28	Very low	29.4	Very low	155 Å²	155	131.6 Å²	131.6	81%	0.812	80%	0.796	S	S	*	*			trans	-67.7	120.9	165.2	-80.8	162	0	0	0	109.4	I8	I8-L10 VanDerWaalsContact C-N 3.33Å; I8-L10 PolarHBondContact O-N 3.23Å
11	P	27.6	Very low	29.5	Very low	126 Å²	126	133.8 Å²	133.8	82%	0.818	80%	0.797	S	S	*	*			trans	-80.1	140.5	178.2	31.9	-33.5	0	0	0	111.4	S9	S9-P11 WeakPolarHBondContact O-CD 3.41Å
12	G	26.1	Very low	29.6	Very low	85 Å²	85	130.4 Å²	130.4	88%	0.876	78%	0.782	S	S	*	*			trans	103.5	41.4	160.7	0	0	0	0	0	118
13	A	28.8	Very low	29.9	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	77%	0.766	S	S	*	*			trans	-131.9	98.2	165.3	0	0	0	0	0	111.1
14	T	23.2	Very low	30.1	Very low	146 Å²	146	133.3 Å²	133.3	90%	0.896	77%	0.773	S	S	*	*			trans	-85.6	106	170.9	49.2	0	0	0	0	109.9
15	V	29.3	Very low	30.2	Very low	139 Å²	139	135.8 Å²	135.8	84%	0.842	77%	0.773	S	S	*	*			trans	-130.1	125.2	165.4	-175.4	0	0	0	0	107.5
16	D	23.8	Very low	30.6	Very low	147 Å²	147	130.9 Å²	130.9	79%	0.786	76%	0.758	S	S	*	*			trans	-92.4	163.7	-179.4	-164.5	2.2	0	0	0	110.5
17	S	26.8	Very low	31	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	73%	0.734	S	S	*	*	S	Bend	trans	69	126.8	173.8	72.4	0	0	0	0	119.4
18	G	25.1	Very low	31.3	Very low	64 Å²	64	121.3 Å²	121.3	66%	0.66	72%	0.716	S	S	*	*			trans	75.4	82.1	134.5	0	0	0	0	0	119.9
19	F	27.6	Very low	32	Very low	192 Å²	192	120.2 Å²	120.2	84%	0.842	71%	0.707	S	S	*	*			trans	-141.4	86.7	156.7	-90.4	-80	0	0	0	111.4
20	D	29.1	Very low	32.8	Very low	152 Å²	152	119.2 Å²	119.2	81%	0.813	70%	0.697	S	S	*	*			trans	-82.5	152.8	165.8	-67.7	-61.4	0	0	0	111.1	I22	D20-I22 PolarHBondContact O-N 3.05Å
21	E	32.3	Very low	33.4	Very low	177 Å²	177	116.1 Å²	116.1	83%	0.827	68%	0.68	S	S	*	*			trans	40.9	65.3	166.4	-59.6	-161.4	139.5	0	0	118.6	N23	E21-N23 PolarHBondContact O-N 3.19Å; E21-N23 VanDerWaalsContact O-N 3.13Å
22	I	35.1	Very low	34.1	Very low	113 Å²	113	114.6 Å²	114.6	58%	0.579	67%	0.665	S	S	*	*			trans	-67.9	107.9	156	-59	178.3	0	0	0	108.4	D20 Q26 A27	D20-I22 PolarHBondContact O-N 3.05Å; I22-Q26 HydrophobicContact CG2-CB 3.93Å; I22-A27 HydrophobicContact CG2-CB 4.49Å
23	N	38.2	Very low	34.8	Very low	106 Å²	106	114.5 Å²	114.5	57%	0.567	65%	0.651	S	S	*	*			trans	-65.8	151.3	179.8	-107.9	-69.2	0	0	0	112.2	E21 L25 Q26 A27	E21-N23 PolarHBondContact O-N 3.19Å; E21-N23 VanDerWaalsContact O-N 3.13Å; N23-L25 PolarHBondContact O-N 3.35Å; N23-Q26 PolarHBondContact O-N 3.46Å; N23-A27 PolarHBondContact O-N 3.42Å
24	E	38.3	Very low	35.2	Very low	158 Å²	158	116.2 Å²	116.2	74%	0.738	65%	0.646	S	S	*	*	H	α-helix	trans	-52.1	-33.8	-177.8	-74.8	-160.1	137.9	0	0	113	A28	E24-A28 WeakPolarHBondContact O-CB 3.45Å; E24-A28 PolarHBondContact O-N 3.12Å
25	L	38.2	Very low	35.9	Very low	138 Å²	138	112.3 Å²	112.3	72%	0.723	63%	0.629	S	S	*	*	H	α-helix	trans	-62.7	-43.5	176.4	-78.4	162.6	0	0	0	113	N23 A28 E29	N23-L25 PolarHBondContact O-N 3.35Å; L25-A28 WeakPolarHBondContact O-CB 3.34Å; L25-A28 PolarHBondContact O-N 3.4Å; L25-E29 WeakPolarHBondContact O-CG 3.21Å; L25-E29 PolarHBondContact O-N 3.09Å
26	Q	41.7	Very low	36.4	Very low	100 Å²	100	113.4 Å²	113.4	47%	0.467	62%	0.622	S	S	.	*	H	α-helix	trans	-71.9	-37.2	179.6	-69.8	172.3	-48.1	0	0	111.3	I22 N23 A28 E29 V30	I22-Q26 HydrophobicContact CG2-CB 3.93Å; N23-Q26 PolarHBondContact O-N 3.46Å; Q26-A28 VanDerWaalsContact C-N 3.29Å; Q26-A28 PolarHBondContact O-N 3.42Å; Q26-E29 PolarHBondContact O-N 3.47Å; Q26-V30 WeakPolarHBondContact O-CG2 3.38Å; Q26-V30 PolarHBondContact O-N 3.33Å
27	A	41	Very low	36.6	Very low	42 Å²	42	108.6 Å²	108.6	35%	0.347	61%	0.608	S	S	.	*	H	α-helix	trans	-60.3	-40.9	170.2	0	0	0	0	0	111.4	I22 N23 L31	I22-A27 HydrophobicContact CG2-CB 4.49Å; N23-A27 PolarHBondContact O-N 3.42Å; A27-L31 WeakPolarHBondContact O-CB 3.45Å; A27-L31 VanDerWaalsContact O-CG 3.3Å; A27-L31 WeakPolarHBondContact O-CG 3.43Å; A27-L31 PolarHBondContact O-N 3.23Å
28	A	40.3	Very low	36.6	Very low	44 Å²	44	109 Å²	109	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-65.6	-39.2	174.5	0	0	0	0	0	112.8	E24 L25 Q26 L31 L32	E24-A28 WeakPolarHBondContact O-CB 3.45Å; E24-A28 PolarHBondContact O-N 3.12Å; L25-A28 WeakPolarHBondContact O-CB 3.34Å; L25-A28 PolarHBondContact O-N 3.4Å; Q26-A28 VanDerWaalsContact C-N 3.29Å; Q26-A28 PolarHBondContact O-N 3.42Å; A28-L31 PolarHBondContact O-N 3.26Å; A28-L32 VanDerWaalsContact O-CB 3.3Å; A28-L32 WeakPolarHBondContact O-CB 3.49Å; A28-L32 PolarHBondContact O-N 3.37Å
29	E	42.2	Very low	36.7	Very low	129 Å²	129	113.3 Å²	113.3	60%	0.603	62%	0.617	S	S	*	*	H	α-helix	trans	-66.2	-40.8	175.9	-75.2	-172.9	132.9	0	0	113	L25 Q26 L32 S33	L25-E29 WeakPolarHBondContact O-CG 3.21Å; L25-E29 PolarHBondContact O-N 3.09Å; Q26-E29 PolarHBondContact O-N 3.47Å; E29-L32 PolarHBondContact O-N 3.28Å; E29-S33 WeakPolarHBondContact O-CB 3.27Å; E29-S33 PolarHBondContact O-N 3.37Å; E29-S33 PolarHBondContact O-OG 3.5Å
30	V	46.4	Very low	36.6	Very low	88 Å²	88	113.4 Å²	113.4	53%	0.533	62%	0.617	S	S	.	*	H	α-helix	trans	-62.8	-44.5	174.1	171.7	0	0	0	0	110.5	Q26 S33 L34	Q26-V30 WeakPolarHBondContact O-CG2 3.38Å; Q26-V30 PolarHBondContact O-N 3.33Å; V30-S33 WeakPolarHBondContact O-CB 3.29Å; V30-S33 PolarHBondContact O-N 3.26Å; V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.29Å; V30-L34 PolarHBondContact O-N 3.49Å
31	L	40.3	Very low	36.5	Very low	89 Å²	89	111.9 Å²	111.9	47%	0.466	62%	0.615	S	S	.	*	H	α-helix	trans	-65.9	-38	175.7	-70.5	169.2	0	0	0	112.7	A27 A28 S33 L34 A35	A27-L31 WeakPolarHBondContact O-CB 3.45Å; A27-L31 VanDerWaalsContact O-CG 3.3Å; A27-L31 WeakPolarHBondContact O-CG 3.43Å; A27-L31 PolarHBondContact O-N 3.23Å; A28-L31 PolarHBondContact O-N 3.26Å; L31-S33 VanDerWaalsContact C-N 3.29Å; L31-S33 PolarHBondContact O-N 2.88Å; L31-L34 HydrophobicContact CD2-CD1 4.5Å; L31-L34 PolarHBondContact O-N 3.21Å; L31-A35 VanDerWaalsContact O-CB 3.27Å; L31-A35 WeakPolarHBondContact O-CB 3.3Å; L31-A35 PolarHBondContact O-N 3.43Å
32	L	42.6	Very low	36.1	Very low	95 Å²	95	112 Å²	112	50%	0.497	62%	0.616	S	S	.	*	H	α-helix	trans	-65.7	-30.8	173	-100.8	152.7	0	0	0	112.8	A28 E29 K36	A28-L32 VanDerWaalsContact O-CB 3.3Å; A28-L32 WeakPolarHBondContact O-CB 3.49Å; A28-L32 PolarHBondContact O-N 3.37Å; E29-L32 PolarHBondContact O-N 3.28Å; L32-K36 WeakPolarHBondContact O-CD 3.44Å; L32-K36 WeakPolarHBondContact O-CG 3.41Å; L32-K36 PolarHBondContact O-N 2.98Å
33	S	40.7	Very low	35.7	Very low	82 Å²	82	114.6 Å²	114.6	57%	0.573	63%	0.631	S	S	*	*	H	α-helix	trans	-72.7	-47.2	175.6	-58.1	0	0	0	0	110.6	E29 V30 L31 A35 K36	E29-S33 WeakPolarHBondContact O-CB 3.27Å; E29-S33 PolarHBondContact O-N 3.37Å; E29-S33 PolarHBondContact O-OG 3.5Å; V30-S33 WeakPolarHBondContact O-CB 3.29Å; V30-S33 PolarHBondContact O-N 3.26Å; L31-S33 VanDerWaalsContact C-N 3.29Å; L31-S33 PolarHBondContact O-N 2.88Å; S33-A35 VanDerWaalsContact C-N 3.27Å; S33-A35 PolarHBondContact O-N 3.37Å; S33-K36 PolarHBondContact O-N 3.43Å; S33-K36 VanDerWaalsContact O-N 3.12Å
34	L	37.9	Very low	35	Very low	131 Å²	131	119 Å²	119	69%	0.686	65%	0.645	S	S	*	*	H	α-helix	trans	-59.1	-37.6	173	-69.2	166.3	0	0	0	112.2	V30 L31 K36	V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.29Å; V30-L34 PolarHBondContact O-N 3.49Å; L31-L34 HydrophobicContact CD2-CD1 4.5Å; L31-L34 PolarHBondContact O-N 3.21Å; L34-K36 VanDerWaalsContact C-N 3.31Å; L34-K36 PolarHBondContact O-N 3.46Å
35	A	37.6	Very low	34.4	Very low	64 Å²	64	118.8 Å²	118.8	53%	0.529	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-13.2	177.9	0	0	0	0	0	114.8	L31 S33	L31-A35 VanDerWaalsContact O-CB 3.27Å; L31-A35 WeakPolarHBondContact O-CB 3.3Å; L31-A35 PolarHBondContact O-N 3.43Å; S33-A35 VanDerWaalsContact C-N 3.27Å; S33-A35 PolarHBondContact O-N 3.37Å
36	K	38.4	Very low	33.9	Very low	162 Å²	162	116 Å²	116	70%	0.704	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-8.9	179.2	-79.5	168.1	-175.6	173.5	0	114.1	L32 S33 L34	L32-K36 WeakPolarHBondContact O-CD 3.44Å; L32-K36 WeakPolarHBondContact O-CG 3.41Å; L32-K36 PolarHBondContact O-N 2.98Å; S33-K36 PolarHBondContact O-N 3.43Å; S33-K36 VanDerWaalsContact O-N 3.12Å; L34-K36 VanDerWaalsContact C-N 3.31Å; L34-K36 PolarHBondContact O-N 3.46Å
37	G	28.2	Very low	33.1	Very low	47 Å²	47	118.5 Å²	118.5	49%	0.485	66%	0.655	S	S	.	*			trans	85.9	179.2	165.2	0	0	0	0	0	116.1
38	S	27.7	Very low	32.4	Very low	116 Å²	116	123.5 Å²	123.5	81%	0.811	68%	0.676	S	S	*	*			trans	55.4	87	-176	47.2	0	0	0	0	116.3
39	I	26.4	Very low	32	Very low	155 Å²	155	128.7 Å²	128.7	80%	0.795	69%	0.693	S	S	*	*			trans	-170	144.1	139.8	-100.7	153.4	0	0	0	110
40	F	26.7	Very low	31.3	Very low	193 Å²	193	128.2 Å²	128.2	85%	0.846	69%	0.694	S	S	*	*	S	Bend	trans	67.5	152.7	177.7	-75.4	-53.9	0	0	0	118.4
41	P	27.1	Very low	30.4	Very low	120 Å²	120	128.1 Å²	128.1	78%	0.779	70%	0.698	S	S	*	*			trans	-111.3	174.1	-130.6	8.4	15.3	0	0	0	115.9
42	Q	23.5	Very low	29.7	Very low	179 Å²	179	133.4 Å²	133.4	84%	0.836	71%	0.713	S	S	*	*			trans	-66.3	129.8	-174	-58	-175.1	11.5	0	0	113.9
43	N	26.3	Very low	29.1	Very low	169 Å²	169	131.8 Å²	131.8	90%	0.904	71%	0.709	S	S	*	*			trans	-131.7	139.2	147.4	-105.7	-36.6	0	0	0	108.7	L45	N43-L45 PolarHBondContact O-N 2.92Å
44	K	23.5	Very low	28.6	Very low	198 Å²	198	134.7 Å²	134.7	86%	0.861	71%	0.711	S	S	*	*			trans	-82.4	99.7	-164.6	-69.5	176.8	177	175.2	0	113.1
45	L	26.6	Very low	28.3	Very low	154 Å²	154	134 Å²	134	81%	0.806	71%	0.705	S	S	*	*			trans	-137	129.7	159	-109.7	99.4	0	0	0	112.5	N43	N43-L45 PolarHBondContact O-N 2.92Å
46	S	26.7	Very low	28.1	Very low	78 Å²	78	135.8 Å²	135.8	55%	0.545	70%	0.698	S	S	.	*			trans	24.2	89.2	161.7	56.8	0	0	0	0	119.2	N48	S46-N48 PolarHBondContact O-N 3.29Å
47	I	24.9	Very low	28	Very low	153 Å²	153	131.7 Å²	131.7	79%	0.785	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-26.3	-179.6	-71.6	172.7	0	0	0	114.3	Q49	I47-Q49 PolarHBondContact O-N 3.45Å
48	N	27.5	Very low	28.2	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	69%	0.688	S	S	*	*	H	α-helix	trans	-73.5	-23.3	-169.7	-79.6	5.6	0	0	0	116.1	S46	S46-N48 PolarHBondContact O-N 3.29Å
49	Q	30.2	Very low	28.6	Very low	153 Å²	153	135.3 Å²	135.3	72%	0.715	67%	0.668	S	S	*	*	H	α-helix	trans	-78.5	-27.5	-175	-71.8	-176.5	-11.7	0	0	113.6	I47 S51	I47-Q49 PolarHBondContact O-N 3.45Å; Q49-S51 VanDerWaalsContact C-N 3.34Å; Q49-S51 PolarHBondContact O-N 3.49Å
50	N	28.5	Very low	28.8	Very low	118 Å²	118	131.2 Å²	131.2	63%	0.631	65%	0.647	S	S	*	*	H	α-helix	trans	-69.6	-28.7	-176.7	-76.9	-21.6	0	0	0	113.6	C53 F54	N50-C53 PolarHBondContact O-N 3.43Å; N50-F54 PolarHBondContact O-N 2.91Å
51	S	26.8	Very low	28.9	Very low	86 Å²	86	128.5 Å²	128.5	60%	0.601	64%	0.635	S	S	*	*	H	α-helix	trans	-60.5	-50.8	-177.4	180	0	0	0	0	112.6	Q49 C53 F54 Q55	Q49-S51 VanDerWaalsContact C-N 3.34Å; Q49-S51 PolarHBondContact O-N 3.49Å; S51-C53 VanDerWaalsContact C-N 3.32Å; S51-C53 PolarHBondContact O-N 2.99Å; S51-F54 PolarHBondContact O-N 3.12Å; S51-Q55 PolarHBondContact O-N 3.29Å; S51-Q55 VanDerWaalsContact O-N 3.12Å
52	Y	26.8	Very low	29.1	Very low	201 Å²	201	128.8 Å²	128.8	79%	0.788	62%	0.624	S	S	*	*	H	α-helix	trans	-64.1	-38.4	-179.9	-118.5	-87.1	0	0	0	112.2	Q55 Y56	Y52-Q55 PolarHBondContact O-N 3.16Å; Y52-Y56 PolarHBondContact O-N 3.28Å; Y52-Y56 VanDerWaalsContact O-N 3.07Å
53	C	30.5	Very low	29.6	Very low	61 Å²	61	125.5 Å²	125.5	41%	0.412	61%	0.609	S	S	.	*	H	α-helix	trans	-65	-45.7	177.6	-156.3	0	0	0	0	111.3	N50 S51 Q55 Y56 H57	N50-C53 PolarHBondContact O-N 3.43Å; S51-C53 VanDerWaalsContact C-N 3.32Å; S51-C53 PolarHBondContact O-N 2.99Å; C53-Q55 VanDerWaalsContact C-N 3.34Å; C53-Q55 PolarHBondContact O-N 3.42Å; C53-Y56 PolarHBondContact O-N 3.47Å; C53-H57 PolarHBondContact O-CD2 3.35Å; C53-H57 VanDerWaalsContact O-CD2 3.23Å; C53-H57 PolarHBondContact O-N 3.43Å
54	F	28.2	Very low	29.8	Very low	142 Å²	142	120 Å²	120	62%	0.623	58%	0.583	S	S	*	*	H	α-helix	trans	-59.6	-42.6	177.1	-125.7	-87.7	0	0	0	112.4	N50 S51 R58	N50-F54 PolarHBondContact O-N 2.91Å; S51-F54 PolarHBondContact O-N 3.12Å; F54-R58 VanDerWaalsContact O-CB 3.29Å; F54-R58 WeakPolarHBondContact O-CB 3.47Å; F54-R58 PolarHBondContact O-N 3.18Å
55	Q	33.2	Very low	30.1	Very low	118 Å²	118	114.8 Å²	114.8	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-65.4	-42.9	178.4	-161.8	75.7	-6.4	0	0	111.6	S51 Y52 C53 R58 N59	S51-Q55 PolarHBondContact O-N 3.29Å; S51-Q55 VanDerWaalsContact O-N 3.12Å; Y52-Q55 PolarHBondContact O-N 3.16Å; C53-Q55 VanDerWaalsContact C-N 3.34Å; C53-Q55 PolarHBondContact O-N 3.42Å; Q55-R58 PolarHBondContact O-N 2.99Å; Q55-N59 PolarHBondContact O-N 3.07Å; Q55-N59 VanDerWaalsContact O-N 3.16Å
56	Y	32	Very low	30.3	Very low	101 Å²	101	111.9 Å²	111.9	40%	0.396	55%	0.552	S	S	.	*	H	α-helix	trans	-63.3	-48.7	177.1	-179.3	-100.5	0	0	0	112.2	Y52 C53 R58 N59 M60	Y52-Y56 PolarHBondContact O-N 3.28Å; Y52-Y56 VanDerWaalsContact O-N 3.07Å; C53-Y56 PolarHBondContact O-N 3.47Å; Y56-R58 VanDerWaalsContact C-N 3.34Å; Y56-R58 PolarHBondContact O-N 3.4Å; Y56-N59 PolarHBondContact O-N 2.98Å; Y56-M60 HydrophobicContact CD1-CG 4.22Å; Y56-M60 HydrophobicContact CE1-CG 3.84Å; Y56-M60 HydrophobicContact CE1-SD 4.2Å; Y56-M60 HydrophobicContact CE2-CG 4.33Å; Y56-M60 HydrophobicContact CE2-SD 4.45Å; Y56-M60 WeakPolarHBondContact O-CG 3.39Å; Y56-M60 PolarHBondContact O-N 3.39Å
57	H	36.4	Very low	30.8	Very low	76 Å²	76	113.8 Å²	113.8	35%	0.352	55%	0.552	S	S	.	*	H	α-helix	trans	-60.2	-42.6	176.1	-80.8	-72.2	0	0	0	111.9	C53 N59 M60 F61	C53-H57 PolarHBondContact O-CD2 3.35Å; C53-H57 VanDerWaalsContact O-CD2 3.23Å; C53-H57 PolarHBondContact O-N 3.43Å; H57-N59 VanDerWaalsContact C-N 3.28Å; H57-N59 PolarHBondContact O-N 3.23Å; H57-M60 PolarHBondContact O-N 3.36Å; H57-F61 VanDerWaalsContact O-CD2 3.31Å; H57-F61 WeakPolarHBondContact O-CD2 3.5Å; H57-F61 PolarHBondContact O-N 2.96Å
58	R	32.6	Very low	31.2	Very low	165 Å²	165	112.3 Å²	112.3	62%	0.623	54%	0.54	S	S	*	.	H	α-helix	trans	-62.3	-33.5	179.1	-167.4	176.2	-169.2	179.2	4.2	113	F54 Q55 Y56 K62	F54-R58 VanDerWaalsContact O-CB 3.29Å; F54-R58 WeakPolarHBondContact O-CB 3.47Å; F54-R58 PolarHBondContact O-N 3.18Å; Q55-R58 PolarHBondContact O-N 2.99Å; Y56-R58 VanDerWaalsContact C-N 3.34Å; Y56-R58 PolarHBondContact O-N 3.4Å; R58-K62 WeakPolarHBondContact O-CG 3.31Å; R58-K62 PolarHBondContact O-N 3.22Å
59	N	35.6	Very low	31.4	Very low	74 Å²	74	109.4 Å²	109.4	40%	0.396	53%	0.528	S	S	.	.	H	α-helix	trans	-76.3	-44.7	175.7	-72	-3.7	0	0	0	111.8	Q55 Y56 H57 F61 K62 E63	Q55-N59 PolarHBondContact O-N 3.07Å; Q55-N59 VanDerWaalsContact O-N 3.16Å; Y56-N59 PolarHBondContact O-N 2.98Å; H57-N59 VanDerWaalsContact C-N 3.28Å; H57-N59 PolarHBondContact O-N 3.23Å; N59-F61 VanDerWaalsContact C-N 3.27Å; N59-F61 PolarHBondContact O-N 2.96Å; N59-K62 WeakPolarHBondContact O-CB 3.39Å; N59-K62 PolarHBondContact O-N 3.14Å; N59-E63 PolarHBondContact O-N 2.88Å
60	M	31.5	Very low	31.6	Very low	68 Å²	68	107.4 Å²	107.4	34%	0.335	52%	0.519	S	S	.	.	H	α-helix	trans	-57.9	-37.7	174.4	-67.4	-92	84.9	0	0	112.4	Y56 H57 E63 S64	Y56-M60 HydrophobicContact CD1-CG 4.22Å; Y56-M60 HydrophobicContact CE1-CG 3.84Å; Y56-M60 HydrophobicContact CE1-SD 4.2Å; Y56-M60 HydrophobicContact CE2-CG 4.33Å; Y56-M60 HydrophobicContact CE2-SD 4.45Å; Y56-M60 WeakPolarHBondContact O-CG 3.39Å; Y56-M60 PolarHBondContact O-N 3.39Å; H57-M60 PolarHBondContact O-N 3.36Å; M60-E63 WeakPolarHBondContact CE-OE2 3.03Å; M60-S64 WeakPolarHBondContact O-CB 3.34Å; M60-S64 PolarHBondContact O-N 2.95Å; M60-S64 PolarHBondContact O-OG 3.48Å
61	F	28.8	Very low	31.9	Very low	136 Å²	136	105.3 Å²	105.3	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-68.1	-35.5	173.5	-88.6	-67.4	0	0	0	113.1	H57 N59 S64 V65	H57-F61 VanDerWaalsContact O-CD2 3.31Å; H57-F61 WeakPolarHBondContact O-CD2 3.5Å; H57-F61 PolarHBondContact O-N 2.96Å; N59-F61 VanDerWaalsContact C-N 3.27Å; N59-F61 PolarHBondContact O-N 2.96Å; F61-S64 PolarHBondContact O-OG 3.43Å; F61-V65 WeakPolarHBondContact O-CB 3.45Å; F61-V65 WeakPolarHBondContact O-CG2 3.42Å; F61-V65 PolarHBondContact O-N 3.14Å; F61-V65 VanDerWaalsContact O-N 3.13Å
62	K	31.8	Very low	32.2	Very low	126 Å²	126	105 Å²	105	55%	0.548	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-50.6	173	-78.8	-179.6	170.9	-170.4	0	111.6	R58 N59 S64 V65 I66	R58-K62 WeakPolarHBondContact O-CG 3.31Å; R58-K62 PolarHBondContact O-N 3.22Å; N59-K62 WeakPolarHBondContact O-CB 3.39Å; N59-K62 PolarHBondContact O-N 3.14Å; K62-S64 PolarHBondContact O-N 2.9Å; K62-V65 PolarHBondContact O-N 2.76Å; K62-I66 VanDerWaalsContact O-CG1 3.29Å; K62-I66 WeakPolarHBondContact O-CG1 3.44Å; K62-I66 PolarHBondContact O-N 3.27Å
63	E	33.9	Very low	32.6	Very low	111 Å²	111	100.5 Å²	100.5	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-46.5	-177.9	-71.8	169.4	-171.5	0	0	111.3	N59 M60 V65 I66 Q67	N59-E63 PolarHBondContact O-N 2.88Å; M60-E63 WeakPolarHBondContact CE-OE2 3.03Å; E63-V65 PolarHBondContact O-N 3.35Å; E63-I66 PolarHBondContact O-N 3.01Å; E63-Q67 WeakPolarHBondContact O-CB 3.43Å; E63-Q67 PolarHBondContact O-N 3.37Å
64	S	31	Very low	32.8	Very low	54 Å²	54	104.1 Å²	104.1	38%	0.378	49%	0.494	S	S	.	.	H	α-helix	trans	-68.4	-29.7	178.1	54.2	0	0	0	0	114.2	M60 F61 K62 K68	M60-S64 WeakPolarHBondContact O-CB 3.34Å; M60-S64 PolarHBondContact O-N 2.95Å; M60-S64 PolarHBondContact O-OG 3.48Å; F61-S64 PolarHBondContact O-OG 3.43Å; K62-S64 PolarHBondContact O-N 2.9Å; S64-K68 WeakPolarHBondContact O-CB 3.21Å; S64-K68 WeakPolarHBondContact O-CG 3.38Å; S64-K68 PolarHBondContact O-N 2.82Å; S64-K68 VanDerWaalsContact O-N 3.09Å
65	V	28.6	Very low	33.1	Very low	88 Å²	88	103.3 Å²	103.3	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-71.8	-43.5	171.3	167.8	0	0	0	0	111.3	F61 K62 E63 K68 T69	F61-V65 WeakPolarHBondContact O-CB 3.45Å; F61-V65 WeakPolarHBondContact O-CG2 3.42Å; F61-V65 PolarHBondContact O-N 3.14Å; F61-V65 VanDerWaalsContact O-N 3.13Å; K62-V65 PolarHBondContact O-N 2.76Å; E63-V65 PolarHBondContact O-N 3.35Å; V65-K68 PolarHBondContact O-N 3.28Å; V65-T69 WeakPolarHBondContact O-CB 3.44Å; V65-T69 PolarHBondContact O-N 3.43Å; V65-T69 PolarHBondContact O-OG1 3.46Å
66	I	31.3	Very low	33.2	Very low	92 Å²	92	103.2 Å²	103.2	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-60	-51	176.4	-69.6	163.7	0	0	0	109.6	K62 E63 K68 T69 E70	K62-I66 VanDerWaalsContact O-CG1 3.29Å; K62-I66 WeakPolarHBondContact O-CG1 3.44Å; K62-I66 PolarHBondContact O-N 3.27Å; E63-I66 PolarHBondContact O-N 3.01Å; I66-K68 PolarHBondContact O-N 3.13Å; I66-T69 WeakPolarHBondContact O-CA 3.39Å; I66-T69 WeakPolarHBondContact O-CB 3.49Å; I66-T69 PolarHBondContact O-N 3.45Å; I66-E70 HydrophobicContact CG2-CG 4.38Å; I66-E70 WeakPolarHBondContact CG2-OE1 3.4Å; I66-E70 PolarHBondContact O-N 3.23Å
67	Q	36.2	Very low	33.5	Very low	118 Å²	118	104.3 Å²	104.3	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-60.4	-43.9	-180	-169	173.5	5.8	0	0	112.5	E63 T69 E70 E71	E63-Q67 WeakPolarHBondContact O-CB 3.43Å; E63-Q67 PolarHBondContact O-N 3.37Å; Q67-T69 VanDerWaalsContact C-N 3.25Å; Q67-T69 PolarHBondContact O-N 2.98Å; Q67-E70 PolarHBondContact O-N 3.06Å; Q67-E71 WeakPolarHBondContact O-CB 3.33Å; Q67-E71 WeakPolarHBondContact O-CG 3.4Å; Q67-E71 PolarHBondContact O-N 3.32Å
68	K	34.2	Very low	33.3	Very low	123 Å²	123	102.3 Å²	102.3	54%	0.535	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-31.3	172.3	-81.9	-171.5	172.8	-169.3	0	112.9	S64 V65 I66 N72	S64-K68 WeakPolarHBondContact O-CB 3.21Å; S64-K68 WeakPolarHBondContact O-CG 3.38Å; S64-K68 PolarHBondContact O-N 2.82Å; S64-K68 VanDerWaalsContact O-N 3.09Å; V65-K68 PolarHBondContact O-N 3.28Å; I66-K68 PolarHBondContact O-N 3.13Å; K68-N72 WeakPolarHBondContact O-CB 3.3Å; K68-N72 VanDerWaalsContact O-CG 3.31Å; K68-N72 PolarHBondContact O-N 3.02Å; K68-N72 PolarHBondContact O-ND2 3.23Å
69	T	31.8	Very low	33.5	Very low	86 Å²	86	100.2 Å²	100.2	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-73.8	-46.6	178.5	-53.1	0	0	0	0	110.9	V65 I66 Q67 N72 E73	V65-T69 WeakPolarHBondContact O-CB 3.44Å; V65-T69 PolarHBondContact O-N 3.43Å; V65-T69 PolarHBondContact O-OG1 3.46Å; I66-T69 WeakPolarHBondContact O-CA 3.39Å; I66-T69 WeakPolarHBondContact O-CB 3.49Å; I66-T69 PolarHBondContact O-N 3.45Å; Q67-T69 VanDerWaalsContact C-N 3.25Å; Q67-T69 PolarHBondContact O-N 2.98Å; T69-N72 PolarHBondContact O-N 3.33Å; T69-E73 PolarHBondContact O-N 2.88Å
70	E	33.5	Very low	33.7	Very low	112 Å²	112	100.4 Å²	100.4	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-43.9	176.4	-69.4	176	178.9	0	0	112	I66 Q67 N72 E73 Q74	I66-E70 HydrophobicContact CG2-CG 4.38Å; I66-E70 WeakPolarHBondContact CG2-OE1 3.4Å; I66-E70 PolarHBondContact O-N 3.23Å; Q67-E70 PolarHBondContact O-N 3.06Å; E70-N72 VanDerWaalsContact C-N 3.31Å; E70-N72 PolarHBondContact O-N 3.29Å; E70-E73 PolarHBondContact O-N 2.94Å; E70-Q74 WeakPolarHBondContact O-CG 3.43Å; E70-Q74 PolarHBondContact O-N 2.96Å
71	E	34.8	Very low	33.5	Very low	73 Å²	73	103.7 Å²	103.7	34%	0.341	51%	0.505	S	S	.	.	H	α-helix	trans	-57.9	-42.8	172.7	-79.6	-174.9	-154	0	0	112	Q67 Q74 R75	Q67-E71 WeakPolarHBondContact O-CB 3.33Å; Q67-E71 WeakPolarHBondContact O-CG 3.4Å; Q67-E71 PolarHBondContact O-N 3.32Å; E71-Q74 PolarHBondContact O-N 3.34Å; E71-R75 WeakPolarHBondContact O-CG 3.31Å; E71-R75 PolarHBondContact O-N 2.88Å; E71-R75 IonicContact OE2-CZ 3.96Å; E71-R75 IonicContact OE2-NH1 2.69Å; E71-R75 PolarHBondContact OE2-NH1 2.92Å; E71-R75 VanDerWaalsContact OE2-NH1 3.09Å; E71-R75 IonicContact OE2-NH2 2.92Å; E71-R75 PolarHBondContact OE2-NH2 3.46Å
72	N	33	Very low	33.5	Very low	81 Å²	81	100.1 Å²	100.1	43%	0.433	49%	0.492	S	S	.	.	H	α-helix	trans	-71.5	-32	179	-78.5	-13.9	0	0	0	112.5	K68 T69 E70 R75 N76	K68-N72 WeakPolarHBondContact O-CB 3.3Å; K68-N72 VanDerWaalsContact O-CG 3.31Å; K68-N72 PolarHBondContact O-N 3.02Å; K68-N72 PolarHBondContact O-ND2 3.23Å; T69-N72 PolarHBondContact O-N 3.33Å; E70-N72 VanDerWaalsContact C-N 3.31Å; E70-N72 PolarHBondContact O-N 3.29Å; N72-R75 PolarHBondContact O-N 3.26Å; N72-R75 PolarHBondContact OD1-NH1 2.97Å; N72-N76 WeakPolarHBondContact O-CB 3.48Å; N72-N76 VanDerWaalsContact O-CG 3.23Å; N72-N76 PolarHBondContact O-N 3.43Å; N72-N76 PolarHBondContact O-ND2 2.93Å
73	E	36.6	Very low	33.7	Very low	106 Å²	106	97.1 Å²	97.1	50%	0.495	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-38.9	171.4	-153.3	-165.5	147.3	0	0	111.5	T69 E70 N76 K77	T69-E73 PolarHBondContact O-N 2.88Å; E70-E73 PolarHBondContact O-N 2.94Å; E73-N76 PolarHBondContact O-N 2.93Å; E73-K77 VanDerWaalsContact CD-NZ 3.34Å; E73-K77 WeakPolarHBondContact O-CB 3.06Å; E73-K77 VanDerWaalsContact O-CG 3.31Å; E73-K77 WeakPolarHBondContact O-CG 3.49Å; E73-K77 PolarHBondContact O-N 2.61Å; E73-K77 WeakPolarHBondContact OE1-CE 3.45Å; E73-K77 IonicContact OE1-NZ 2.76Å; E73-K77 PolarHBondContact OE1-NZ 2.7Å
74	Q	33.8	Very low	33.8	Very low	137 Å²	137	94.6 Å²	94.6	64%	0.64	48%	0.479	S	S	*	.	H	α-helix	trans	-65.2	-42.6	172.4	-71.7	-173.6	3.8	0	0	112.3	E70 E71 K77 S78	E70-Q74 WeakPolarHBondContact O-CG 3.43Å; E70-Q74 PolarHBondContact O-N 2.96Å; E71-Q74 PolarHBondContact O-N 3.34Å; Q74-K77 PolarHBondContact O-N 3.45Å; Q74-S78 PolarHBondContact O-N 3.26Å; Q74-S78 PolarHBondContact O-OG 2.99Å
75	R	33.6	Very low	33.9	Very low	125 Å²	125	96.9 Å²	96.9	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-59	-44.7	171.5	-74	178.9	-172.1	104	14.4	111.6	E71 N72 K77 S78 Q79	E71-R75 WeakPolarHBondContact O-CG 3.31Å; E71-R75 PolarHBondContact O-N 2.88Å; E71-R75 IonicContact OE2-CZ 3.96Å; E71-R75 IonicContact OE2-NH1 2.69Å; E71-R75 PolarHBondContact OE2-NH1 2.92Å; E71-R75 VanDerWaalsContact OE2-NH1 3.09Å; E71-R75 IonicContact OE2-NH2 2.92Å; E71-R75 PolarHBondContact OE2-NH2 3.46Å; N72-R75 PolarHBondContact O-N 3.26Å; N72-R75 PolarHBondContact OD1-NH1 2.97Å; R75-K77 VanDerWaalsContact C-N 3.33Å; R75-K77 PolarHBondContact O-N 3.25Å; R75-S78 PolarHBondContact O-N 2.9Å; R75-S78 PolarHBondContact O-OG 3.41Å; R75-Q79 VanDerWaalsContact O-CB 3.26Å; R75-Q79 WeakPolarHBondContact O-CB 3.29Å; R75-Q79 PolarHBondContact O-N 3.32Å
76	N	36.3	Very low	34.2	Very low	115 Å²	115	97.4 Å²	97.4	62%	0.615	49%	0.486	S	S	*	.	H	α-helix	trans	-64.3	-37.9	177.8	-75.3	-26.4	0	0	0	112.1	N72 E73 S80	N72-N76 WeakPolarHBondContact O-CB 3.48Å; N72-N76 VanDerWaalsContact O-CG 3.23Å; N72-N76 PolarHBondContact O-N 3.43Å; N72-N76 PolarHBondContact O-ND2 2.93Å; E73-N76 PolarHBondContact O-N 2.93Å; N76-S80 WeakPolarHBondContact O-CB 3.39Å; N76-S80 PolarHBondContact O-N 3.04Å
77	K	37.4	Very low	34.8	Very low	124 Å²	124	99 Å²	99	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-44.3	173.8	-73.5	166.9	-175.2	168.4	0	112	E73 Q74 R75 Y81	E73-K77 VanDerWaalsContact CD-NZ 3.34Å; E73-K77 WeakPolarHBondContact O-CB 3.06Å; E73-K77 VanDerWaalsContact O-CG 3.31Å; E73-K77 WeakPolarHBondContact O-CG 3.49Å; E73-K77 PolarHBondContact O-N 2.61Å; E73-K77 WeakPolarHBondContact OE1-CE 3.45Å; E73-K77 IonicContact OE1-NZ 2.76Å; E73-K77 PolarHBondContact OE1-NZ 2.7Å; Q74-K77 PolarHBondContact O-N 3.45Å; R75-K77 VanDerWaalsContact C-N 3.33Å; R75-K77 PolarHBondContact O-N 3.25Å; K77-Y81 PolarHBondContact O-N 3.34Å
78	S	32.3	Very low	35	Very low	35 Å²	35	96.6 Å²	96.6	25%	0.245	48%	0.481	C	S	.	.	H	α-helix	trans	-69	-41.3	177.1	65.2	0	0	0	0	112.4	Q74 R75 S80 Y81 L82	Q74-S78 PolarHBondContact O-N 3.26Å; Q74-S78 PolarHBondContact O-OG 2.99Å; R75-S78 PolarHBondContact O-N 2.9Å; R75-S78 PolarHBondContact O-OG 3.41Å; S78-S80 VanDerWaalsContact C-N 3.34Å; S78-S80 PolarHBondContact O-N 3.45Å; S78-Y81 PolarHBondContact O-N 3.27Å; S78-Y81 VanDerWaalsContact O-N 3.15Å; S78-L82 WeakPolarHBondContact O-CB 3.45Å; S78-L82 VanDerWaalsContact O-CG 3.32Å; S78-L82 WeakPolarHBondContact O-CG 3.37Å; S78-L82 PolarHBondContact O-N 3.05Å
79	Q	36.8	Very low	35.4	Very low	121 Å²	121	95.5 Å²	95.5	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-40.3	175.3	-155.4	77.6	-2.3	0	0	112	R75 T83	R75-Q79 VanDerWaalsContact O-CB 3.26Å; R75-Q79 WeakPolarHBondContact O-CB 3.29Å; R75-Q79 PolarHBondContact O-N 3.32Å; Q79-T83 WeakPolarHBondContact O-CG2 3.46Å; Q79-T83 PolarHBondContact O-N 2.92Å; Q79-T83 PolarHBondContact O-OG1 2.98Å
80	S	39.7	Very low	35.8	Very low	78 Å²	78	97 Å²	97	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-45	172.4	-178	0	0	0	0	111.6	N76 S78 T83 S84	N76-S80 WeakPolarHBondContact O-CB 3.39Å; N76-S80 PolarHBondContact O-N 3.04Å; S78-S80 VanDerWaalsContact C-N 3.34Å; S78-S80 PolarHBondContact O-N 3.45Å; S80-T83 PolarHBondContact O-N 3.33Å; S80-T83 PolarHBondContact O-OG1 2.71Å; S80-S84 WeakPolarHBondContact O-CB 3.22Å; S80-S84 PolarHBondContact O-N 3.06Å
81	Y	27.4	Very low	36.5	Very low	137 Å²	137	98.7 Å²	98.7	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-66.5	-42.2	178.3	-150.6	-94.1	0	0	0	112.4	K77 S78 S84 L85 F132	K77-Y81 PolarHBondContact O-N 3.34Å; S78-Y81 PolarHBondContact O-N 3.27Å; S78-Y81 VanDerWaalsContact O-N 3.15Å; Y81-S84 WeakPolarHBondContact O-CB 3.26Å; Y81-S84 PolarHBondContact O-N 2.9Å; Y81-L85 HydrophobicContact CE1-CD1 4.36Å; Y81-L85 WeakPolarHBondContact O-CB 3.42Å; Y81-L85 PolarHBondContact O-N 3.41Å; Y81-F132 HydrophobicContact CD1-CE1 4.21Å; Y81-F132 HydrophobicContact CD1-CZ 4.4Å; Y81-F132 HydrophobicContact CE1-CE1 4.15Å; Y81-F132 AromaticContact CE1-CZ 3.95Å; Y81-F132 HydrophobicContact CE1-CZ 3.95Å
82	L	29.2	Very low	36.7	Very low	60 Å²	60	100.2 Å²	100.2	31%	0.314	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-45	176.1	-71.8	173.2	0	0	0	112	S78 S84 L85 D86 L136	S78-L82 WeakPolarHBondContact O-CB 3.45Å; S78-L82 VanDerWaalsContact O-CG 3.32Å; S78-L82 WeakPolarHBondContact O-CG 3.37Å; S78-L82 PolarHBondContact O-N 3.05Å; L82-S84 VanDerWaalsContact C-N 3.27Å; L82-S84 PolarHBondContact O-N 3.3Å; L82-L85 WeakPolarHBondContact O-CB 3.36Å; L82-L85 PolarHBondContact O-N 2.94Å; L82-L85 VanDerWaalsContact O-N 3.17Å; L82-D86 PolarHBondContact O-N 3.25Å; L82-L136 HydrophobicContact CD1-CD2 4.23Å; L82-L136 HydrophobicContact CD2-CD2 3.85Å; L82-L136 HydrophobicContact CD2-CG 4.44Å
83	T	35.9	Very low	37	Very low	63 Å²	63	100.4 Å²	100.4	39%	0.387	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-23.4	175.8	57.6	0	0	0	0	113.1	Q79 S80 K87	Q79-T83 WeakPolarHBondContact O-CG2 3.46Å; Q79-T83 PolarHBondContact O-N 2.92Å; Q79-T83 PolarHBondContact O-OG1 2.98Å; S80-T83 PolarHBondContact O-N 3.33Å; S80-T83 PolarHBondContact O-OG1 2.71Å; T83-K87 WeakPolarHBondContact O-CB 3.41Å; T83-K87 WeakPolarHBondContact O-CD 3.32Å; T83-K87 WeakPolarHBondContact O-CG 3.38Å; T83-K87 PolarHBondContact O-N 3.03Å
84	S	37.2	Very low	37.3	Very low	58 Å²	58	102 Å²	102	41%	0.406	50%	0.499	S	S	.	.	H	α-helix	trans	-72.3	-42.5	167.7	-171.4	0	0	0	0	111.8	S80 Y81 L82 K87 N88	S80-S84 WeakPolarHBondContact O-CB 3.22Å; S80-S84 PolarHBondContact O-N 3.06Å; Y81-S84 WeakPolarHBondContact O-CB 3.26Å; Y81-S84 PolarHBondContact O-N 2.9Å; L82-S84 VanDerWaalsContact C-N 3.27Å; L82-S84 PolarHBondContact O-N 3.3Å; S84-K87 PolarHBondContact O-N 3.17Å; S84-N88 PolarHBondContact O-N 3.36Å; S84-N88 PolarHBondContact O-ND2 3.21Å
85	L	32.1	Very low	37.6	Very low	102 Å²	102	102.5 Å²	102.5	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-46.3	178	-148.7	80.3	0	0	0	111.3	Y81 L82 N88 L89	Y81-L85 HydrophobicContact CE1-CD1 4.36Å; Y81-L85 WeakPolarHBondContact O-CB 3.42Å; Y81-L85 PolarHBondContact O-N 3.41Å; L82-L85 WeakPolarHBondContact O-CB 3.36Å; L82-L85 PolarHBondContact O-N 2.94Å; L82-L85 VanDerWaalsContact O-N 3.17Å; L85-N88 CarbonylContact O-C 3.55Å; L85-N88 PolarHBondContact O-N 3.25Å; L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 PolarHBondContact O-N 3.38Å
86	D	34.2	Very low	38	Very low	99 Å²	99	102.2 Å²	102.2	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-43.2	176.2	-179	50.2	0	0	0	111.9	L82 N88 L89 H90	L82-D86 PolarHBondContact O-N 3.25Å; D86-N88 VanDerWaalsContact C-N 3.26Å; D86-N88 PolarHBondContact O-N 3.41Å; D86-L89 PolarHBondContact O-N 2.88Å; D86-H90 VanDerWaalsContact O-CB 3.25Å; D86-H90 WeakPolarHBondContact O-CB 3.42Å; D86-H90 PolarHBondContact O-N 3.48Å
87	K	44.6	Very low	38.1	Very low	125 Å²	125	101.1 Å²	101.1	54%	0.543	50%	0.495	S	S	.	.	H	α-helix	trans	-57.5	-38.3	172	-75.6	164.4	-166.1	161.7	0	112.2	T83 S84 R91	T83-K87 WeakPolarHBondContact O-CB 3.41Å; T83-K87 WeakPolarHBondContact O-CD 3.32Å; T83-K87 WeakPolarHBondContact O-CG 3.38Å; T83-K87 PolarHBondContact O-N 3.03Å; S84-K87 PolarHBondContact O-N 3.17Å; K87-R91 WeakPolarHBondContact O-CB 3.4Å; K87-R91 WeakPolarHBondContact O-CD 3.2Å; K87-R91 WeakPolarHBondContact O-CG 3.5Å; K87-R91 PolarHBondContact O-N 2.92Å
88	N	41.3	Very low	38.5	Very low	69 Å²	69	101.5 Å²	101.5	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-77.4	-34.7	177.7	-73.5	-33.6	0	0	0	113	S84 L85 D86 R91 N92	S84-N88 PolarHBondContact O-N 3.36Å; S84-N88 PolarHBondContact O-ND2 3.21Å; L85-N88 CarbonylContact O-C 3.55Å; L85-N88 PolarHBondContact O-N 3.25Å; D86-N88 VanDerWaalsContact C-N 3.26Å; D86-N88 PolarHBondContact O-N 3.41Å; N88-R91 PolarHBondContact O-N 2.9Å; N88-R91 PolarHBondContact OD1-NH1 3.41Å; N88-R91 VanDerWaalsContact OD1-NH1 3.1Å; N88-N92 WeakPolarHBondContact O-CB 3.48Å; N88-N92 PolarHBondContact O-N 2.95Å
89	L	41.3	Very low	39	Very low	99 Å²	99	108.6 Å²	108.6	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-47.9	171.3	179.7	59.5	0	0	0	110.6	L85 D86 R91 N92 I93	L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 PolarHBondContact O-N 3.38Å; D86-L89 PolarHBondContact O-N 2.88Å; L89-R91 VanDerWaalsContact C-N 3.33Å; L89-R91 PolarHBondContact O-N 3.42Å; L89-N92 CarbonylContact O-C 3.59Å; L89-N92 PolarHBondContact O-N 3.09Å; L89-N92 VanDerWaalsContact O-N 3.12Å; L89-I93 HydrophobicContact CD1-CD1 3.96Å; L89-I93 HydrophobicContact CD1-CG1 4.21Å; L89-I93 HydrophobicContact CG-CD1 3.86Å; L89-I93 HydrophobicContact CG-CG1 4.49Å; L89-I93 WeakPolarHBondContact O-CB 3.44Å; L89-I93 WeakPolarHBondContact O-CG1 3.27Å; L89-I93 PolarHBondContact O-N 3.01Å
90	H	40.9	Very low	39.2	Very low	118 Å²	118	107.3 Å²	107.3	55%	0.546	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-40.5	175.1	-169.3	104.9	0	0	0	111.6	D86 K94	D86-H90 VanDerWaalsContact O-CB 3.25Å; D86-H90 WeakPolarHBondContact O-CB 3.42Å; D86-H90 PolarHBondContact O-N 3.48Å; H90-K94 WeakPolarHBondContact O-CB 3.47Å; H90-K94 PolarHBondContact O-N 3.19Å
91	R	47.1	Very low	39.2	Very low	148 Å²	148	110.8 Å²	110.8	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-59.6	-49.4	170.2	-78	165	176.2	178.8	-5.1	111.6	K87 N88 L89 K94 F95	K87-R91 WeakPolarHBondContact O-CB 3.4Å; K87-R91 WeakPolarHBondContact O-CD 3.2Å; K87-R91 WeakPolarHBondContact O-CG 3.5Å; K87-R91 PolarHBondContact O-N 2.92Å; N88-R91 PolarHBondContact O-N 2.9Å; N88-R91 PolarHBondContact OD1-NH1 3.41Å; N88-R91 VanDerWaalsContact OD1-NH1 3.1Å; L89-R91 VanDerWaalsContact C-N 3.33Å; L89-R91 PolarHBondContact O-N 3.42Å; R91-K94 CarbonylContact O-C 3.58Å; R91-K94 PolarHBondContact O-N 2.89Å; R91-F95 WeakPolarHBondContact O-CD2 3.4Å; R91-F95 PolarHBondContact O-N 3.21Å
92	N	39.7	Very low	40.3	Very low	105 Å²	105	107.6 Å²	107.6	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-64.9	-39.1	180	-86.6	-28.3	0	0	0	112.8	N88 L89 F95 K96	N88-N92 WeakPolarHBondContact O-CB 3.48Å; N88-N92 PolarHBondContact O-N 2.95Å; L89-N92 CarbonylContact O-C 3.59Å; L89-N92 PolarHBondContact O-N 3.09Å; L89-N92 VanDerWaalsContact O-N 3.12Å; N92-F95 PolarHBondContact O-N 2.92Å; N92-K96 WeakPolarHBondContact O-CB 3.43Å; N92-K96 PolarHBondContact O-N 3Å
93	I	38.5	Very low	40.9	Very low	84 Å²	84	110.4 Å²	110.4	43%	0.431	53%	0.533	S	S	.	.	H	α-helix	trans	-63.8	-45.3	172.2	-69.5	169.7	0	0	0	109.8	L89 F95 K96 L97	L89-I93 HydrophobicContact CD1-CD1 3.96Å; L89-I93 HydrophobicContact CD1-CG1 4.21Å; L89-I93 HydrophobicContact CG-CD1 3.86Å; L89-I93 HydrophobicContact CG-CG1 4.49Å; L89-I93 WeakPolarHBondContact O-CB 3.44Å; L89-I93 WeakPolarHBondContact O-CG1 3.27Å; L89-I93 PolarHBondContact O-N 3.01Å; I93-F95 VanDerWaalsContact C-N 3.32Å; I93-F95 PolarHBondContact O-N 3.13Å; I93-K96 PolarHBondContact O-N 2.95Å; I93-L97 HydrophobicContact CG2-CD1 3.76Å; I93-L97 HydrophobicContact CG2-CG 4.25Å; I93-L97 VanDerWaalsContact O-CB 3.29Å; I93-L97 WeakPolarHBondContact O-CB 3.11Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.49Å; I93-L97 PolarHBondContact O-N 3.24Å
94	K	43.9	Very low	41.1	Very low	141 Å²	141	111.8 Å²	111.8	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-62.5	-36	176.1	-169.6	170.9	-176.8	173.8	0	112.3	H90 R91 H98	H90-K94 WeakPolarHBondContact O-CB 3.47Å; H90-K94 PolarHBondContact O-N 3.19Å; R91-K94 CarbonylContact O-C 3.58Å; R91-K94 PolarHBondContact O-N 2.89Å; K94-H98 VanDerWaalsContact O-CB 3.23Å; K94-H98 WeakPolarHBondContact O-CB 3.4Å; K94-H98 PolarHBondContact O-N 2.86Å
95	F	40.8	Very low	41.3	Very low	146 Å²	146	115.8 Å²	115.8	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-71.8	-44.1	172.5	-78.8	-61.3	0	0	0	112.9	R91 N92 I93 L97 H98 R99	R91-F95 WeakPolarHBondContact O-CD2 3.4Å; R91-F95 PolarHBondContact O-N 3.21Å; N92-F95 PolarHBondContact O-N 2.92Å; I93-F95 VanDerWaalsContact C-N 3.32Å; I93-F95 PolarHBondContact O-N 3.13Å; F95-L97 VanDerWaalsContact C-N 3.34Å; F95-L97 PolarHBondContact O-N 3.46Å; F95-H98 PolarHBondContact O-N 3.05Å; F95-R99 WeakPolarHBondContact O-CB 3.16Å; F95-R99 PolarHBondContact O-N 3.33Å
96	K	40.9	Very low	41.5	Very low	119 Å²	119	119.5 Å²	119.5	52%	0.517	57%	0.57	S	S	.	*	H	α-helix	trans	-56.6	-48	171.4	-82.3	-170.8	175.5	-177.5	0	110.1	N92 I93 R99 I100 E122	N92-K96 WeakPolarHBondContact O-CB 3.43Å; N92-K96 PolarHBondContact O-N 3Å; I93-K96 PolarHBondContact O-N 2.95Å; K96-R99 PolarHBondContact O-N 2.95Å; K96-I100 VanDerWaalsContact O-CG1 3.3Å; K96-I100 WeakPolarHBondContact O-CG1 3.41Å; K96-I100 PolarHBondContact O-N 3.06Å; K96-E122 IonicContact NZ-OE1 2.77Å; K96-E122 PolarHBondContact NZ-OE1 3.49Å; K96-E122 IonicContact NZ-OE2 2.68Å
97	L	38	Very low	41.4	Very low	93 Å²	93	124.1 Å²	124.1	49%	0.487	59%	0.586	S	S	.	*	H	α-helix	trans	-65.2	-40	177.5	-73.3	173.1	0	0	0	113.3	I93 F95 R99 I100 K101	I93-L97 HydrophobicContact CG2-CD1 3.76Å; I93-L97 HydrophobicContact CG2-CG 4.25Å; I93-L97 VanDerWaalsContact O-CB 3.29Å; I93-L97 WeakPolarHBondContact O-CB 3.11Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.49Å; I93-L97 PolarHBondContact O-N 3.24Å; F95-L97 VanDerWaalsContact C-N 3.34Å; F95-L97 PolarHBondContact O-N 3.46Å; L97-R99 VanDerWaalsContact C-N 3.35Å; L97-I100 PolarHBondContact O-N 3.49Å; L97-K101 WeakPolarHBondContact O-CB 3.32Å; L97-K101 WeakPolarHBondContact O-CG 3.49Å; L97-K101 PolarHBondContact O-N 2.92Å
98	H	45.7	Very low	40.9	Very low	132 Å²	132	123.2 Å²	123.2	61%	0.611	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-40.5	174.3	-173.2	-84.6	0	0	0	111.2	K94 F95 K101 S102	K94-H98 VanDerWaalsContact O-CB 3.23Å; K94-H98 WeakPolarHBondContact O-CB 3.4Å; K94-H98 PolarHBondContact O-N 2.86Å; F95-H98 PolarHBondContact O-N 3.05Å; H98-K101 PolarHBondContact O-N 3.36Å; H98-S102 WeakPolarHBondContact O-CB 3.48Å; H98-S102 PolarHBondContact O-N 3.15Å; H98-S102 PolarHBondContact O-OG 3.07Å
99	R	44.3	Very low	40.3	Very low	183 Å²	183	128 Å²	128	69%	0.691	62%	0.62	S	S	*	*	H	α-helix	trans	-63.2	-45.4	174.3	-168.5	173	-179.7	126.8	-1.8	111.1	F95 K96 L97 S102 L103	F95-R99 WeakPolarHBondContact O-CB 3.16Å; F95-R99 PolarHBondContact O-N 3.33Å; K96-R99 PolarHBondContact O-N 2.95Å; L97-R99 VanDerWaalsContact C-N 3.35Å; R99-S102 WeakPolarHBondContact CA-OG 3.38Å; R99-S102 PolarHBondContact O-N 3.04Å; R99-S102 PolarHBondContact O-OG 3.25Å; R99-L103 HydrophobicContact CG-CD1 4.24Å; R99-L103 VanDerWaalsContact O-CG 3.31Å; R99-L103 WeakPolarHBondContact O-CG 3.45Å; R99-L103 PolarHBondContact O-N 2.94Å
100	I	39.5	Very low	39.7	Very low	94 Å²	94	127.5 Å²	127.5	48%	0.482	63%	0.625	S	S	.	*	H	α-helix	trans	-58	-50.9	173.4	-68.8	162.9	0	0	0	110.6	K96 L97 S102 L103 T104	K96-I100 VanDerWaalsContact O-CG1 3.3Å; K96-I100 WeakPolarHBondContact O-CG1 3.41Å; K96-I100 PolarHBondContact O-N 3.06Å; L97-I100 PolarHBondContact O-N 3.49Å; I100-S102 VanDerWaalsContact C-N 3.27Å; I100-S102 PolarHBondContact O-N 3.33Å; I100-L103 PolarHBondContact O-N 3.08Å; I100-T104 HydrophobicContact CG2-CG2 4.24Å; I100-T104 PolarHBondContact O-N 2.76Å; I100-T104 PolarHBondContact O-OG1 2.69Å
101	K	41.4	Very low	39.2	Very low	152 Å²	152	127.7 Å²	127.7	66%	0.661	64%	0.639	S	S	*	*	H	α-helix	trans	-58.7	-35.6	176.4	-75.5	-175.2	175.9	-171.9	0	113	L97 H98 L103 T104 N105	L97-K101 WeakPolarHBondContact O-CB 3.32Å; L97-K101 WeakPolarHBondContact O-CG 3.49Å; L97-K101 PolarHBondContact O-N 2.92Å; H98-K101 PolarHBondContact O-N 3.36Å; K101-L103 VanDerWaalsContact C-N 3.31Å; K101-T104 PolarHBondContact O-OG1 3.01Å; K101-N105 WeakPolarHBondContact O-CB 3.31Å; K101-N105 PolarHBondContact O-N 3.3Å
102	S	49.3	Very low	38.4	Very low	70 Å²	70	127.2 Å²	127.2	49%	0.49	65%	0.646	S	S	.	*	H	α-helix	trans	-70.9	-25.3	175.7	74.6	0	0	0	0	113.6	H98 R99 I100	H98-S102 WeakPolarHBondContact O-CB 3.48Å; H98-S102 PolarHBondContact O-N 3.15Å; H98-S102 PolarHBondContact O-OG 3.07Å; R99-S102 WeakPolarHBondContact CA-OG 3.38Å; R99-S102 PolarHBondContact O-N 3.04Å; R99-S102 PolarHBondContact O-OG 3.25Å; I100-S102 VanDerWaalsContact C-N 3.27Å; I100-S102 PolarHBondContact O-N 3.33Å
103	L	41.2	Very low	38	Very low	119 Å²	119	128.3 Å²	128.3	62%	0.623	65%	0.652	S	S	*	*	H	α-helix	trans	-85.9	-38.9	177	-69.1	166.6	0	0	0	111.8	R99 I100 K101 N105	R99-L103 HydrophobicContact CG-CD1 4.24Å; R99-L103 VanDerWaalsContact O-CG 3.31Å; R99-L103 WeakPolarHBondContact O-CG 3.45Å; R99-L103 PolarHBondContact O-N 2.94Å; I100-L103 PolarHBondContact O-N 3.08Å; K101-L103 VanDerWaalsContact C-N 3.31Å; L103-N105 VanDerWaalsContact C-N 3.27Å; L103-N105 PolarHBondContact O-N 2.69Å
104	T	41.7	Very low	37.7	Very low	92 Å²	92	132 Å²	132	56%	0.564	67%	0.666	S	S	*	*	H	α-helix	trans	-74.5	-13.5	177.9	58.4	0	0	0	0	113.6	I100 K101 K106	I100-T104 HydrophobicContact CG2-CG2 4.24Å; I100-T104 PolarHBondContact O-N 2.76Å; I100-T104 PolarHBondContact O-OG1 2.69Å; K101-T104 PolarHBondContact O-OG1 3.01Å; T104-K106 PolarHBondContact O-N 2.88Å; T104-K106 VanDerWaalsContact O-N 3.1Å
105	N	40.7	Very low	37.3	Very low	142 Å²	142	131.7 Å²	131.7	76%	0.759	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	19	177.4	-132.4	12	0	0	0	114.1	K101 L103	K101-N105 WeakPolarHBondContact O-CB 3.31Å; K101-N105 PolarHBondContact O-N 3.3Å; L103-N105 VanDerWaalsContact C-N 3.27Å; L103-N105 PolarHBondContact O-N 2.69Å
106	K	36.3	Very low	37	Very low	180 Å²	180	134 Å²	134	78%	0.783	68%	0.68	S	S	*	*	S	Bend	trans	-133.9	105.2	173.1	-75.1	-172.9	176.3	179.6	0	111.5	T104	T104-K106 PolarHBondContact O-N 2.88Å; T104-K106 VanDerWaalsContact O-N 3.1Å
107	K	32.3	Very low	36.4	Very low	195 Å²	195	133.2 Å²	133.2	85%	0.848	69%	0.685	S	S	*	*	S	Bend	trans	81	130.9	175.5	-56.8	-176.5	175.1	-176.5	0	116.6
108	S	33.5	Very low	36.2	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	70%	0.701	S	S	*	*			trans	50.5	89	158.8	49.9	0	0	0	0	118.1	S110	S108-S110 PolarHBondContact O-N 3.45Å
109	L	29.3	Very low	35.4	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	71%	0.714	S	S	*	*			trans	-73.7	104	152.2	-80.6	79.8	0	0	0	109.7
110	S	29.6	Very low	34.7	Very low	88 Å²	88	137.7 Å²	137.7	62%	0.615	71%	0.714	S	S	*	*			trans	-162.9	146.5	153	49.3	0	0	0	0	110.7	S108 I112	S108-S110 PolarHBondContact O-N 3.45Å; S110-I112 PolarHBondContact O-N 3.46Å
111	S	30.3	Very low	34.2	Very low	121 Å²	121	138.5 Å²	138.5	85%	0.846	73%	0.726	S	S	*	*			trans	49.9	54	165.2	57	0	0	0	0	118.1
112	I	29.2	Very low	33.7	Very low	139 Å²	139	137.3 Å²	137.3	71%	0.713	72%	0.722	S	S	*	*			trans	-106.8	102.7	153.9	-61	-179.5	0	0	0	107.7	S110 F114	S110-I112 PolarHBondContact O-N 3.46Å; I112-F114 HydrophobicContact CG2-CE2 4.44Å
113	N	30.8	Very low	32.7	Very low	128 Å²	128	140.3 Å²	140.3	68%	0.684	74%	0.738	S	S	*	*			trans	-85.3	131.4	171.7	-166.4	25.2	0	0	0	109.5	D115	N113-D115 PolarHBondContact ND2-OD2 3.43Å; N113-D115 PolarHBondContact O-N 2.86Å; N113-D115 PolarHBondContact OD1-OD2 2.98Å
114	F	32.1	Very low	32.1	Very low	162 Å²	162	140.4 Å²	140.4	71%	0.711	74%	0.738	S	S	*	*	S	Bend	trans	-81.7	-13.1	-164.3	-90.5	-93.9	0	0	0	114.9	I112 K116 V117	I112-F114 HydrophobicContact CG2-CE2 4.44Å; F114-K116 PolarHBondContact O-N 2.91Å; F114-V117 PolarHBondContact O-N 3.32Å
115	D	35.6	Very low	31.4	Very low	133 Å²	133	141.3 Å²	141.3	71%	0.711	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	10.7	-169.7	-50.2	-42	0	0	0	116.2	N113	N113-D115 PolarHBondContact ND2-OD2 3.43Å; N113-D115 PolarHBondContact O-N 2.86Å; N113-D115 PolarHBondContact OD1-OD2 2.98Å
116	K	34.4	Very low	30.9	Very low	196 Å²	196	142.9 Å²	142.9	85%	0.852	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.1	8.8	-178.5	-81.5	-169.3	173.1	-178.5	0	116.2	F114 Q118	F114-K116 PolarHBondContact O-N 2.91Å; K116-Q118 PolarHBondContact O-N 3.28Å
117	V	29.5	Very low	30.6	Very low	101 Å²	101	142 Å²	142	61%	0.612	75%	0.747	S	S	*	*			trans	-83.5	59.7	176.6	-164.4	0	0	0	0	111.7	F114	F114-V117 PolarHBondContact O-N 3.32Å
118	Q	32.6	Very low	30.3	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	74%	0.744	S	S	*	*			trans	-119.6	64.5	168.6	-80.9	-164.9	-16.6	0	0	111	K116	K116-Q118 PolarHBondContact O-N 3.28Å
119	Q	30.6	Very low	30.1	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	73%	0.732	S	S	*	*			trans	-169.3	89.1	160.4	-110.9	159.7	62.1	0	0	111
120	I	27.8	Very low	30.2	Very low	137 Å²	137	135.6 Å²	135.6	70%	0.703	73%	0.726	S	S	*	*			trans	-135.9	114	159.6	-58.8	-179.7	0	0	0	106.8	E122	I120-E122 PolarHBondContact O-N 3.43Å
121	P	29.3	Very low	30.3	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	73%	0.727	S	S	*	*			trans	-80.1	105.1	172	-0.4	17.5	0	0	0	109.5	T123	P121-T123 VanDerWaalsContact C-N 3.34Å; P121-T123 PolarHBondContact O-N 3.38Å; P121-T123 VanDerWaalsContact O-N 3.09Å
122	E	31.4	Very low	30.2	Very low	127 Å²	127	134.9 Å²	134.9	59%	0.593	71%	0.708	S	S	*	*			trans	-78.2	84.5	166.2	-77.6	-159.2	149.8	0	0	109.8	K96 I120 I124	K96-E122 IonicContact NZ-OE1 2.77Å; K96-E122 PolarHBondContact NZ-OE1 3.49Å; K96-E122 IonicContact NZ-OE2 2.68Å; I120-E122 PolarHBondContact O-N 3.43Å; E122-I124 VanDerWaalsContact C-N 3.26Å; E122-I124 HydrophobicContact CB-CD1 4.36Å; E122-I124 HydrophobicContact CB-CG1 4.39Å; E122-I124 PolarHBondContact O-N 2.84Å
123	T	28.3	Very low	30.3	Very low	134 Å²	134	133.2 Å²	133.2	82%	0.822	70%	0.701	S	S	*	*			trans	-72.4	77.7	168.8	36.7	0	0	0	0	111.1	P121	P121-T123 VanDerWaalsContact C-N 3.34Å; P121-T123 PolarHBondContact O-N 3.38Å; P121-T123 VanDerWaalsContact O-N 3.09Å
124	I	29.2	Very low	30.4	Very low	121 Å²	121	130.8 Å²	130.8	62%	0.621	69%	0.694	S	S	*	*			trans	-86.9	126.7	172.9	-62.5	168.8	0	0	0	109.3	E122 Q126	E122-I124 VanDerWaalsContact C-N 3.26Å; E122-I124 HydrophobicContact CB-CD1 4.36Å; E122-I124 HydrophobicContact CB-CG1 4.39Å; E122-I124 PolarHBondContact O-N 2.84Å; I124-Q126 PolarHBondContact O-N 3.04Å
125	P	27.5	Very low	30.4	Very low	111 Å²	111	127 Å²	127	72%	0.721	68%	0.68	S	S	*	*			trans	-60.8	120.9	179.6	-24.9	34.7	0	0	0	112.7	Q127	P125-Q127 PolarHBondContact O-N 2.84Å
126	Q	28.5	Very low	30.2	Very low	175 Å²	175	125.7 Å²	125.7	82%	0.818	67%	0.673	S	S	*	*			trans	-78.6	89.6	172.9	-71.8	-167.9	-1	0	0	110.8	I124	I124-Q126 PolarHBondContact O-N 3.04Å
127	Q	29.9	Very low	30	Very low	160 Å²	160	120.7 Å²	120.7	75%	0.748	66%	0.655	S	S	*	*	S	Bend	trans	-121.3	137.8	158.4	-68.4	-177.2	-17.8	0	0	108.3	P125 V129	P125-Q127 PolarHBondContact O-N 2.84Å; Q127-V129 PolarHBondContact O-N 2.91Å
128	N	27	Very low	30	Very low	147 Å²	147	121 Å²	121	79%	0.786	66%	0.658	S	S	*	*	S	Bend	trans	71.2	12.2	176.7	-51.8	-14.9	0	0	0	118.8
129	V	29.7	Very low	30	Very low	82 Å²	82	118.1 Å²	118.1	50%	0.497	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-86.4	-10	178.2	-171.4	0	0	0	0	113.5	Q127 S131	Q127-V129 PolarHBondContact O-N 2.91Å; V129-S131 PolarHBondContact O-N 2.74Å; V129-S131 VanDerWaalsContact O-N 3.17Å
130	S	30.4	Very low	30	Very low	110 Å²	110	116.5 Å²	116.5	77%	0.769	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-66.4	-14.6	-178.2	44	0	0	0	0	115.3
131	S	32.1	Very low	30	Very low	91 Å²	91	116 Å²	116	64%	0.636	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-95.1	-6.2	-172.9	-52.9	0	0	0	0	115.8	V129	V129-S131 PolarHBondContact O-N 2.74Å; V129-S131 VanDerWaalsContact O-N 3.17Å
132	F	27.9	Very low	29.9	Very low	102 Å²	102	119 Å²	119	45%	0.447	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.8	-18.5	-170	-99.5	-90	0	0	0	116.1	Y81 S134 I135	Y81-F132 HydrophobicContact CD1-CE1 4.21Å; Y81-F132 HydrophobicContact CD1-CZ 4.4Å; Y81-F132 HydrophobicContact CE1-CE1 4.15Å; Y81-F132 AromaticContact CE1-CZ 3.95Å; Y81-F132 HydrophobicContact CE1-CZ 3.95Å; F132-S134 PolarHBondContact O-N 3.09Å; F132-S134 VanDerWaalsContact O-N 3.13Å; F132-I135 HydrophobicContact CD1-CD1 4.16Å; F132-I135 HydrophobicContact CE1-CD1 4.21Å; F132-I135 PolarHBondContact O-N 3.46Å; F132-I135 VanDerWaalsContact O-N 3.16Å
133	N	30.9	Very low	29.7	Very low	104 Å²	104	119.8 Å²	119.8	56%	0.556	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-16.6	-174.7	-72	-15.3	0	0	0	114.2	I135 N137	N133-I135 VanDerWaalsContact C-N 3.3Å; N133-I135 PolarHBondContact O-N 2.67Å; N133-N137 PolarHBondContact O-ND2 3.43Å
134	S	34.4	Very low	29.6	Very low	78 Å²	78	118.3 Å²	118.3	55%	0.545	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-11.9	176	-51.3	0	0	0	0	114.4	F132	F132-S134 PolarHBondContact O-N 3.09Å; F132-S134 VanDerWaalsContact O-N 3.13Å
135	I	32.3	Very low	29.6	Very low	83 Å²	83	119.1 Å²	119.1	43%	0.426	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	-23.1	-173.4	-60.8	174.7	0	0	0	112.1	F132 N133	F132-I135 HydrophobicContact CD1-CD1 4.16Å; F132-I135 HydrophobicContact CE1-CD1 4.21Å; F132-I135 PolarHBondContact O-N 3.46Å; F132-I135 VanDerWaalsContact O-N 3.16Å; N133-I135 VanDerWaalsContact C-N 3.3Å; N133-I135 PolarHBondContact O-N 2.67Å
136	L	30	Very low	29.7	Very low	105 Å²	105	118.8 Å²	118.8	55%	0.55	66%	0.664	S	S	.	*	S	Bend	trans	-92.6	-8.9	-175.5	-83.1	160.5	0	0	0	114.6	L82 T138	L82-L136 HydrophobicContact CD1-CD2 4.23Å; L82-L136 HydrophobicContact CD2-CD2 3.85Å; L82-L136 HydrophobicContact CD2-CG 4.44Å; L136-T138 VanDerWaalsContact C-N 3.34Å; L136-T138 PolarHBondContact O-N 2.96Å
137	N	30.9	Very low	29.6	Very low	90 Å²	90	116.4 Å²	116.4	48%	0.481	66%	0.664	S	S	.	*			trans	-92.9	45.9	-174.2	-69.5	-19.7	0	0	0	113.5	N133	N133-N137 PolarHBondContact O-ND2 3.43Å
138	T	29.8	Very low	29.6	Very low	108 Å²	108	116.9 Å²	116.9	66%	0.663	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-85	123.4	166.4	49.9	0	0	0	0	110	L136 N140	L136-T138 VanDerWaalsContact C-N 3.34Å; L136-T138 PolarHBondContact O-N 2.96Å; T138-N140 PolarHBondContact O-N 3.42Å
139	P	31.1	Very low	29.6	Very low	116 Å²	116	119 Å²	119	75%	0.753	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.8	135.1	175.9	-24.6	34.8	0	0	0	112.1	V141	P139-V141 PolarHBondContact O-N 2.86Å
140	N	30.8	Very low	29.3	Very low	155 Å²	155	121.2 Å²	121.2	83%	0.829	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.9	125.5	177.4	-81.5	-48.6	0	0	0	111.2	T138 Q142	T138-N140 PolarHBondContact O-N 3.42Å; N140-Q142 PolarHBondContact O-N 2.52Å
141	V	28.3	Very low	29.2	Very low	127 Å²	127	121.3 Å²	121.3	77%	0.77	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-70.8	117.6	157	176.5	0	0	0	0	107.3	P139 I143	P139-V141 PolarHBondContact O-N 2.86Å; V141-I143 PolarHBondContact O-N 3.11Å; V141-I143 VanDerWaalsContact O-N 3.16Å
142	Q	26.6	Very low	28.9	Very low	172 Å²	172	121.5 Å²	121.5	80%	0.804	69%	0.689	S	S	*	*			trans	-73.5	104.7	171.1	-74.8	-169.3	-36.1	0	0	109.4	N140 S144	N140-Q142 PolarHBondContact O-N 2.52Å; Q142-S144 PolarHBondContact O-N 3.4Å; Q142-S144 VanDerWaalsContact O-N 3.12Å
143	I	27.2	Very low	28.9	Very low	144 Å²	144	125 Å²	125	74%	0.738	70%	0.704	S	S	*	*			trans	-77.2	93.3	166.1	-58.6	178.1	0	0	0	107.4	V141 N145	V141-I143 PolarHBondContact O-N 3.11Å; V141-I143 VanDerWaalsContact O-N 3.16Å; I143-N145 PolarHBondContact O-N 2.81Å; I143-N145 VanDerWaalsContact O-N 3.15Å
144	S	26.8	Very low	28.7	Very low	103 Å²	103	127 Å²	127	72%	0.72	71%	0.71	S	S	*	*			trans	-74.3	94.7	172.5	-63.7	0	0	0	0	109.8	Q142	Q142-S144 PolarHBondContact O-N 3.4Å; Q142-S144 VanDerWaalsContact O-N 3.12Å
145	N	30.2	Very low	28.2	Very low	138 Å²	138	131.6 Å²	131.6	74%	0.738	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-62.2	134.4	170.4	-73.1	-19.3	0	0	0	110	I143	I143-N145 PolarHBondContact O-N 2.81Å; I143-N145 VanDerWaalsContact O-N 3.15Å
146	P	28.3	Very low	28	Very low	104 Å²	104	133.9 Å²	133.9	68%	0.675	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.5	147.9	176.8	28.8	-34.7	0	0	0	111.2
147	P	27.3	Very low	27.8	Very low	126 Å²	126	133.2 Å²	133.2	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-74.8	128.1	178.6	30.2	-33.4	0	0	0	111.2
148	L	29.1	Very low	27.4	Very low	169 Å²	169	137.7 Å²	137.7	89%	0.885	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85	145.9	163.5	-114	72.2	0	0	0	110.3
149	E	27.9	Very low	27.3	Very low	192 Å²	192	142.1 Å²	142.1	90%	0.897	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-79.7	160.6	-168	-61.5	-174.7	120.6	0	0	114.4
150	T	22.9	Very low	26.9	Very low	128 Å²	128	144 Å²	144	79%	0.785	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77.7	171.3	-174.5	70.1	0	0	0	0	113.2
151	P	28.6	Very low	26.7	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	77%	0.769	S	S	*	*				-151.1	129.7	89.4	35.6	-15.7	0	0	0	118.3
152	S	24.7	Very low	26.4	Very low	94 Å²	94	147.7 Å²	147.7	66%	0.657	77%	0.774	S	S	*	*			trans	76.4	144.8	135.6	80.8	0	0	0	0	122.5
153	K	28.2	Very low	26.3	Very low	176 Å²	176	144.7 Å²	144.7	77%	0.765	77%	0.771	S	S	*	*			trans	70.7	138.1	163.9	-61.7	173.2	172.5	-162.5	0	116.4
154	E	27	Very low	26.2	Very low	145 Å²	145	142.5 Å²	142.5	68%	0.678	77%	0.769	S	S	*	*			cis	-151.3	128.6	4.3	-126.4	149.4	-136.7	0	0	112.5
155	Q	24.8	Very low	26.2	Very low	176 Å²	176	145 Å²	145	82%	0.822	77%	0.771	S	S	*	*			trans	47.8	160.9	144	-58.6	-172.5	-6.8	0	0	124.4
156	V	26.6	Very low	25.9	Very low	130 Å²	130	145 Å²	145	79%	0.788	77%	0.772	S	S	*	*			trans	73.7	128.8	163.1	-168.5	0	0	0	0	116.9
157	S	26.2	Very low	25.7	Very low	92 Å²	92	146.7 Å²	146.7	64%	0.643	78%	0.775	S	S	*	*			cis	-165.3	147.9	-22.7	55.3	0	0	0	0	111.1
158	F	23.4	Very low	25.7	Very low	184 Å²	184	148.9 Å²	148.9	81%	0.807	78%	0.779	S	S	*	*			trans	21.2	123.9	151.1	-70.4	-97.7	0	0	0	120.3
159	Y	26.7	Very low	25.5	Very low	200 Å²	200	147.3 Å²	147.3	78%	0.784	77%	0.771	S	S	*	*				-167	131	89.7	-114.8	-82.8	0	0	0	112.4
160	N	22.6	Very low	25.5	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	77%	0.767	S	S	*	*			trans	-90.2	136.5	164.9	-83.6	-24.7	0	0	0	109.3
161	H	28	Very low	25.6	Very low	173 Å²	173	145 Å²	145	80%	0.801	77%	0.765	S	S	*	*			trans	-142.1	88.4	163	-117.8	-75	0	0	0	111.7
162	Q	22.1	Very low	25.4	Very low	187 Å²	187	152.2 Å²	152.2	87%	0.874	78%	0.778	S	S	*	*			trans	-102.7	91.8	171.8	-177.5	-177.8	20.5	0	0	109
163	S	23.7	Very low	25.3	Very low	108 Å²	108	152.2 Å²	152.2	76%	0.755	78%	0.778	S	S	*	*			trans	-176.4	151.4	163.6	-89	0	0	0	0	115.1
164	S	24.4	Very low	25.3	Very low	99 Å²	99	150.6 Å²	150.6	69%	0.692	78%	0.777	S	S	*	*			trans	95.5	144.8	140.8	-126.7	0	0	0	0	121.7
165	M	26.9	Very low	25.4	Very low	155 Å²	155	151.5 Å²	151.5	76%	0.764	79%	0.787	S	S	*	*			trans	58.1	113.5	169.7	-49.3	-51.2	175.6	0	0	117.2
166	N	25.4	Very low	25.4	Very low	139 Å²	139	150 Å²	150	74%	0.743	78%	0.784	S	S	*	*			cis	67.8	120.5	45.2	-64.9	-24.8	0	0	0	116.4
167	N	23.7	Very low	25.5	Very low	138 Å²	138	149.4 Å²	149.4	74%	0.738	78%	0.783	S	S	*	*			trans	60.2	88.6	142.9	-61.6	-14.6	0	0	0	121.3
168	L	27.8	Very low	25.3	Very low	173 Å²	173	151 Å²	151	91%	0.906	78%	0.782	S	S	*	*			trans	-143.5	117	132.6	-68.1	176.8	0	0	0	105.7
169	N	23.4	Very low	25.6	Very low	136 Å²	136	150.3 Å²	150.3	73%	0.727	79%	0.786	S	S	*	*			cis	65.6	84	11.3	-162	31.6	0	0	0	117.1
170	T	28.6	Very low	25.4	Very low	133 Å²	133	145.6 Å²	145.6	82%	0.816	78%	0.778	S	S	*	*			trans	-160.6	148.5	139.5	17.1	0	0	0	0	110.9
171	N	23.7	Very low	25.6	Very low	138 Å²	138	144.4 Å²	144.4	74%	0.738	77%	0.771	S	S	*	*			trans	-72.6	157.1	168.3	-53.9	-59.1	0	0	0	110.7
172	W	25.1	Very low	25.5	Very low	265 Å²	265	144.8 Å²	144.8	100%	1.004	77%	0.773	S	S	*	*			trans	-138.5	126.3	135.8	-90.7	-8.7	0	0	0	110.3
173	S	23.5	Very low	25.7	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	76%	0.758	S	S	*	*			trans	-98.8	177.5	172.6	-56.7	0	0	0	0	110
174	N	27.5	Very low	26	Very low	141 Å²	141	143 Å²	143	75%	0.754	76%	0.762	S	S	*	*			trans	79.7	104.8	166.4	-44.2	-18.9	0	0	0	115.4
175	N	30	Very low	25.9	Very low	165 Å²	165	146 Å²	146	88%	0.882	77%	0.769	S	S	*	*				-167.2	134.2	94.2	-85.7	-28	0	0	0	111.6
176	L	24.3	Very low	26	Very low	145 Å²	145	143.4 Å²	143.4	76%	0.759	76%	0.764	S	S	*	*			trans	-110.1	153.7	169.4	-98.3	154.8	0	0	0	107.9	I178	L176-I178 HydrophobicContact CD2-CG1 4.43Å
177	P	28.1	Very low	25.9	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	76%	0.762	S	S	*	*				-129.6	143.1	92.9	26.4	-10.3	0	0	0	111.2
178	I	23.3	Very low	26.1	Very low	124 Å²	124	144.2 Å²	144.2	64%	0.636	77%	0.767	S	S	*	*				58.4	91.1	63.2	-53	176.6	0	0	0	111.9	L176 T180	L176-I178 HydrophobicContact CD2-CG1 4.43Å; I178-T180 HydrophobicContact CG2-CG2 4.29Å
179	I	28.3	Very low	25.8	Very low	171 Å²	171	141.1 Å²	141.1	88%	0.877	76%	0.76	S	S	*	*			trans	-126.8	134.9	143.6	-62.9	-178.8	0	0	0	105.1
180	T	22.2	Very low	25.9	Very low	100 Å²	100	144 Å²	144	61%	0.613	77%	0.766	S	S	*	*			trans	-103.4	-162.6	-175.5	48.9	0	0	0	0	111.1	I178	I178-T180 HydrophobicContact CG2-CG2 4.29Å
181	D	27.4	Very low	25.7	Very low	131 Å²	131	146.3 Å²	146.3	70%	0.701	77%	0.768	S	S	*	*			trans	89.2	105.1	164.7	-44.9	-8.5	0	0	0	112.1
182	E	26.9	Very low	25.7	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	77%	0.771	S	S	*	*				80.3	142	94.4	-77.6	-164.1	-174	0	0	112.7
183	S	25.8	Very low	25.7	Very low	79 Å²	79	142.3 Å²	142.3	55%	0.552	76%	0.757	S	S	*	*			cis	-170.5	-171.5	-12.5	48.3	0	0	0	0	107.8
184	H	29.1	Very low	25.9	Very low	180 Å²	180	144.1 Å²	144.1	83%	0.833	76%	0.76	S	S	*	*			trans	66.2	95.2	164.3	-60.1	-61.6	0	0	0	121.9
185	L	22.9	Very low	25.9	Very low	160 Å²	160	144.9 Å²	144.9	84%	0.838	76%	0.759	S	S	*	*				-34.2	172.5	127.6	-78.7	151	0	0	0	115.8
186	P	29.5	Very low	25.6	Very low	101 Å²	101	143.7 Å²	143.7	66%	0.656	75%	0.752	S	S	*	*			cis	-140.6	-176.7	-6.3	30.1	-5.8	0	0	0	116.4
187	S	22.4	Very low	25.9	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	76%	0.758	S	S	*	*			trans	53.6	133.8	139.9	65.9	0	0	0	0	123.6
188	K	28.2	Very low	25.8	Very low	193 Å²	193	141.6 Å²	141.6	84%	0.839	75%	0.753	S	S	*	*				-165.2	144.1	106	-104.8	166.9	-175.3	176	0	113.1
189	S	21.9	Very low	25.9	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	76%	0.758	S	S	*	*			trans	-85.2	151.7	165	45	0	0	0	0	110.4
190	F	25.9	Very low	25.7	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.864	75%	0.749	S	S	*	*			trans	-141.2	128.1	157.2	-109.3	-84.7	0	0	0	109.6
191	Q	23.2	Very low	26	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	76%	0.762	S	S	*	*			trans	-125.9	171.4	163.5	-77.7	-174.9	-64.9	0	0	107.2
192	Q	24.6	Very low	25.8	Very low	171 Å²	171	146 Å²	146	80%	0.799	77%	0.767	S	S	*	*			trans	81	142.4	160.4	-131.5	175.7	-9.7	0	0	116.8
193	M	25	Very low	25.8	Very low	147 Å²	147	145.2 Å²	145.2	72%	0.724	77%	0.767	S	S	*	*			trans	71	135.8	166.5	-56.6	-179.2	-62.5	0	0	117.3
194	D	27.8	Very low	25.7	Very low	132 Å²	132	146 Å²	146	71%	0.706	77%	0.771	S	S	*	*			cis	-156.1	161.4	-11.8	-102.6	-24.6	0	0	0	112.6
195	E	26.7	Very low	25.6	Very low	158 Å²	158	144.7 Å²	144.7	74%	0.738	77%	0.769	S	S	*	*			trans	27	137.5	146.4	-65	-155.9	173.2	0	0	125
196	N	24.6	Very low	25.6	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	76%	0.763	S	S	*	*			trans	52.7	101.4	131.2	-59.1	-35.7	0	0	0	121.3
197	S	29.4	Very low	25.4	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	77%	0.767	S	S	*	*				-163.2	166.1	129.4	-160.6	0	0	0	0	112.5
198	S	27.1	Very low	25.8	Very low	91 Å²	91	149.4 Å²	149.4	64%	0.636	77%	0.774	S	S	*	*			trans	-124.2	171.5	-172.2	61.8	0	0	0	0	114.2
199	N	25.1	Very low	25.5	Very low	140 Å²	140	145.3 Å²	145.3	75%	0.749	77%	0.765	S	S	*	*			trans	73.8	103.4	160.5	-63.3	-26.6	0	0	0	121.4
200	S	24.5	Very low	25.7	Very low	97 Å²	97	148.3 Å²	148.3	68%	0.678	77%	0.773	S	S	*	*				75.3	126.8	127.1	76	0	0	0	0	121.5
201	K	28.5	Very low	25.7	Very low	204 Å²	204	146.9 Å²	146.9	89%	0.887	77%	0.769	S	S	*	*				178.1	160.5	105	-93.1	155.6	-172.7	172	0	113.4
202	H	23.4	Very low	25.5	Very low	178 Å²	178	143.7 Å²	143.7	82%	0.824	77%	0.765	S	S	*	*			trans	-79.2	150	-179.4	-72.9	-107.7	0	0	0	113.9
203	I	26	Very low	25.4	Very low	165 Å²	165	143.1 Å²	143.1	85%	0.846	77%	0.766	S	S	*	*			trans	-145.1	124.3	140.3	-53.8	-178	0	0	0	109.4
204	P	25	Very low	25.2	Very low	95 Å²	95	142.7 Å²	142.7	62%	0.617	77%	0.765	S	S	*	*			trans	-123.7	158.3	172.6	39.4	-28.1	0	0	0	115
205	L	25.4	Very low	24.9	Very low	153 Å²	153	144 Å²	144	80%	0.801	77%	0.772	S	S	*	*			trans	-137	139.7	162.2	-73	92.8	0	0	0	107.8
206	I	24.1	Very low	24.8	Very low	137 Å²	137	144.9 Å²	144.9	70%	0.703	78%	0.776	S	S	*	*			cis	76.4	114.2	36.9	-56.6	167.4	0	0	0	110.9
207	N	24.4	Very low	25	Very low	139 Å²	139	148.1 Å²	148.1	74%	0.743	79%	0.787	S	S	*	*			cis	-147.7	-166	-1.1	-127	10	0	0	0	108.9
208	Q	30.9	Very low	24.8	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.864	78%	0.781	S	S	*	*			cis	-147.2	-172.3	30.4	-67.6	176.8	-19.8	0	0	111.7
209	T	21.9	Very low	24.7	Very low	108 Å²	108	150.2 Å²	150.2	66%	0.663	79%	0.79	S	S	*	*			trans	-123.6	165.2	-178.4	47.4	0	0	0	0	113.2
210	N	25.9	Very low	24.6	Very low	170 Å²	170	150.6 Å²	150.6	91%	0.909	79%	0.792	S	S	*	*			trans	-150.2	151	145.9	-104.8	-37.8	0	0	0	111
211	Q	26.1	Very low	24.5	Very low	168 Å²	168	157.5 Å²	157.5	79%	0.785	80%	0.803	S	S	*	*			trans	-107.5	164.5	-156.4	-139	85.8	-2.6	0	0	114.3
212	C	19.7	Very low	24.1	Very low	113 Å²	113	154 Å²	154	76%	0.764	80%	0.799	S	S	*	*			trans	-70.4	157.1	174.1	-54.3	0	0	0	0	113.8
213	I	21.5	Very low	24	Very low	160 Å²	160	150.1 Å²	150.1	82%	0.821	79%	0.791	S	S	*	*			trans	-121	143.8	150.9	-69.6	166	0	0	0	107.2
214	I	20.4	Very low	23.8	Very low	138 Å²	138	151.7 Å²	151.7	71%	0.708	79%	0.792	S	S	*	*			trans	-115	133.6	176.3	-62.8	168.3	0	0	0	107.2	Q216	I214-Q216 HydrophobicContact CG2-CG 4.35Å
215	D	23	Very low	23.6	Very low	159 Å²	159	152.6 Å²	152.6	85%	0.85	80%	0.796	S	S	*	*			trans	-120.8	135.8	162	-96.7	-50	0	0	0	109.8
216	Q	23.3	Very low	23.5	Very low	176 Å²	176	152.9 Å²	152.9	82%	0.822	80%	0.798	S	S	*	*			trans	-106.6	119	-178.5	-66	177.7	-25.7	0	0	110.2	I214	I214-Q216 HydrophobicContact CG2-CG 4.35Å
217	Q	29.3	Very low	23.4	Very low	207 Å²	207	156.4 Å²	156.4	97%	0.967	80%	0.802	S	S	*	*			trans	-136.9	143.6	148.5	-73.4	-158.5	-14	0	0	110.4
218	S	25	Very low	23.4	Very low	109 Å²	109	157.3 Å²	157.3	76%	0.762	81%	0.807	S	S	*	*			trans	-100	141.5	-166.6	54.1	0	0	0	0	112.6
219	D	25.7	Very low	23	Very low	154 Å²	154	155.1 Å²	155.1	82%	0.824	80%	0.801	S	S	*	*				-153.1	158	129.8	-134.9	-28.7	0	0	0	113.7
220	N	21.8	Very low	23.2	Very low	147 Å²	147	155.2 Å²	155.2	79%	0.786	81%	0.805	S	S	*	*			trans	-90.9	116.2	-161.2	-69.8	-81.1	0	0	0	114.4
221	R	23	Very low	23.1	Very low	243 Å²	243	156.2 Å²	156.2	92%	0.917	80%	0.804	S	S	*	*			trans	-142.6	120.6	146.7	-73.2	-160.4	174.2	-140.5	-5.7	111.9
222	V	20	Very low	23.1	Very low	131 Å²	131	155.7 Å²	155.7	79%	0.794	81%	0.806	S	S	*	*			trans	-79.4	124.6	172.3	177.7	0	0	0	0	109.7	F224	V222-F224 HydrophobicContact CG1-CD2 4.43Å; V222-F224 HydrophobicContact CG1-CE2 4.26Å
223	S	22.2	Very low	23.2	Very low	96 Å²	96	154.9 Å²	154.9	67%	0.671	80%	0.802	S	S	*	*			trans	-143.5	119.5	164.4	55.8	0	0	0	0	109.3	T225	S223-T225 PolarHBondContact O-N 3.29Å; S223-T225 VanDerWaalsContact O-N 3.14Å
224	F	20.5	Very low	23.5	Very low	198 Å²	198	153.1 Å²	153.1	87%	0.868	80%	0.801	S	S	*	*			trans	-68	108.8	-178.1	-76.3	-96.7	0	0	0	111.6	V222	V222-F224 HydrophobicContact CG1-CD2 4.43Å; V222-F224 HydrophobicContact CG1-CE2 4.26Å
225	T	21.9	Very low	23.6	Very low	114 Å²	114	152.7 Å²	152.7	70%	0.699	81%	0.805	S	S	*	*			trans	-99.4	104.1	162.3	47.1	0	0	0	0	109	S223 W227	S223-T225 PolarHBondContact O-N 3.29Å; S223-T225 VanDerWaalsContact O-N 3.14Å; T225-W227 PolarHBondContact O-N 2.75Å
226	L	23.5	Very low	23.7	Very low	159 Å²	159	149.4 Å²	149.4	83%	0.832	80%	0.8	S	S	*	*			trans	-70.3	122	168.2	-130	82	0	0	0	108.4
227	W	22	Very low	23.9	Very low	211 Å²	211	146.1 Å²	146.1	80%	0.799	80%	0.796	S	S	*	*			trans	-65.4	145.9	172.5	-73.7	6.1	0	0	0	110.8	T225	T225-W227 PolarHBondContact O-N 2.75Å
228	N	23.9	Very low	23.7	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	79%	0.786	S	S	*	*			trans	-145.8	46.8	172.9	-115.4	-7.2	0	0	0	109.6	C230	N228-C230 PolarHBondContact O-N 3Å
229	D	22.8	Very low	23.5	Very low	139 Å²	139	142.1 Å²	142.1	74%	0.743	79%	0.786	S	S	*	*			trans	-75.1	102.1	174.4	-64.5	-41.5	0	0	0	109.6
230	C	24.8	Very low	23.4	Very low	110 Å²	110	142.6 Å²	142.6	74%	0.743	79%	0.787	S	S	*	*			trans	-149.1	74.4	172.2	-143.6	0	0	0	0	109.2	N228 L232	N228-C230 PolarHBondContact O-N 3Å; C230-L232 PolarHBondContact O-N 2.85Å
231	E	23.9	Very low	23.5	Very low	191 Å²	191	143 Å²	143	89%	0.893	79%	0.79	S	S	*	*			trans	-65.6	113.5	177.1	-65.8	-169	125.3	0	0	111
232	L	26.1	Very low	23.5	Very low	158 Å²	158	137.7 Å²	137.7	83%	0.827	79%	0.788	S	S	*	*			trans	-129.3	92.3	166.8	-74.9	176.7	0	0	0	110.1	C230 P234	C230-L232 PolarHBondContact O-N 2.85Å; L232-P234 WeakPolarHBondContact O-CD 3.32Å
233	S	22.7	Very low	23.7	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	79%	0.789	S	S	*	*			trans	-75.2	124.8	173.2	177.9	0	0	0	0	111.6	T235	S233-T235 PolarHBondContact O-N 3.34Å
234	P	27.2	Very low	23.8	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	79%	0.794	S	S	*	*			trans	-92.6	78.6	173.2	35.1	-31.5	0	0	0	111.5	L232	L232-P234 WeakPolarHBondContact O-CD 3.32Å
235	T	23.2	Very low	24.1	Very low	129 Å²	129	139.7 Å²	139.7	79%	0.791	79%	0.79	S	S	*	*			trans	-117.9	49.6	171.5	55.7	0	0	0	0	113.2	S233	S233-T235 PolarHBondContact O-N 3.34Å
236	A	25.5	Very low	24.4	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	79%	0.788	S	S	*	*			trans	-157.6	152.4	169	0	0	0	0	0	107.8
237	S	26.5	Very low	24.5	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	79%	0.785	S	S	*	*			cis	-154.8	168	-8.7	41.4	0	0	0	0	109.5
238	T	24.6	Very low	24.9	Very low	124 Å²	124	136.8 Å²	136.8	76%	0.761	78%	0.782	S	S	*	*	S	Bend	trans	-64.9	143.5	169	41.7	0	0	0	0	112.2
239	S	22.4	Very low	25.2	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	77%	0.769	S	S	*	*			trans	43.4	95.3	152.9	60.4	0	0	0	0	118.1
240	L	24	Very low	25.6	Very low	164 Å²	164	130.7 Å²	130.7	86%	0.859	76%	0.758	S	S	*	*			trans	-134.4	112.6	151	-102.9	165	0	0	0	108.4
241	N	21.9	Very low	25.8	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	76%	0.757	S	S	*	*			trans	-80.3	128.6	169	-70.4	-6.6	0	0	0	108.4
242	C	24.7	Very low	26.2	Very low	130 Å²	130	130.4 Å²	130.4	88%	0.878	75%	0.746	S	S	*	*			trans	-148.4	125.6	150.2	-92.1	0	0	0	0	107.8
243	E	22.5	Very low	26.3	Very low	174 Å²	174	129 Å²	129	81%	0.813	74%	0.735	S	S	*	*			trans	-75.4	161.6	165.7	-64.9	163.5	112.6	0	0	109.2
244	N	24.7	Very low	26.6	Very low	146 Å²	146	129.4 Å²	129.4	78%	0.781	73%	0.726	S	S	*	*			trans	56.8	102.9	168	-50.8	-36.6	0	0	0	116.4
245	D	27.5	Very low	26.7	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	71%	0.714	S	S	*	*				-162.3	134.9	100.7	-112.9	-33.2	0	0	0	116.3
246	N	27	Very low	27	Very low	123 Å²	123	128.8 Å²	128.8	66%	0.658	70%	0.701	S	S	*	*			trans	17.2	108.8	153.1	-73.4	-67.6	0	0	0	122.8	N248	N246-N248 PolarHBondContact O-N 3.2Å
247	H	27.4	Very low	27.1	Very low	164 Å²	164	129.1 Å²	129.1	76%	0.759	69%	0.69	S	S	*	*	S	Bend		70.3	-27.8	124.4	-111.6	-81.1	0	0	0	122.8	S249	H247-S249 PolarHBondContact O-N 3.47Å
248	N	29.7	Very low	27.3	Very low	137 Å²	137	127.6 Å²	127.6	73%	0.733	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	2.1	-166.1	-79.7	-9.6	0	0	0	117.4	N246	N246-N248 PolarHBondContact O-N 3.2Å
249	S	30.9	Very low	27.6	Very low	83 Å²	83	129.5 Å²	129.5	58%	0.58	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-7.6	-174.7	59.7	0	0	0	0	115.7	H247 H253	H247-S249 PolarHBondContact O-N 3.47Å; S249-H253 PolarHBondContact O-ND1 3.34Å
250	V	29.6	Very low	27.8	Very low	85 Å²	85	129.6 Å²	129.6	52%	0.515	66%	0.658	S	S	.	*	H	α-helix	trans	-82.9	-42.4	-176.1	-179.4	0	0	0	0	111.9	Q252 H253 Q254	V250-Q252 VanDerWaalsContact C-N 3.35Å; V250-Q252 PolarHBondContact O-N 3.37Å; V250-H253 PolarHBondContact O-N 3.31Å; V250-Q254 PolarHBondContact O-N 3.41Å; V250-Q254 VanDerWaalsContact O-N 3.14Å
251	E	29.9	Very low	28.1	Very low	152 Å²	152	127.8 Å²	127.8	71%	0.71	65%	0.649	S	S	*	*	H	α-helix	trans	-66.1	-33.8	-174.6	-60.6	-167.1	141.7	0	0	113.3	H253 Q254 Y255	E251-H253 VanDerWaalsContact C-N 3.32Å; E251-H253 PolarHBondContact O-N 3.41Å; E251-Q254 WeakPolarHBondContact O-CB 3.24Å; E251-Q254 PolarHBondContact O-N 2.92Å; E251-Y255 PolarHBondContact O-N 3.21Å
252	Q	31.3	Very low	28.5	Very low	142 Å²	142	127.8 Å²	127.8	66%	0.664	64%	0.643	S	S	*	*	H	α-helix	trans	-65.5	-34.8	177	-66.3	-171.9	-9.2	0	0	112.5	V250 Y255 I256	V250-Q252 VanDerWaalsContact C-N 3.35Å; V250-Q252 PolarHBondContact O-N 3.37Å; Q252-Y255 PolarHBondContact O-N 3.03Å; Q252-I256 WeakPolarHBondContact O-CG1 3.23Å; Q252-I256 PolarHBondContact O-N 3.23Å
253	H	28.9	Very low	28.7	Very low	128 Å²	128	126.4 Å²	126.4	59%	0.593	63%	0.631	S	S	*	*	H	α-helix	trans	-72.2	-36.9	173.5	-71.7	90.4	0	0	0	111.6	S249 V250 E251 Y255 I256 L257	S249-H253 PolarHBondContact O-ND1 3.34Å; V250-H253 PolarHBondContact O-N 3.31Å; E251-H253 VanDerWaalsContact C-N 3.32Å; E251-H253 PolarHBondContact O-N 3.41Å; H253-Y255 VanDerWaalsContact C-N 3.34Å; H253-Y255 PolarHBondContact O-N 3.1Å; H253-I256 PolarHBondContact O-N 2.99Å; H253-L257 WeakPolarHBondContact O-CG 3.38Å; H253-L257 PolarHBondContact O-N 3.22Å; H253-L257 VanDerWaalsContact O-N 3.14Å
254	Q	30.1	Very low	29	Very low	105 Å²	105	123.2 Å²	123.2	49%	0.491	62%	0.619	S	S	.	*	H	α-helix	trans	-62.1	-40.7	173.1	-153.8	73.7	20	0	0	111.7	V250 E251 L257 N258	V250-Q254 PolarHBondContact O-N 3.41Å; V250-Q254 VanDerWaalsContact O-N 3.14Å; E251-Q254 WeakPolarHBondContact O-CB 3.24Å; E251-Q254 PolarHBondContact O-N 2.92Å; Q254-L257 PolarHBondContact O-N 2.8Å; Q254-N258 WeakPolarHBondContact O-CB 3.31Å; Q254-N258 VanDerWaalsContact O-CG 3.23Å; Q254-N258 PolarHBondContact O-N 3.5Å
255	Y	29.1	Very low	29.2	Very low	140 Å²	140	120 Å²	120	55%	0.549	61%	0.608	S	S	.	*	H	α-helix	trans	-62.5	-43.4	178.2	-174.7	-95.1	0	0	0	112.7	E251 Q252 H253 N258 R259	E251-Y255 PolarHBondContact O-N 3.21Å; Q252-Y255 PolarHBondContact O-N 3.03Å; H253-Y255 VanDerWaalsContact C-N 3.34Å; H253-Y255 PolarHBondContact O-N 3.1Å; Y255-N258 PolarHBondContact O-N 2.97Å; Y255-R259 HydrophobicContact CE1-CG 4.46Å; Y255-R259 PolarHBondContact O-N 2.81Å; Y255-R259 PolarHBondContact OH-NE 3.38Å
256	I	29.1	Very low	29.2	Very low	100 Å²	100	119.6 Å²	119.6	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-66.8	-42.8	178.6	-66.4	168.4	0	0	0	110.9	Q252 H253 R259 L260	Q252-I256 WeakPolarHBondContact O-CG1 3.23Å; Q252-I256 PolarHBondContact O-N 3.23Å; H253-I256 PolarHBondContact O-N 2.99Å; I256-R259 PolarHBondContact O-N 3.15Å; I256-L260 HydrophobicContact CG2-CD1 4.11Å; I256-L260 WeakPolarHBondContact O-CG 3.41Å; I256-L260 PolarHBondContact O-N 2.74Å; I256-L260 VanDerWaalsContact O-N 3.09Å
257	L	27.8	Very low	29.2	Very low	97 Å²	97	120 Å²	120	51%	0.508	61%	0.608	S	S	.	*	H	α-helix	trans	-62.2	-45.3	175	-74.9	167.3	0	0	0	111.9	H253 Q254 R259 L260 L261	H253-L257 WeakPolarHBondContact O-CG 3.38Å; H253-L257 PolarHBondContact O-N 3.22Å; H253-L257 VanDerWaalsContact O-N 3.14Å; Q254-L257 PolarHBondContact O-N 2.8Å; L257-R259 VanDerWaalsContact C-N 3.34Å; L257-R259 PolarHBondContact O-N 3Å; L257-L260 PolarHBondContact O-N 2.83Å; L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 2.77Å
258	N	31.4	Very low	29.2	Very low	74 Å²	74	116.3 Å²	116.3	40%	0.396	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-37.5	177.7	-72.8	-10	0	0	0	112.2	Q254 Y255 L261 H262	Q254-N258 WeakPolarHBondContact O-CB 3.31Å; Q254-N258 VanDerWaalsContact O-CG 3.23Å; Q254-N258 PolarHBondContact O-N 3.5Å; Y255-N258 PolarHBondContact O-N 2.97Å; N258-L261 PolarHBondContact O-N 2.68Å; N258-H262 PolarHBondContact O-CD2 3.41Å; N258-H262 PolarHBondContact O-N 2.79Å
259	R	30.2	Very low	29.1	Very low	164 Å²	164	115.3 Å²	115.3	62%	0.619	60%	0.596	S	S	*	*	H	α-helix	trans	-63.9	-44	173.5	-101.7	-171.5	173.1	-149.3	-3.1	112.5	Y255 I256 L257 L261 H262 T263	Y255-R259 HydrophobicContact CE1-CG 4.46Å; Y255-R259 PolarHBondContact O-N 2.81Å; Y255-R259 PolarHBondContact OH-NE 3.38Å; I256-R259 PolarHBondContact O-N 3.15Å; L257-R259 VanDerWaalsContact C-N 3.34Å; L257-R259 PolarHBondContact O-N 3Å; R259-L261 VanDerWaalsContact C-N 3.32Å; R259-L261 PolarHBondContact O-N 3.15Å; R259-H262 PolarHBondContact O-N 3Å; R259-T263 PolarHBondContact O-N 2.8Å; R259-T263 PolarHBondContact O-OG1 3.44Å
260	L	27.1	Very low	28.7	Very low	109 Å²	109	118 Å²	118	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-67.9	-30.9	179.4	-70.7	168.2	0	0	0	113	I256 L257 T263	I256-L260 HydrophobicContact CG2-CD1 4.11Å; I256-L260 WeakPolarHBondContact O-CG 3.41Å; I256-L260 PolarHBondContact O-N 2.74Å; I256-L260 VanDerWaalsContact O-N 3.09Å; L257-L260 PolarHBondContact O-N 2.83Å; L260-T263 PolarHBondContact O-OG1 2.84Å
261	L	29.6	Very low	28.5	Very low	127 Å²	127	119 Å²	119	67%	0.665	61%	0.609	S	S	*	*	H	α-helix	trans	-72.1	-36.3	172.6	-76.8	163.8	0	0	0	112.5	L257 N258 R259	L257-L261 WeakPolarHBondContact O-CG 3.34Å; L257-L261 PolarHBondContact O-N 2.77Å; N258-L261 PolarHBondContact O-N 2.68Å; R259-L261 VanDerWaalsContact C-N 3.32Å; R259-L261 PolarHBondContact O-N 3.15Å
262	H	30.3	Very low	28.4	Very low	156 Å²	156	119 Å²	119	72%	0.722	61%	0.609	S	S	*	*	H	α-helix	trans	-79.4	-15.9	179.8	-78.4	-55.5	0	0	0	115.1	N258 R259 N264	N258-H262 PolarHBondContact O-CD2 3.41Å; N258-H262 PolarHBondContact O-N 2.79Å; R259-H262 PolarHBondContact O-N 3Å; H262-N264 VanDerWaalsContact C-N 3.31Å; H262-N264 PolarHBondContact O-N 3.47Å
263	T	29.5	Very low	28.2	Very low	101 Å²	101	116.5 Å²	116.5	62%	0.62	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	1.5	176.5	48.9	0	0	0	0	115.1	R259 L260	R259-T263 PolarHBondContact O-N 2.8Å; R259-T263 PolarHBondContact O-OG1 3.44Å; L260-T263 PolarHBondContact O-OG1 2.84Å
264	N	27.6	Very low	28.1	Very low	107 Å²	107	115 Å²	115	57%	0.572	61%	0.61	S	S	*	*			trans	-125.8	57.9	176.8	-71.3	-77.2	0	0	0	111.3	H262 D266	H262-N264 VanDerWaalsContact C-N 3.31Å; H262-N264 PolarHBondContact O-N 3.47Å; N264-D266 PolarHBondContact O-N 2.72Å
265	S	28.2	Very low	27.7	Very low	78 Å²	78	117.5 Å²	117.5	55%	0.545	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-18.6	-179.2	48.8	0	0	0	0	115.2
266	D	28.8	Very low	27.5	Very low	139 Å²	139	115.5 Å²	115.5	74%	0.743	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	9.7	-162	-60.4	0.9	0	0	0	113.6	N264	N264-D266 PolarHBondContact O-N 2.72Å
267	L	26.3	Very low	27.3	Very low	132 Å²	132	116.1 Å²	116.1	69%	0.691	65%	0.646	S	S	*	*	S	Bend	trans	-124.3	-10.6	178.2	-87.9	165.4	0	0	0	114.7	T269	L267-T269 VanDerWaalsContact C-N 3.25Å; L267-T269 PolarHBondContact O-N 2.95Å
268	T	28.2	Very low	27.2	Very low	87 Å²	87	117.2 Å²	117.2	53%	0.534	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-75.7	-9.8	-179.7	2.5	0	0	0	0	114
269	T	26.7	Very low	26.8	Very low	115 Å²	115	119.5 Å²	119.5	71%	0.706	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-87.1	-2.6	-174.6	44.7	0	0	0	0	115.1	L267	L267-T269 VanDerWaalsContact C-N 3.25Å; L267-T269 PolarHBondContact O-N 2.95Å
270	L	23.8	Very low	26.6	Very low	141 Å²	141	117.3 Å²	117.3	74%	0.738	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-113.5	2.6	-176	-110.1	166.3	0	0	0	115.4
271	V	25.7	Very low	26.6	Very low	106 Å²	106	117.6 Å²	117.6	64%	0.642	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	-20.5	-178.4	-177.1	0	0	0	0	112.8	S273	V271-S273 PolarHBondContact O-N 3.2Å
272	H	26.5	Very low	26.3	Very low	152 Å²	152	118.6 Å²	118.6	70%	0.704	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-81.8	-5.1	-178.6	-88.8	-76.2	0	0	0	115.5
273	S	26.7	Very low	26.1	Very low	88 Å²	88	118.3 Å²	118.3	62%	0.615	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-89.2	4.3	-177.8	46.7	0	0	0	0	114.9	V271	V271-S273 PolarHBondContact O-N 3.2Å
274	S	26.4	Very low	25.8	Very low	96 Å²	96	119.2 Å²	119.2	67%	0.671	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-114.9	-1.4	-177.3	-51.2	0	0	0	0	115
275	L	23.6	Very low	25.7	Very low	158 Å²	158	124.1 Å²	124.1	83%	0.827	72%	0.722	S	S	*	*	S	Bend	trans	-127.2	45.3	-175.6	-82.5	83.2	0	0	0	112.2
276	S	23.4	Very low	25.4	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	74%	0.738	S	S	*	*	S	Bend	trans	-147.1	25.4	-178.5	65.9	0	0	0	0	115.9
277	S	24.9	Very low	25.3	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	74%	0.744	S	S	*	*			trans	-169.6	139.3	168.7	53.6	0	0	0	0	109.3
278	S	26.1	Very low	25.2	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	75%	0.745	S	S	*	*			cis	-144.4	157.9	-0.5	52.3	0	0	0	0	110.6
279	T	23.5	Very low	25	Very low	122 Å²	122	132.6 Å²	132.6	75%	0.748	76%	0.759	S	S	*	*			trans	-73.4	176.2	168.7	47	0	0	0	0	112.2
280	T	26.4	Very low	24.9	Very low	119 Å²	119	131.5 Å²	131.5	73%	0.73	76%	0.756	S	S	*	*			trans	71.7	106.7	165.4	59.4	0	0	0	0	119.5
281	T	25.9	Very low	24.8	Very low	114 Å²	114	131.7 Å²	131.7	70%	0.699	76%	0.757	S	S	*	*			trans	64.8	107.9	132	58.3	0	0	0	0	121.5
282	D	23.4	Very low	24.9	Very low	148 Å²	148	132 Å²	132	79%	0.791	76%	0.764	S	S	*	*				73.4	169.2	126.1	-61.9	-49.2	0	0	0	122.2
283	D	26.1	Very low	24.7	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	77%	0.774	S	S	*	*			trans	63.3	95.8	174.8	-65.7	-17.9	0	0	0	119.8
284	T	22.6	Very low	24.6	Very low	121 Å²	121	137 Å²	137	74%	0.742	78%	0.782	S	S	*	*			trans	-11.6	133	143.7	55.4	0	0	0	0	117
285	F	26.6	Very low	24.4	Very low	210 Å²	210	139.3 Å²	139.3	92%	0.921	79%	0.787	S	S	*	*				-154.4	169.9	120	-126.6	-90	0	0	0	112.3
286	R	21.8	Very low	24.3	Very low	235 Å²	235	143.1 Å²	143.1	89%	0.887	79%	0.79	S	S	*	*			trans	-115.9	113.2	-164.3	172.7	-170.4	-179.9	-173.8	1.8	111.4
287	S	27	Very low	24.3	Very low	124 Å²	124	147.6 Å²	147.6	87%	0.867	79%	0.793	S	S	*	*			trans	-150.4	154	160.4	65.9	0	0	0	0	111.6
288	S	23.1	Very low	24.2	Very low	101 Å²	101	145.4 Å²	145.4	71%	0.706	77%	0.773	S	S	*	*			trans	-122.6	132.1	-176.1	52.4	0	0	0	0	110.3
289	N	24.6	Very low	24.3	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	77%	0.767	S	S	*	*				-176	156	126.7	-100.4	-16.4	0	0	0	114.2
290	S	24.1	Very low	24.5	Very low	92 Å²	92	144.4 Å²	144.4	64%	0.643	75%	0.753	S	S	*	*			trans	48.6	130.9	149.5	57.9	0	0	0	0	121.4
291	D	23.1	Very low	24.5	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	74%	0.742	S	S	*	*			trans	64.6	90.1	144.2	-55.1	-27.5	0	0	0	119.1
292	S	26.6	Very low	24.5	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	73%	0.729	S	S	*	*			trans	-143.1	99.4	152.2	-76	0	0	0	0	109.7	L294	S292-L294 VanDerWaalsContact C-N 3.34Å; S292-L294 PolarHBondContact O-N 3.01Å
293	Q	23.4	Very low	24.5	Very low	193 Å²	193	138.9 Å²	138.9	90%	0.902	72%	0.718	S	S	*	*			trans	-74.1	81	-178.4	-65.1	-176.1	9	0	0	111.5
294	L	24.1	Very low	24.5	Very low	152 Å²	152	139 Å²	139	80%	0.796	71%	0.714	S	S	*	*			trans	-90.1	110.6	168.7	-76.7	172	0	0	0	110.8	S292 R296	S292-L294 VanDerWaalsContact C-N 3.34Å; S292-L294 PolarHBondContact O-N 3.01Å; L294-R296 PolarHBondContact O-N 2.77Å
295	L	21.6	Very low	24.6	Very low	146 Å²	146	138.1 Å²	138.1	76%	0.764	71%	0.712	S	S	*	*			trans	-58.5	93.8	173	-80.5	161.2	0	0	0	110.9	Y297	L295-Y297 VanDerWaalsContact C-N 3.35Å; L295-Y297 HydrophobicContact CB-CD2 4.42Å; L295-Y297 HydrophobicContact CB-CE2 4.09Å; L295-Y297 WeakPolarHBondContact O-CD2 3.26Å; L295-Y297 PolarHBondContact O-N 2.83Å
296	R	21.9	Very low	24.6	Very low	238 Å²	238	131.9 Å²	131.9	90%	0.898	69%	0.69	S	S	*	*			trans	-72.1	90.3	169.4	-72.4	-171.2	174.6	-149.4	-2.3	109.5	L294 D298	L294-R296 PolarHBondContact O-N 2.77Å; R296-D298 PolarHBondContact O-N 3.24Å
297	Y	23.2	Very low	24.7	Very low	193 Å²	193	124.5 Å²	124.5	76%	0.757	67%	0.668	S	S	*	*			trans	-56.5	111.2	170.1	-78.7	-87.1	0	0	0	110.2	L295 L299	L295-Y297 VanDerWaalsContact C-N 3.35Å; L295-Y297 HydrophobicContact CB-CD2 4.42Å; L295-Y297 HydrophobicContact CB-CE2 4.09Å; L295-Y297 WeakPolarHBondContact O-CD2 3.26Å; L295-Y297 PolarHBondContact O-N 2.83Å; Y297-L299 PolarHBondContact O-N 3.48Å
298	D	23.7	Very low	24.7	Very low	67 Å²	67	122.4 Å²	122.4	36%	0.358	65%	0.65	S	S	.	*			trans	-79	89.5	-176.7	-171.1	23	0	0	0	110	R296 N300 D301 R504	R296-D298 PolarHBondContact O-N 3.24Å; D298-N300 PolarHBondContact O-N 3.49Å; D298-N300 PolarHBondContact OD1-ND2 2.94Å; D298-D301 PolarHBondContact O-N 3.21Å; D298-R504 IonicContact OD2-CZ 3.14Å; D298-R504 VanDerWaalsContact OD2-CZ 3.26Å; D298-R504 IonicContact OD2-NH1 3.75Å; D298-R504 PolarHBondContact OD2-NH1 2.97Å; D298-R504 IonicContact OD2-NH2 2.61Å; D298-R504 PolarHBondContact OD2-NH2 3Å
299	L	26.8	Very low	24.9	Very low	137 Å²	137	124.9 Å²	124.9	72%	0.717	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-58.2	4.2	-177.7	-70.1	166.1	0	0	0	115.3	Y297 D301 I302	Y297-L299 PolarHBondContact O-N 3.48Å; L299-D301 VanDerWaalsContact C-N 3.33Å; L299-I302 HydrophobicContact CD2-CD1 3.93Å
300	N	27.9	Very low	24.8	Very low	83 Å²	83	124.6 Å²	124.6	44%	0.444	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-72.3	-16.9	176	-77.9	-73.1	0	0	0	114.5	D298 R518	D298-N300 PolarHBondContact O-N 3.49Å; D298-N300 PolarHBondContact OD1-ND2 2.94Å; N300-R518 PolarHBondContact ND2-NH1 3.35Å; N300-R518 PolarHBondContact OD1-NH2 3.49Å
301	D	28	Very low	24.9	Very low	97 Å²	97	127.6 Å²	127.6	52%	0.519	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-96.8	3.6	-175.4	-82.1	-75	0	0	0	114.6	D298 L299 R504	D298-D301 PolarHBondContact O-N 3.21Å; L299-D301 VanDerWaalsContact C-N 3.33Å; D301-R504 IonicContact OD2-CZ 2.85Å; D301-R504 IonicContact OD2-NH1 3.92Å; D301-R504 PolarHBondContact OD2-NH1 3.16Å
302	I	24	Very low	25.1	Very low	80 Å²	80	125.9 Å²	125.9	41%	0.41	62%	0.623	S	S	.	*	S	Bend	trans	-76.3	129.5	167.8	-59.1	177	0	0	0	109.1	L299 Q304 L307	L299-I302 HydrophobicContact CD2-CD1 3.93Å; I302-Q304 PolarHBondContact O-N 3.46Å; I302-L307 HydrophobicContact CG2-CD1 4.15Å
303	P	25.1	Very low	25.2	Very low	88 Å²	88	127.5 Å²	127.5	57%	0.571	62%	0.616	S	S	*	*			trans	-63.3	113	179.6	24.8	-33.6	0	0	0	111	C305 T306	P303-C305 PolarHBondContact O-N 3.02Å; P303-T306 PolarHBondContact O-N 3.4Å; P303-T306 PolarHBondContact O-OG1 2.91Å
304	Q	26.4	Very low	25.2	Very low	153 Å²	153	124.8 Å²	124.8	72%	0.715	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-57.6	-22	-170.3	-66.4	-146.4	-49.9	0	0	115.1	I302 T306 L307 T308	I302-Q304 PolarHBondContact O-N 3.46Å; Q304-T306 PolarHBondContact O-N 3.35Å; Q304-L307 PolarHBondContact O-N 3.19Å; Q304-T308 PolarHBondContact O-N 2.78Å; Q304-T308 PolarHBondContact O-OG1 3.02Å
305	C	24.7	Very low	25.6	Very low	102 Å²	102	123 Å²	123	69%	0.689	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-55.6	-18.3	171.9	-55.5	0	0	0	0	114.3	P303	P303-C305 PolarHBondContact O-N 3.02Å
306	T	24.6	Very low	25.8	Very low	78 Å²	78	123 Å²	123	48%	0.479	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-94.3	-23.6	178.5	-43	0	0	0	0	112.6	P303 Q304	P303-T306 PolarHBondContact O-N 3.4Å; P303-T306 PolarHBondContact O-OG1 2.91Å; Q304-T306 PolarHBondContact O-N 3.35Å
307	L	24.8	Very low	26	Very low	81 Å²	81	121.2 Å²	121.2	42%	0.424	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-42.7	179.4	-117.4	76	0	0	0	112.3	I302 Q304 Y309 Y310 Y311	I302-L307 HydrophobicContact CG2-CD1 4.15Å; Q304-L307 PolarHBondContact O-N 3.19Å; L307-Y309 VanDerWaalsContact C-N 3.25Å; L307-Y309 PolarHBondContact O-N 3.42Å; L307-Y310 PolarHBondContact O-N 3.41Å; L307-Y311 HydrophobicContact CD2-CE2 4.18Å; L307-Y311 HydrophobicContact CG-CD2 4.5Å; L307-Y311 HydrophobicContact CG-CE2 4.34Å; L307-Y311 PolarHBondContact O-N 3.29Å; L307-Y311 VanDerWaalsContact O-N 3.15Å
308	T	26.9	Very low	26.1	Very low	79 Å²	79	119 Å²	119	49%	0.485	59%	0.59	S	S	.	*	H	α-helix	trans	-60.9	-34.9	-175.7	-39.6	0	0	0	0	112.4	Q304 Y310 Y311 D312	Q304-T308 PolarHBondContact O-N 2.78Å; Q304-T308 PolarHBondContact O-OG1 3.02Å; T308-Y310 VanDerWaalsContact C-N 3.27Å; T308-Y310 PolarHBondContact O-N 3.21Å; T308-Y311 PolarHBondContact O-N 3.19Å; T308-D312 PolarHBondContact O-N 2.87Å
309	Y	27.1	Very low	26	Very low	153 Å²	153	121.7 Å²	121.7	60%	0.6	61%	0.611	S	S	*	*	H	α-helix	trans	-62.9	-30.9	177.1	-173.6	-95	0	0	0	113.5	L307	L307-Y309 VanDerWaalsContact C-N 3.25Å; L307-Y309 PolarHBondContact O-N 3.42Å
310	Y	23.5	Very low	26	Very low	147 Å²	147	122.7 Å²	122.7	58%	0.576	62%	0.615	S	S	*	*	H	α-helix	trans	-82.1	-38.4	175.5	-85	-90.3	0	0	0	112.2	L307 T308 M314	L307-Y310 PolarHBondContact O-N 3.41Å; T308-Y310 VanDerWaalsContact C-N 3.27Å; T308-Y310 PolarHBondContact O-N 3.21Å; Y310-M314 HydrophobicContact CD1-CE 4.43Å; Y310-M314 VanDerWaalsContact O-CG 3.29Å; Y310-M314 WeakPolarHBondContact O-CG 3.4Å; Y310-M314 PolarHBondContact O-N 3.46Å
311	Y	26.5	Very low	25.7	Very low	155 Å²	155	126.4 Å²	126.4	61%	0.608	63%	0.634	S	S	*	*	H	α-helix	trans	-71.3	-44.5	-179.3	-85.8	-79.8	0	0	0	113.3	L307 T308 K313 M314 V315	L307-Y311 HydrophobicContact CD2-CE2 4.18Å; L307-Y311 HydrophobicContact CG-CD2 4.5Å; L307-Y311 HydrophobicContact CG-CE2 4.34Å; L307-Y311 PolarHBondContact O-N 3.29Å; L307-Y311 VanDerWaalsContact O-N 3.15Å; T308-Y311 PolarHBondContact O-N 3.19Å; Y311-K313 VanDerWaalsContact C-N 3.32Å; Y311-K313 PolarHBondContact O-N 3.15Å; Y311-M314 PolarHBondContact O-N 3.43Å; Y311-M314 VanDerWaalsContact O-N 3.17Å; Y311-V315 PolarHBondContact O-N 3.13Å
312	D	27.2	Very low	25.5	Very low	109 Å²	109	130.2 Å²	130.2	58%	0.583	65%	0.649	S	S	*	*	H	α-helix	trans	-59.4	-43.3	178.2	-74	-11.3	0	0	0	111.1	T308 M314 V315	T308-D312 PolarHBondContact O-N 2.87Å; D312-M314 VanDerWaalsContact C-N 3.28Å; D312-M314 PolarHBondContact O-N 3.43Å; D312-V315 PolarHBondContact O-N 3.39Å
313	K	28.4	Very low	25.4	Very low	146 Å²	146	133 Å²	133	64%	0.635	67%	0.67	S	S	*	*	H	α-helix	trans	-75.5	-6.4	179.8	-81.4	-157.5	169	-168.3	0	115.8	Y311	Y311-K313 VanDerWaalsContact C-N 3.32Å; Y311-K313 PolarHBondContact O-N 3.15Å
314	M	24	Very low	25.3	Very low	137 Å²	137	137.1 Å²	137.1	68%	0.675	69%	0.685	S	S	*	*	H	α-helix	trans	-98.1	-14.4	175.7	-77.7	-179.5	170.6	0	0	113.5	Y310 Y311 D312	Y310-M314 HydrophobicContact CD1-CE 4.43Å; Y310-M314 VanDerWaalsContact O-CG 3.29Å; Y310-M314 WeakPolarHBondContact O-CG 3.4Å; Y310-M314 PolarHBondContact O-N 3.46Å; Y311-M314 PolarHBondContact O-N 3.43Å; Y311-M314 VanDerWaalsContact O-N 3.17Å; D312-M314 VanDerWaalsContact C-N 3.28Å; D312-M314 PolarHBondContact O-N 3.43Å
315	V	31.4	Very low	25.2	Very low	114 Å²	114	135.7 Å²	135.7	69%	0.691	69%	0.687	S	S	*	*	H	α-helix	trans	-89.1	-32.7	-178.5	176.3	0	0	0	0	112.5	Y311 D312 R317	Y311-V315 PolarHBondContact O-N 3.13Å; D312-V315 PolarHBondContact O-N 3.39Å; V315-R317 PolarHBondContact O-N 3.47Å
316	D	26.3	Very low	25.2	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	69%	0.692	S	S	*	*	S	Bend	trans	-71.5	17	-179.7	-71.8	-21.7	0	0	0	114.9
317	R	25.3	Very low	25.2	Very low	201 Å²	201	142.7 Å²	142.7	76%	0.758	71%	0.708	S	S	*	*	S	Bend	trans	-146.1	77.4	180	-70.5	-170.9	174.2	-164.6	-2.8	113.1	V315	V315-R317 PolarHBondContact O-N 3.47Å
318	Q	25.4	Very low	25.3	Very low	146 Å²	146	145.8 Å²	145.8	68%	0.682	73%	0.725	S	S	*	*			trans	176.3	110.2	146.1	-96.9	-67.8	-48.3	0	0	109	M320	Q318-M320 PolarHBondContact O-N 2.86Å
319	P	21.4	Very low	25.2	Very low	123 Å²	123	151.9 Å²	151.9	80%	0.799	74%	0.739	S	S	*	*			trans	-81.3	108.2	167.1	31.7	-29.1	0	0	0	109.2
320	M	26.6	Very low	25.1	Very low	159 Å²	159	149.8 Å²	149.8	78%	0.783	74%	0.738	S	S	*	*			trans	-129.5	137.1	175.5	-88.5	-67.5	167.7	0	0	112	Q318	Q318-M320 PolarHBondContact O-N 2.86Å
321	N	23.3	Very low	25.2	Very low	160 Å²	160	147.1 Å²	147.1	86%	0.856	74%	0.741	S	S	*	*			trans	-79	169.7	-165.7	-78.5	-20.4	0	0	0	114.2
322	E	22.2	Very low	25.1	Very low	178 Å²	178	150 Å²	150	83%	0.832	75%	0.752	S	S	*	*	S	Bend	trans	-43.1	135.8	170.1	-53.1	173.3	134.8	0	0	113.3
323	T	22.3	Very low	25	Very low	139 Å²	139	151.7 Å²	151.7	85%	0.853	76%	0.76	S	S	*	*			trans	148.8	61.1	138	48.6	0	0	0	0	113.5
324	I	24	Very low	24.6	Very low	173 Å²	173	149 Å²	149	89%	0.887	76%	0.76	S	S	*	*			trans	-121.1	129.4	160.7	-63	-177.1	0	0	0	109
325	T	24.5	Very low	24.6	Very low	123 Å²	123	148.5 Å²	148.5	76%	0.755	76%	0.764	S	S	*	*			trans	-80.1	162	-155	45.6	0	0	0	0	115.2	R327	T325-R327 VanDerWaalsContact C-N 3.3Å; T325-R327 PolarHBondContact O-N 3.45Å
326	S	23.9	Very low	24.3	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	62.4	-169.6	59.3	0	0	0	0	114.6
327	R	25.1	Very low	24.1	Very low	216 Å²	216	148.6 Å²	148.6	82%	0.815	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.7	-12.8	176.3	-89.6	-175.6	170.6	153.3	-0.6	117.4	T325	T325-R327 VanDerWaalsContact C-N 3.3Å; T325-R327 PolarHBondContact O-N 3.45Å
328	N	26.1	Very low	24.1	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	77%	0.765	S	S	*	*	S	Bend	trans	-111	9.1	-177.7	-72.8	-4.2	0	0	0	114.8
329	R	24.2	Very low	24.1	Very low	207 Å²	207	142.4 Å²	142.4	78%	0.781	77%	0.77	S	S	*	*	S	Bend	trans	-92.2	-33.6	-177.4	-139.5	172.8	-167.7	165.2	4.1	113.3
330	D	25.5	Very low	24.3	Very low	109 Å²	109	141.4 Å²	141.4	58%	0.583	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-82.1	-18.9	-171	-49.6	-66.8	0	0	0	113.6	Y332 L333 S334	D330-Y332 PolarHBondContact O-N 3.22Å; D330-L333 PolarHBondContact O-N 2.99Å; D330-S334 PolarHBondContact O-OG 3.28Å
331	S	26.7	Very low	24.3	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-70.2	-6.8	175	-47.3	0	0	0	0	114.4
332	Y	23.7	Very low	24.4	Very low	214 Å²	214	136.2 Å²	136.2	84%	0.839	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-115.9	0.9	179.3	-102	-87.1	0	0	0	114.3	D330	D330-Y332 PolarHBondContact O-N 3.22Å
333	L	24.2	Very low	24.8	Very low	146 Å²	146	136.1 Å²	136.1	76%	0.764	75%	0.747	S	S	*	*	S	Bend	trans	-119.8	10	-176.6	-68	173.7	0	0	0	113.8	D330	D330-L333 PolarHBondContact O-N 2.99Å
334	S	21.7	Very low	25.1	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	74%	0.743	S	S	*	*			trans	-107.7	31.5	-166.8	33.2	0	0	0	0	114.8	D330	D330-S334 PolarHBondContact O-OG 3.28Å
335	V	23.9	Very low	25.2	Very low	126 Å²	126	132.8 Å²	132.8	76%	0.764	73%	0.726	S	S	*	*	S	Bend	trans	-130	103.1	175	-178	0	0	0	0	111.8
336	I	24.1	Very low	25.3	Very low	137 Å²	137	131.2 Å²	131.2	70%	0.703	72%	0.719	S	S	*	*			trans	69.2	74	163.5	-50.1	169.5	0	0	0	115.2	S338	I336-S338 WeakPolarHBondContact CG2-OG 3.45Å
337	S	22.9	Very low	25.5	Very low	126 Å²	126	129.8 Å²	129.8	88%	0.881	71%	0.706	S	S	*	*				-68.5	135.9	129.1	-61.6	0	0	0	0	108.4
338	S	24.8	Very low	25.6	Very low	95 Å²	95	124.6 Å²	124.6	66%	0.664	69%	0.694	S	S	*	*			trans	-155.1	151.8	173.1	-83.3	0	0	0	0	111	I336	I336-S338 WeakPolarHBondContact CG2-OG 3.45Å
339	P	26	Very low	25.7	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-81.6	164.3	-148	30.3	-36.9	0	0	0	115.5
340	S	24.6	Very low	25.8	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-51.2	132.1	172.6	48.3	0	0	0	0	112.4
341	C	26.8	Very low	25.9	Very low	96 Å²	96	119.4 Å²	119.4	65%	0.649	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-84.5	123.4	174.3	-165.8	0	0	0	0	110
342	N	26.3	Very low	26	Very low	115 Å²	115	120.1 Å²	120.1	62%	0.615	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-78.4	144.9	-176.7	-61	-8.5	0	0	0	111.3	Q344 C345	N342-Q344 PolarHBondContact O-N 3.17Å; N342-C345 WeakPolarHBondContact O-CB 3.49Å; N342-C345 PolarHBondContact O-N 3Å
343	E	30.4	Very low	26.1	Very low	176 Å²	176	114.4 Å²	114.4	82%	0.822	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-34.9	-168.5	-63.7	-176	117.6	0	0	114.7	C345 C346	E343-C345 PolarHBondContact O-N 3.27Å; E343-C345 VanDerWaalsContact O-N 3.1Å; E343-C346 PolarHBondContact O-N 2.79Å
344	Q	27.8	Very low	26.3	Very low	161 Å²	161	113.6 Å²	113.6	75%	0.752	65%	0.651	S	S	*	*	H	α-helix	trans	-58.9	-21.9	179.2	-69.8	171.5	-37.2	0	0	114.2	N342 C346 T347	N342-Q344 PolarHBondContact O-N 3.17Å; Q344-C346 VanDerWaalsContact C-N 3.31Å; Q344-T347 PolarHBondContact O-OG1 2.76Å
345	C	25.3	Very low	26.5	Very low	81 Å²	81	115.4 Å²	115.4	55%	0.547	65%	0.654	S	S	.	*	H	α-helix	trans	-72.5	-26.1	177.4	-158.1	0	0	0	0	112.4	N342 E343	N342-C345 WeakPolarHBondContact O-CB 3.49Å; N342-C345 PolarHBondContact O-N 3Å; E343-C345 PolarHBondContact O-N 3.27Å; E343-C345 VanDerWaalsContact O-N 3.1Å
346	C	27.9	Very low	26.5	Very low	89 Å²	89	117.9 Å²	117.9	60%	0.601	65%	0.654	S	S	*	*	H	α-helix	trans	-78.2	-31.5	-179.1	-65.7	0	0	0	0	112.9	E343 Q344 V349 Y350	E343-C346 PolarHBondContact O-N 2.79Å; Q344-C346 VanDerWaalsContact C-N 3.31Å; C346-V349 PolarHBondContact O-N 3.41Å; C346-Y350 PolarHBondContact O-N 2.84Å
347	T	27.8	Very low	26.4	Very low	83 Å²	83	117.3 Å²	117.3	51%	0.509	66%	0.657	S	S	.	*	H	α-helix	trans	-67.2	-41.3	-173.9	-10.9	0	0	0	0	112.9	Q344 V349 Y350 Q351	Q344-T347 PolarHBondContact O-OG1 2.76Å; T347-V349 VanDerWaalsContact C-N 3.34Å; T347-V349 PolarHBondContact O-N 2.87Å; T347-Y350 PolarHBondContact O-N 3.17Å; T347-Q351 PolarHBondContact O-N 3.16Å
348	N	26.5	Very low	26.4	Very low	106 Å²	106	117.1 Å²	117.1	57%	0.567	65%	0.653	S	S	*	*	H	α-helix	trans	-68.4	-31.9	-178.6	-71.5	2.7	0	0	0	112.7	Y350 N352	N348-Y350 VanDerWaalsContact C-N 3.34Å; N348-N352 PolarHBondContact O-N 3.48Å; N348-N352 PolarHBondContact O-ND2 3.21Å
349	V	28.9	Very low	26.3	Very low	86 Å²	86	118.8 Å²	118.8	52%	0.521	66%	0.659	S	S	.	*	H	α-helix	trans	-66.6	-39.9	174.5	-178.4	0	0	0	0	110.5	C346 T347 Q351 N352 C353	C346-V349 PolarHBondContact O-N 3.41Å; T347-V349 VanDerWaalsContact C-N 3.34Å; T347-V349 PolarHBondContact O-N 2.87Å; V349-Q351 PolarHBondContact O-N 3.17Å; V349-N352 PolarHBondContact O-N 3.13Å; V349-C353 PolarHBondContact O-N 3.16Å
350	Y	27.2	Very low	26.2	Very low	143 Å²	143	118.9 Å²	118.9	56%	0.561	66%	0.658	S	S	*	*	H	α-helix	trans	-65.5	-37.7	-179.2	-161.7	-99	0	0	0	112.9	C346 T347 N348 Q354	C346-Y350 PolarHBondContact O-N 2.84Å; T347-Y350 PolarHBondContact O-N 3.17Å; N348-Y350 VanDerWaalsContact C-N 3.34Å; Y350-Q354 VanDerWaalsContact CE1-NE2 3.31Å
351	Q	27.1	Very low	26.1	Very low	124 Å²	124	121.6 Å²	121.6	58%	0.579	66%	0.663	S	S	*	*	H	α-helix	trans	-69.9	-44.7	175.8	-71.7	-174.4	-23.7	0	0	112.4	T347 V349 C353 Q354	T347-Q351 PolarHBondContact O-N 3.16Å; V349-Q351 PolarHBondContact O-N 3.17Å; Q351-C353 VanDerWaalsContact C-N 3.27Å; Q351-C353 PolarHBondContact O-N 3.12Å; Q351-Q354 PolarHBondContact O-N 3.37Å; Q351-Q354 VanDerWaalsContact O-N 3.1Å
352	N	27.6	Very low	25.9	Very low	106 Å²	106	124.7 Å²	124.7	57%	0.567	67%	0.665	S	S	*	*	H	α-helix	trans	-64.2	-29.1	-178	-76.1	-21.3	0	0	0	113.5	N348 V349 Q354	N348-N352 PolarHBondContact O-N 3.48Å; N348-N352 PolarHBondContact O-ND2 3.21Å; V349-N352 PolarHBondContact O-N 3.13Å; N352-Q354 VanDerWaalsContact C-N 3.32Å; N352-Q354 PolarHBondContact O-N 3.25Å
353	C	26.5	Very low	25.8	Very low	94 Å²	94	126.1 Å²	126.1	64%	0.635	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-73.3	-16	175.7	-71.1	0	0	0	0	114.6	V349 Q351	V349-C353 PolarHBondContact O-N 3.16Å; Q351-C353 VanDerWaalsContact C-N 3.27Å; Q351-C353 PolarHBondContact O-N 3.12Å
354	Q	27.8	Very low	25.4	Very low	129 Å²	129	125 Å²	125	60%	0.603	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-82.5	-14.9	-179.3	-68.5	-175.9	-1.6	0	0	113.7	Y350 Q351 N352	Y350-Q354 VanDerWaalsContact CE1-NE2 3.31Å; Q351-Q354 PolarHBondContact O-N 3.37Å; Q351-Q354 VanDerWaalsContact O-N 3.1Å; N352-Q354 VanDerWaalsContact C-N 3.32Å; N352-Q354 PolarHBondContact O-N 3.25Å
355	N	26.1	Very low	25.2	Very low	128 Å²	128	121.8 Å²	121.8	68%	0.684	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-90.7	5.3	-171.9	-67.5	-21.6	0	0	0	114.9
356	F	23.7	Very low	25.1	Very low	177 Å²	177	123.9 Å²	123.9	78%	0.776	69%	0.689	S	S	*	*			trans	-107.1	89.2	-177.9	-78.5	-84.1	0	0	0	112.6
357	T	21.6	Very low	24.9	Very low	125 Å²	125	126.5 Å²	126.5	77%	0.767	70%	0.695	S	S	*	*			trans	-90.1	120.6	167.4	40.3	0	0	0	0	110.8	T359	T357-T359 PolarHBondContact O-N 3.45Å
358	P	24.7	Very low	24.7	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	72%	0.715	S	S	*	*			trans	-74.1	115.3	178.2	-16.8	31.5	0	0	0	111.8
359	T	22.3	Very low	24.6	Very low	130 Å²	130	134.6 Å²	134.6	80%	0.798	73%	0.725	S	S	*	*			trans	-72.1	124.3	169.6	27.3	0	0	0	0	110.7	T357 I361	T357-T359 PolarHBondContact O-N 3.45Å; T359-I361 PolarHBondContact O-N 3.35Å
360	V	22.4	Very low	24.3	Very low	124 Å²	124	138.3 Å²	138.3	75%	0.752	74%	0.736	S	S	*	*			trans	-82.8	103.5	-179.9	-179.5	0	0	0	0	110	K362	V360-K362 HydrophobicContact CG1-CG 4.33Å
361	I	23.4	Very low	24.1	Very low	159 Å²	159	138.6 Å²	138.6	82%	0.815	75%	0.747	S	S	*	*			trans	-86	128.2	165.1	-59.5	178.3	0	0	0	108	T359	T359-I361 PolarHBondContact O-N 3.35Å
362	K	21.8	Very low	23.9	Very low	161 Å²	161	138.7 Å²	138.7	70%	0.7	76%	0.757	S	S	*	*			trans	-97.9	177.7	173	-68.8	-176.9	177.8	178.6	0	110.2	V360	V360-K362 HydrophobicContact CG1-CG 4.33Å
363	D	24	Very low	23.8	Very low	145 Å²	145	138.6 Å²	138.6	78%	0.775	76%	0.762	S	S	*	*			trans	74.8	74.4	170.1	-49.7	-23.5	0	0	0	115	S365	D363-S365 VanDerWaalsContact C-N 3.34Å; D363-S365 PolarHBondContact O-N 3.39Å; D363-S365 VanDerWaalsContact O-N 3.1Å
364	T	23	Very low	23.8	Very low	153 Å²	153	140.1 Å²	140.1	94%	0.939	77%	0.768	S	S	*	*			trans	-79.4	76.1	169.2	52.9	0	0	0	0	111.5
365	S	23.2	Very low	23.5	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	78%	0.779	S	S	*	*			trans	-146.2	147.5	164.9	57.8	0	0	0	0	111	D363	D363-S365 VanDerWaalsContact C-N 3.34Å; D363-S365 PolarHBondContact O-N 3.39Å; D363-S365 VanDerWaalsContact O-N 3.1Å
366	S	24	Very low	23.4	Very low	125 Å²	125	141.8 Å²	141.8	87%	0.874	78%	0.781	S	S	*	*	S	Bend	trans	70	43	172.6	-49.3	0	0	0	0	118.3
367	I	23.6	Very low	23.5	Very low	144 Å²	144	138.5 Å²	138.5	74%	0.738	78%	0.775	S	S	*	*			trans	-125.2	103.3	159.5	-56.1	-179	0	0	0	110.7	L369	I367-L369 HydrophobicContact CG2-CB 4.14Å; I367-L369 HydrophobicContact CG2-CD1 3.9Å; I367-L369 HydrophobicContact CG2-CG 4.08Å
368	K	22.4	Very low	23.6	Very low	214 Å²	214	141.9 Å²	141.9	93%	0.93	78%	0.779	S	S	*	*			trans	-93.2	120.6	151.7	-78.2	-177.2	176.1	-177.1	0	106.7
369	L	26.1	Very low	23.5	Very low	146 Å²	146	140.1 Å²	140.1	76%	0.764	77%	0.77	S	S	*	*			trans	-136.4	126.2	168.7	-97.5	169.4	0	0	0	110	I367	I367-L369 HydrophobicContact CG2-CB 4.14Å; I367-L369 HydrophobicContact CG2-CD1 3.9Å; I367-L369 HydrophobicContact CG2-CG 4.08Å
370	Q	21.8	Very low	23.5	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.762	77%	0.773	S	S	*	*			trans	-83.9	155.3	165.7	-67	157.1	-102.8	0	0	108.8
371	D	22.7	Very low	23.6	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	76%	0.761	S	S	*	*			trans	36.5	91.4	155.8	-51.5	-39.4	0	0	0	118.1
372	T	22.9	Very low	23.7	Very low	127 Å²	127	140.8 Å²	140.8	78%	0.779	77%	0.769	S	S	*	*			trans	-160.4	151.2	148.5	8.1	0	0	0	0	111.1
373	P	24.8	Very low	23.8	Very low	104 Å²	104	136 Å²	136	68%	0.675	76%	0.755	S	S	*	*			trans	-94	163.9	-162.1	37.3	-36.4	0	0	0	114.3
374	T	26.7	Very low	24.1	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	76%	0.755	S	S	*	*			trans	-131.2	61.9	166.7	19.7	0	0	0	0	112.1	L376	T374-L376 HydrophobicContact CG2-CD1 4.15Å; T374-L376 PolarHBondContact O-N 3.22Å
375	D	22.8	Very low	24.3	Very low	154 Å²	154	130.1 Å²	130.1	82%	0.824	73%	0.729	S	S	*	*			trans	-67.5	72.1	158.5	-82.5	-58.6	0	0	0	110.5	V377	D375-V377 PolarHBondContact O-N 3.28Å
376	L	24.3	Very low	24.5	Very low	138 Å²	138	130.3 Å²	130.3	72%	0.723	73%	0.726	S	S	*	*			trans	-100.5	73.7	174.2	-80.4	173.6	0	0	0	111.7	T374	T374-L376 HydrophobicContact CG2-CD1 4.15Å; T374-L376 PolarHBondContact O-N 3.22Å
377	V	24.4	Very low	24.8	Very low	108 Å²	108	128.5 Å²	128.5	66%	0.655	71%	0.713	S	S	*	*			trans	44.7	81.2	146.3	-165	0	0	0	0	116.5	D375	D375-V377 PolarHBondContact O-N 3.28Å
378	F	24	Very low	24.9	Very low	197 Å²	197	129.6 Å²	129.6	86%	0.864	71%	0.709	S	S	*	*			trans	-121.7	34.4	148.7	-84.9	-75.5	0	0	0	112
379	S	22.5	Very low	25.1	Very low	84 Å²	84	123.1 Å²	123.1	59%	0.587	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	143.3	161.5	41.3	0	0	0	0	110.2
380	N	23.3	Very low	25.2	Very low	161 Å²	161	120.8 Å²	120.8	86%	0.861	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.5	36.2	168.9	-53.4	-15.8	0	0	0	118.8
381	V	24.3	Very low	25.5	Very low	85 Å²	85	119.7 Å²	119.7	52%	0.515	68%	0.679	S	S	.	*			trans	-117.5	74	160.6	-169.2	0	0	0	0	111.6	C383	V381-C383 VanDerWaalsContact C-N 3.26Å; V381-C383 HydrophobicContact CG1-CB 4.12Å; V381-C383 PolarHBondContact O-N 2.94Å
382	N	25.4	Very low	25.6	Very low	181 Å²	181	118.6 Å²	118.6	97%	0.968	67%	0.67	S	S	*	*			trans	-74.7	77.5	166.1	-90.1	-17.4	0	0	0	110
383	C	24.8	Very low	25.9	Very low	61 Å²	61	114.9 Å²	114.9	41%	0.412	65%	0.647	S	S	.	*	S	Bend	trans	-145.2	149	175.9	-163.8	0	0	0	0	112.1	V381 T385	V381-C383 VanDerWaalsContact C-N 3.26Å; V381-C383 HydrophobicContact CG1-CB 4.12Å; V381-C383 PolarHBondContact O-N 2.94Å; C383-T385 WeakPolarHBondContact CB-OG1 3.48Å; C383-T385 PolarHBondContact O-N 3.09Å; C383-T385 VanDerWaalsContact O-N 3.12Å
384	S	29.2	Very low	26.1	Very low	112 Å²	112	113.1 Å²	113.1	78%	0.783	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-8.3	176.5	40	0	0	0	0	113.8	V386 S387	S384-V386 PolarHBondContact O-N 2.86Å; S384-S387 PolarHBondContact O-N 2.72Å
385	T	26.8	Very low	26.1	Very low	63 Å²	63	115.2 Å²	115.2	39%	0.387	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62	-14.9	176.6	49.4	0	0	0	0	115.1	C383 S387 Y388 C389	C383-T385 WeakPolarHBondContact CB-OG1 3.48Å; C383-T385 PolarHBondContact O-N 3.09Å; C383-T385 VanDerWaalsContact O-N 3.12Å; T385-S387 PolarHBondContact O-N 3.19Å; T385-Y388 CarbonylContact O-C 3.58Å; T385-Y388 WeakPolarHBondContact O-CA 3.49Å; T385-Y388 VanDerWaalsContact O-CB 3.31Å; T385-Y388 WeakPolarHBondContact O-CB 3.33Å; T385-Y388 PolarHBondContact O-N 2.94Å; T385-C389 PolarHBondContact O-N 3.14Å; T385-C389 PolarHBondContact O-SG 3.3Å
386	V	28.7	Very low	26.4	Very low	95 Å²	95	112.8 Å²	112.8	58%	0.576	62%	0.623	S	S	*	*	H	α-helix	trans	-56.1	-34.9	172.5	-179.7	0	0	0	0	111.3	S384 Y388 T390	S384-V386 PolarHBondContact O-N 2.86Å; V386-Y388 PolarHBondContact O-N 3.36Å; V386-T390 PolarHBondContact O-N 3.15Å; V386-T390 PolarHBondContact O-OG1 3.21Å
387	S	28.7	Very low	26.6	Very low	88 Å²	88	109.3 Å²	109.3	62%	0.615	61%	0.607	S	S	*	*	H	α-helix	trans	-71.7	-11.1	174.5	-167.9	0	0	0	0	114.2	S384 T385 T390	S384-S387 PolarHBondContact O-N 2.72Å; T385-S387 PolarHBondContact O-N 3.19Å; S387-T390 VanDerWaalsContact C-OG1 3.26Å; S387-T390 WeakPolarHBondContact CA-OG1 3.45Å; S387-T390 PolarHBondContact O-OG1 3.34Å; S387-T390 VanDerWaalsContact O-OG1 3.08Å
388	Y	25.7	Very low	26.8	Very low	166 Å²	166	110 Å²	110	65%	0.651	61%	0.607	S	S	*	*	H	α-helix	trans	-102.2	-37.1	-179.5	-137.2	-93.4	0	0	0	111	T385 V386 T390 M391 M392	T385-Y388 CarbonylContact O-C 3.58Å; T385-Y388 WeakPolarHBondContact O-CA 3.49Å; T385-Y388 VanDerWaalsContact O-CB 3.31Å; T385-Y388 WeakPolarHBondContact O-CB 3.33Å; T385-Y388 PolarHBondContact O-N 2.94Å; V386-Y388 PolarHBondContact O-N 3.36Å; Y388-T390 PolarHBondContact O-N 2.96Å; Y388-M391 WeakPolarHBondContact O-CA 3.36Å; Y388-M391 WeakPolarHBondContact O-CB 3.4Å; Y388-M391 PolarHBondContact O-N 3.46Å; Y388-M392 PolarHBondContact O-N 3.35Å
389	C	26.9	Very low	27	Very low	79 Å²	79	105.4 Å²	105.4	53%	0.534	60%	0.595	S	S	.	*	H	α-helix	trans	-61.4	-31.9	170.4	-62.4	0	0	0	0	112	T385 M391 M392 T393	T385-C389 PolarHBondContact O-N 3.14Å; T385-C389 PolarHBondContact O-SG 3.3Å; C389-M391 PolarHBondContact O-N 3.26Å; C389-M392 PolarHBondContact O-N 3.23Å; C389-T393 PolarHBondContact O-OG1 3.45Å
390	T	29.7	Very low	27.3	Very low	96 Å²	96	105 Å²	105	59%	0.589	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-6.5	169.5	49.1	0	0	0	0	114.8	V386 S387 Y388 T393	V386-T390 PolarHBondContact O-N 3.15Å; V386-T390 PolarHBondContact O-OG1 3.21Å; S387-T390 VanDerWaalsContact C-OG1 3.26Å; S387-T390 WeakPolarHBondContact CA-OG1 3.45Å; S387-T390 PolarHBondContact O-OG1 3.34Å; S387-T390 VanDerWaalsContact O-OG1 3.08Å; Y388-T390 PolarHBondContact O-N 2.96Å; T390-T393 VanDerWaalsContact C-OG1 3.26Å; T390-T393 VanDerWaalsContact CA-OG1 3.3Å; T390-T393 WeakPolarHBondContact CA-OG1 3.42Å; T390-T393 PolarHBondContact O-OG1 2.94Å
391	M	26.6	Very low	27.6	Very low	140 Å²	140	101.3 Å²	101.3	69%	0.69	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-19.7	170.6	-59.8	-173.5	69	0	0	112.4	Y388 C389 T393	Y388-M391 WeakPolarHBondContact O-CA 3.36Å; Y388-M391 WeakPolarHBondContact O-CB 3.4Å; Y388-M391 PolarHBondContact O-N 3.46Å; C389-M391 PolarHBondContact O-N 3.26Å; M391-T393 VanDerWaalsContact C-N 3.25Å; M391-T393 PolarHBondContact O-N 3.39Å
392	M	25.2	Very low	27.7	Very low	127 Å²	127	100.9 Å²	100.9	63%	0.626	57%	0.573	S	S	*	*	S	Bend	trans	-86.2	11.5	175	-63.2	-66.5	-112.5	0	0	113.2	Y388 C389 P394	Y388-M392 PolarHBondContact O-N 3.35Å; C389-M392 PolarHBondContact O-N 3.23Å; M392-P394 VanDerWaalsContact O-CD 3.31Å; M392-P394 WeakPolarHBondContact O-CD 3.3Å
393	T	30.3	Very low	27.9	Very low	48 Å²	48	98.1 Å²	98.1	29%	0.294	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-86.8	10.7	-171.7	-23.3	0	0	0	0	118.7	C389 T390 M391 H395 I396	C389-T393 PolarHBondContact O-OG1 3.45Å; T390-T393 VanDerWaalsContact C-OG1 3.26Å; T390-T393 VanDerWaalsContact CA-OG1 3.3Å; T390-T393 WeakPolarHBondContact CA-OG1 3.42Å; T390-T393 PolarHBondContact O-OG1 2.94Å; M391-T393 VanDerWaalsContact C-N 3.25Å; M391-T393 PolarHBondContact O-N 3.39Å; T393-H395 PolarHBondContact O-N 2.94Å; T393-I396 HydrophobicContact CG2-CB 4Å; T393-I396 HydrophobicContact CG2-CD1 4.28Å; T393-I396 HydrophobicContact CG2-CG1 4.28Å; T393-I396 PolarHBondContact O-N 3.39Å
394	P	28.7	Very low	28.1	Very low	68 Å²	68	99.7 Å²	99.7	44%	0.442	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-55.5	-20.2	175.4	-27.9	35.9	0	0	0	116.3	M392 T397	M392-P394 VanDerWaalsContact O-CD 3.31Å; M392-P394 WeakPolarHBondContact O-CD 3.3Å; P394-T397 PolarHBondContact O-OG1 3.07Å; P394-T397 VanDerWaalsContact O-OG1 3.12Å
395	H	26.9	Very low	28	Very low	169 Å²	169	97.2 Å²	97.2	78%	0.782	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-88.8	-17.1	-177.3	-80.1	-86.1	0	0	0	115.1	T393	T393-H395 PolarHBondContact O-N 2.94Å
396	I	29	Very low	28.1	Very low	103 Å²	103	101.1 Å²	101.1	53%	0.528	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.4	-10.8	-176.5	-46.7	-178.8	0	0	0	111.5	T393 N398 T399 N400	T393-I396 HydrophobicContact CG2-CB 4Å; T393-I396 HydrophobicContact CG2-CD1 4.28Å; T393-I396 HydrophobicContact CG2-CG1 4.28Å; T393-I396 PolarHBondContact O-N 3.39Å; I396-N398 PolarHBondContact O-N 3.25Å; I396-T399 PolarHBondContact O-OG1 3.3Å; I396-N400 PolarHBondContact O-ND2 2.76Å
397	T	27.7	Very low	28.1	Very low	64 Å²	64	102.9 Å²	102.9	39%	0.393	57%	0.57	S	S	.	*	H	α-helix	trans	-67.3	-32.8	176.2	42.2	0	0	0	0	113.2	P394 T399 N400 N401	P394-T397 PolarHBondContact O-OG1 3.07Å; P394-T397 VanDerWaalsContact O-OG1 3.12Å; T397-T399 VanDerWaalsContact C-N 3.33Å; T397-T399 PolarHBondContact O-N 3.47Å; T397-N400 PolarHBondContact O-N 3.48Å; T397-N401 PolarHBondContact O-N 2.85Å; T397-N401 PolarHBondContact O-ND2 2.77Å; T397-N401 PolarHBondContact O-OD1 2.79Å
398	N	27.5	Very low	28	Very low	123 Å²	123	104.3 Å²	104.3	66%	0.658	58%	0.575	S	S	*	*	H	α-helix	trans	-66.6	-28	-174.1	-76.6	-6.2	0	0	0	114.6	I396	I396-N398 PolarHBondContact O-N 3.25Å
399	T	28.8	Very low	28.2	Very low	100 Å²	100	100.9 Å²	100.9	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-81.4	-38.9	173.1	48.4	0	0	0	0	111.9	I396 T397 N401 A402	I396-T399 PolarHBondContact O-OG1 3.3Å; T397-T399 VanDerWaalsContact C-N 3.33Å; T397-T399 PolarHBondContact O-N 3.47Å; T399-N401 VanDerWaalsContact C-N 3.28Å; T399-N401 PolarHBondContact O-N 3.14Å; T399-A402 PolarHBondContact O-N 2.83Å
400	N	29.9	Very low	28.1	Very low	75 Å²	75	102 Å²	102	40%	0.401	57%	0.573	S	S	.	*	H	α-helix	trans	-65.1	-30.4	175.8	-74	-72	0	0	0	112.9	I396 T397 A402 I403 I404	I396-N400 PolarHBondContact O-ND2 2.76Å; T397-N400 PolarHBondContact O-N 3.48Å; N400-A402 PolarHBondContact O-N 3.1Å; N400-I403 PolarHBondContact O-N 3.3Å; N400-I404 HydrophobicContact CB-CD1 4.2Å; N400-I404 WeakPolarHBondContact O-CG1 3.48Å; N400-I404 PolarHBondContact O-N 3.32Å
401	N	28.3	Very low	28.2	Very low	85 Å²	85	103.3 Å²	103.3	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-58	-29.4	177.1	-73.2	-15.1	0	0	0	113.2	T397 T399 I403 A405	T397-N401 PolarHBondContact O-N 2.85Å; T397-N401 PolarHBondContact O-ND2 2.77Å; T397-N401 PolarHBondContact O-OD1 2.79Å; T399-N401 VanDerWaalsContact C-N 3.28Å; T399-N401 PolarHBondContact O-N 3.14Å; N401-I403 VanDerWaalsContact C-N 3.31Å; N401-I403 PolarHBondContact O-N 3.21Å; N401-A405 PolarHBondContact O-N 3.12Å; N401-A405 VanDerWaalsContact O-N 3.15Å
402	A	26.6	Very low	28.4	Very low	76 Å²	76	100.2 Å²	100.2	63%	0.628	57%	0.567	S	S	*	*	H	α-helix	trans	-70.1	-26	175.4	0	0	0	0	0	113.4	T399 N400	T399-A402 PolarHBondContact O-N 2.83Å; N400-A402 PolarHBondContact O-N 3.1Å
403	I	29.2	Very low	28.9	Very low	123 Å²	123	98.1 Å²	98.1	63%	0.631	57%	0.565	S	S	*	*	H	α-helix	trans	-89	-35.5	176.9	-61.1	170.1	0	0	0	110.2	N400 N401 A405 N406	N400-I403 PolarHBondContact O-N 3.3Å; N401-I403 VanDerWaalsContact C-N 3.31Å; N401-I403 PolarHBondContact O-N 3.21Å; I403-A405 VanDerWaalsContact C-N 3.25Å; I403-A405 PolarHBondContact O-N 3.02Å; I403-N406 PolarHBondContact O-N 3.41Å
404	I	29.6	Very low	29.3	Very low	93 Å²	93	100.8 Å²	100.8	48%	0.477	58%	0.578	S	S	.	*	H	α-helix	trans	-69	-22.6	177.7	-66.3	164.8	0	0	0	112	N400 N406 L407	N400-I404 HydrophobicContact CB-CD1 4.2Å; N400-I404 WeakPolarHBondContact O-CG1 3.48Å; N400-I404 PolarHBondContact O-N 3.32Å; I404-N406 PolarHBondContact O-N 2.82Å; I404-N406 VanDerWaalsContact O-N 3.1Å; I404-L407 PolarHBondContact O-N 3.47Å
405	A	27.3	Very low	30.2	Very low	60 Å²	60	100.5 Å²	100.5	50%	0.496	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.9	-23.6	176.1	0	0	0	0	0	114.5	N401 I403 T408	N401-A405 PolarHBondContact O-N 3.12Å; N401-A405 VanDerWaalsContact O-N 3.15Å; I403-A405 VanDerWaalsContact C-N 3.25Å; I403-A405 PolarHBondContact O-N 3.02Å; A405-T408 PolarHBondContact O-OG1 2.75Å; A405-T408 VanDerWaalsContact O-OG1 3.13Å
406	N	29.4	Very low	31.8	Very low	146 Å²	146	98.1 Å²	98.1	78%	0.781	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	5.8	176.4	-67.9	-12.5	0	0	0	113.4	I403 I404	I403-N406 PolarHBondContact O-N 3.41Å; I404-N406 PolarHBondContact O-N 2.82Å; I404-N406 VanDerWaalsContact O-N 3.1Å
407	L	29.1	Very low	33.6	Very low	131 Å²	131	94.1 Å²	94.1	69%	0.686	56%	0.555	S	S	*	*			trans	-114.1	43.9	176.1	-68.1	174.5	0	0	0	111.2	I404 I409	I404-L407 PolarHBondContact O-N 3.47Å; L407-I409 VanDerWaalsContact C-N 3.32Å; L407-I409 PolarHBondContact O-N 2.95Å
408	T	26.5	Very low	35.4	Very low	118 Å²	118	94.4 Å²	94.4	72%	0.724	56%	0.558	S	S	*	*			trans	-66.9	86.2	177.4	-45.2	0	0	0	0	110.6	A405	A405-T408 PolarHBondContact O-OG1 2.75Å; A405-T408 VanDerWaalsContact O-OG1 3.13Å
409	I	29.5	Very low	37	Very low	94 Å²	94	95.7 Å²	95.7	48%	0.482	56%	0.563	S	S	.	*			trans	-53.1	129.4	170.5	-57.8	175.2	0	0	0	108	L407 V411	L407-I409 VanDerWaalsContact C-N 3.32Å; L407-I409 PolarHBondContact O-N 2.95Å; I409-V411 PolarHBondContact O-N 3.29Å
410	P	25.2	Very low	38.3	Very low	103 Å²	103	93.3 Å²	93.3	67%	0.669	55%	0.546	S	S	*	.			trans	-57.7	108.1	170.7	-23.9	34.5	0	0	0	109.9	D412	P410-D412 PolarHBondContact O-N 2.96Å
411	V	31.8	Very low	39.7	Very low	124 Å²	124	95.7 Å²	95.7	75%	0.752	56%	0.558	S	S	*	*			trans	-78.4	100	167.2	-180	0	0	0	0	106	I409 S413	I409-V411 PolarHBondContact O-N 3.29Å; V411-S413 PolarHBondContact O-N 3.07Å; V411-S413 PolarHBondContact O-OG 3.26Å; V411-S413 VanDerWaalsContact O-OG 3.09Å
412	D	30.1	Very low	41	Very low	74 Å²	74	94.8 Å²	94.8	40%	0.396	55%	0.553	S	S	.	*			trans	-53.5	103.6	-178.9	-67.7	-53.3	0	0	0	110.5	P410 N414 N415 R488	P410-D412 PolarHBondContact O-N 2.96Å; D412-N414 PolarHBondContact O-N 3.19Å; D412-N415 WeakPolarHBondContact O-CB 3.5Å; D412-N415 PolarHBondContact O-N 3.12Å; D412-R488 IonicContact OD2-CZ 3.26Å; D412-R488 IonicContact OD2-NH1 3.37Å; D412-R488 PolarHBondContact OD2-NH1 3.24Å; D412-R488 IonicContact OD2-NH2 2.88Å; D412-R488 PolarHBondContact OD2-NH2 3.3Å
413	S	36.3	Very low	42.1	Very low	84 Å²	84	96.3 Å²	96.3	59%	0.587	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	6.7	-167	-59.5	0	0	0	0	114.1	V411	V411-S413 PolarHBondContact O-N 3.07Å; V411-S413 PolarHBondContact O-OG 3.26Å; V411-S413 VanDerWaalsContact O-OG 3.09Å
414	N	37.1	Very low	43.2	Very low	104 Å²	104	95.1 Å²	95.1	56%	0.556	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	6.3	178.9	-68.8	-20.8	0	0	0	112.8	D412 S416	D412-N414 PolarHBondContact O-N 3.19Å; N414-S416 PolarHBondContact O-N 2.9Å
415	N	48.3	Very low	44.3	Very low	62 Å²	62	97.8 Å²	97.8	33%	0.332	56%	0.561	S	S	.	*			trans	-75.7	110.6	-174.3	-166.6	-13.8	0	0	0	111.9	D412 N417	D412-N415 WeakPolarHBondContact O-CB 3.5Å; D412-N415 PolarHBondContact O-N 3.12Å; N415-N417 PolarHBondContact O-N 3.45Å; N415-N417 VanDerWaalsContact O-N 3.15Å; N415-N417 WeakPolarHBondContact OD1-CB 3.46Å; N415-N417 PolarHBondContact OD1-N 3.42Å; N415-N417 PolarHBondContact OD1-ND2 3.22Å
416	S	60.6	Low	45.5	Very low	119 Å²	119	99.6 Å²	99.6	83%	0.832	56%	0.562	S	S	*	*			trans	-74.9	5	-176.8	53.7	0	0	0	0	115.2	N414	N414-S416 PolarHBondContact O-N 2.9Å
417	N	66.9	Low	46.2	Very low	19 Å²	19	98.3 Å²	98.3	10%	0.102	55%	0.551	C	S	.	*	S	Bend	trans	-83.8	142.2	-178.1	-67.9	-58.7	0	0	0	112.5	N415 I419 P466 Y467 I468 L484	N415-N417 PolarHBondContact O-N 3.45Å; N415-N417 VanDerWaalsContact O-N 3.15Å; N415-N417 WeakPolarHBondContact OD1-CB 3.46Å; N415-N417 PolarHBondContact OD1-N 3.42Å; N415-N417 PolarHBondContact OD1-ND2 3.22Å; N417-I419 PolarHBondContact O-N 3.46Å; N417-P466 PolarHBondContact OD1-O 2.62Å; N417-Y467 HydrophobicContact CB-CD1 3.75Å; N417-Y467 HydrophobicContact CB-CE1 4.16Å; N417-Y467 VanDerWaalsContact OD1-CA 3.32Å; N417-Y467 WeakPolarHBondContact OD1-CA 3.33Å; N417-I468 PolarHBondContact ND2-O 3.02Å; N417-I468 PolarHBondContact OD1-N 2.86Å; N417-L484 VanDerWaalsContact ND2-CD2 3.27Å; N417-L484 WeakPolarHBondContact ND2-CD2 3.48Å
418	P	64.6	Low	46.8	Very low	70 Å²	70	98.1 Å²	98.1	46%	0.455	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-61.2	134.8	-176.2	-24.3	34.6	0	0	0	113.7	D420 P466 Y467	P418-D420 PolarHBondContact O-N 2.85Å; P418-P466 HydrophobicContact CG-CB 4.26Å; P418-Y467 WeakPolarHBondContact O-CE1 3.4Å; P418-Y467 PolarHBondContact O-OH 2.36Å
419	I	62.5	Low	47.6	Very low	150 Å²	150	100.1 Å²	100.1	77%	0.769	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-77.3	116.7	174.6	-56.8	177.8	0	0	0	109.3	N417 I421	N417-I419 PolarHBondContact O-N 3.46Å; I419-I421 VanDerWaalsContact C-N 3.33Å; I419-I421 HydrophobicContact CG2-CG1 4.31Å; I419-I421 PolarHBondContact O-N 3.06Å
420	D	56.6	Low	48	Very low	49 Å²	49	99 Å²	99	26%	0.262	57%	0.569	S	S	.	*			trans	-70.8	88.7	168.9	-90.8	-27.7	0	0	0	108.9	P418 D422 R459 Y467	P418-D420 PolarHBondContact O-N 2.85Å; D420-D422 PolarHBondContact O-N 3.15Å; D420-D422 VanDerWaalsContact O-N 3.13Å; D420-R459 IonicContact OD1-CZ 2.74Å; D420-R459 IonicContact OD1-NH1 2.74Å; D420-R459 PolarHBondContact OD1-NH1 3.1Å; D420-R459 IonicContact OD1-NH2 3.44Å; D420-R459 PolarHBondContact OD1-NH2 2.96Å; D420-R459 IonicContact OD2-CZ 3.09Å; D420-R459 IonicContact OD2-NH1 2.83Å; D420-R459 PolarHBondContact OD2-NH1 3.47Å; D420-R459 IonicContact OD2-NH2 3.49Å; D420-Y467 PolarHBondContact OD1-OH 3.33Å; D420-Y467 PolarHBondContact OD2-OH 3.32Å; D420-Y467 VanDerWaalsContact OD2-OH 3.14Å
421	I	58.2	Low	48.5	Very low	126 Å²	126	103.1 Å²	103.1	65%	0.646	58%	0.584	S	S	*	*			trans	-66.4	109.3	178	-58.8	175.1	0	0	0	109.4	I419 N423	I419-I421 VanDerWaalsContact C-N 3.33Å; I419-I421 HydrophobicContact CG2-CG1 4.31Å; I419-I421 PolarHBondContact O-N 3.06Å; I421-N423 PolarHBondContact O-N 3.47Å
422	D	56.8	Low	49	Very low	65 Å²	65	99.7 Å²	99.7	35%	0.348	57%	0.573	S	S	.	*			trans	-87.3	93	177.1	-164.7	31.2	0	0	0	111.2	D420 N424 K450 S452	D420-D422 PolarHBondContact O-N 3.15Å; D420-D422 VanDerWaalsContact O-N 3.13Å; D422-N424 PolarHBondContact O-N 2.84Å; D422-K450 WeakPolarHBondContact OD1-CD 3.17Å; D422-K450 IonicContact OD1-NZ 2.62Å; D422-K450 PolarHBondContact OD1-NZ 3.13Å; D422-K450 IonicContact OD2-NZ 3.21Å; D422-K450 PolarHBondContact OD2-NZ 3.18Å; D422-S452 PolarHBondContact OD1-OG 2.81Å
423	N	48.5	Very low	49.8	Very low	109 Å²	109	108.4 Å²	108.4	58%	0.583	60%	0.601	S	S	*	*			trans	-62.6	97.6	173.2	-81.1	-2.3	0	0	0	110	I421 N425	I421-N423 PolarHBondContact O-N 3.47Å; N423-N425 PolarHBondContact O-N 2.92Å
424	N	52.6	Low	51	Low	97 Å²	97	108.6 Å²	108.6	52%	0.519	60%	0.598	S	S	.	*			trans	-70.5	2.4	-170.8	-110.8	-22.2	0	0	0	115.6	D422 N426 H427 K450	D422-N424 PolarHBondContact O-N 2.84Å; N424-N426 PolarHBondContact O-N 2.61Å; N424-H427 PolarHBondContact O-N 3.47Å; N424-K450 PolarHBondContact OD1-NZ 2.89Å
425	N	52.3	Low	52.3	Low	149 Å²	149	112 Å²	112	80%	0.797	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	17.9	-167.5	-58.6	3.3	0	0	0	115.4	N423	N423-N425 PolarHBondContact O-N 2.92Å
426	N	52.6	Low	54	Low	99 Å²	99	110.9 Å²	110.9	53%	0.529	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.2	10.8	178.9	-102.7	9	0	0	0	113.5	N424 F449	N424-N426 PolarHBondContact O-N 2.61Å; N426-F449 PolarHBondContact ND2-O 3.44Å; N426-F449 VanDerWaalsContact ND2-O 3.14Å
427	H	43.8	Very low	55.1	Low	119 Å²	119	108.1 Å²	108.1	55%	0.551	58%	0.579	S	S	*	*			trans	-97.6	92.6	166.5	-76.7	-71.5	0	0	0	110.4	N424 K450	N424-H427 PolarHBondContact O-N 3.47Å; H427-K450 WeakPolarHBondContact NE2-CE 3.39Å; H427-K450 PolarHBondContact NE2-NZ 3.32Å
428	N	42.4	Very low	56.1	Low	127 Å²	127	115.6 Å²	115.6	68%	0.679	61%	0.606	S	S	*	*			trans	172.8	164.1	140.4	-87.8	-20.3	0	0	0	111.4
429	N	42.3	Very low	57.3	Low	160 Å²	160	113 Å²	113	86%	0.856	59%	0.59	S	S	*	*			trans	75.8	124.6	175.9	-52.7	-15.3	0	0	0	116
430	G	38	Very low	58.5	Low	70 Å²	70	113.9 Å²	113.9	72%	0.722	60%	0.596	S	S	*	*	S	Bend	trans	-87.1	175.3	178.2	0	0	0	0	0	113.8	G432	G430-G432 PolarHBondContact O-N 3.14Å
431	L	37	Very low	60	Low	190 Å²	190	117 Å²	117	100%	0.995	61%	0.607	S	S	*	*	S	Bend	trans	54.8	24.6	169.9	-65.7	166.8	0	0	0	116.2
432	G	41.4	Very low	61.3	Low	51 Å²	51	118.5 Å²	118.5	53%	0.526	62%	0.616	S	S	.	*	S	Bend	trans	-101.3	155.8	164.8	0	0	0	0	0	112.3	G430 V434	G430-G432 PolarHBondContact O-N 3.14Å; G432-V434 VanDerWaalsContact C-N 3.28Å; G432-V434 WeakPolarHBondContact O-CG2 3.4Å; G432-V434 PolarHBondContact O-N 3.32Å
433	R	48.3	Very low	62.8	Low	257 Å²	257	118.7 Å²	118.7	97%	0.97	63%	0.634	S	S	*	*			trans	-74.1	73.7	-179.5	-162.2	-178.7	-157.7	163.8	5.8	111.4	K435	R433-K435 PolarHBondContact O-N 2.91Å
434	V	60.7	Low	64.7	Low	89 Å²	89	114.4 Å²	114.4	54%	0.539	61%	0.612	S	S	.	*			trans	-55.3	119.4	-169	-165.9	0	0	0	0	112	G432 S436 F449	G432-V434 VanDerWaalsContact C-N 3.28Å; G432-V434 WeakPolarHBondContact O-CG2 3.4Å; G432-V434 PolarHBondContact O-N 3.32Å; V434-S436 PolarHBondContact O-N 2.72Å; V434-F449 HydrophobicContact CB-CD1 4.16Å; V434-F449 HydrophobicContact CB-CE1 4.2Å; V434-F449 HydrophobicContact CG1-CD1 3.54Å; V434-F449 HydrophobicContact CG1-CE1 4.08Å; V434-F449 HydrophobicContact CG1-CG 4.37Å
435	K	65.2	Low	66.5	Low	174 Å²	174	116.3 Å²	116.3	76%	0.757	63%	0.627	S	S	*	*			trans	-69.8	103.3	177.4	-172.9	173.1	-177.8	175.4	0	109.5	R433	R433-K435 PolarHBondContact O-N 2.91Å
436	S	82.9	Confident	68.2	Low	40 Å²	40	114.4 Å²	114.4	28%	0.28	61%	0.612	S	S	.	*			trans	-91.1	141.4	176.2	49.9	0	0	0	0	111.7	V434	V434-S436 PolarHBondContact O-N 2.72Å
437	H	84.5	Confident	69.8	Low	61 Å²	61	111.8 Å²	111.8	28%	0.282	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91	104.1	174.2	-64.1	-85.2	0	0	0	108.5	A447 Y448 L454	H437-A447 WeakPolarHBondContact O-CA 3.49Å; H437-Y448 WeakPolarHBondContact CB-O 3.44Å; H437-Y448 PolarHBondContact N-O 2.86Å; H437-Y448 PolarHBondContact O-N 3.09Å; H437-L454 HydrophobicContact CB-CB 3.87Å; H437-L454 HydrophobicContact CB-CD2 3.67Å; H437-L454 HydrophobicContact CB-CG 4.33Å
438	R	86.8	Confident	72	Confident	176 Å²	176	109 Å²	109	66%	0.664	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.2	152.4	178.4	-56.8	-174.5	-170.4	-89.5	0.9	111	A447 L454	R438-A447 HydrophobicContact CG-CB 4.02Å; R438-L454 VanDerWaalsContact O-CD2 3.27Å; R438-L454 WeakPolarHBondContact O-CD2 3.13Å
439	C	89.7	Confident	73.9	Confident	16 Å²	16	109.2 Å²	109.2	11%	0.108	58%	0.584	C	S	.	*			trans	-67.1	147.8	164.1	-155	0	0	0	0	110.6	C444 K446 L454 H457 H461	C439-C444 HydrophobicContact CB-CB 4.11Å; C439-K446 PolarHBondContact N-O 3.32Å; C439-L454 HydrophobicContact CB-CD1 4.31Å; C439-H457 PolarHBondContact SG-NE2 2.81Å; C439-H461 PolarHBondContact SG-CD2 3.15Å; C439-H461 PolarHBondContact SG-NE2 3.49Å
440	N	88.4	Confident	75.8	Confident	168 Å²	168	102.4 Å²	102.4	90%	0.898	55%	0.547	S	S	*	.			trans	-117.7	21.9	177.5	-160.5	88.4	0	0	0	111.1
441	F	87.4	Confident	78.1	Confident	114 Å²	114	101.8 Å²	101.8	50%	0.5	53%	0.532	S	S	.	.	S	Bend	trans	-95.8	139.8	173.4	-160.1	-89.4	0	0	0	108.8	C444 H461	F441-C444 HydrophobicContact CB-CB 4.34Å; F441-C444 VanDerWaalsContact O-CB 3.3Å; F441-C444 WeakPolarHBondContact O-CB 3.45Å; F441-C444 PolarHBondContact O-N 2.79Å; F441-C444 VanDerWaalsContact O-N 3.09Å; F441-H461 HydrophobicContact CB-CB 4.38Å; F441-H461 HydrophobicContact CD1-CB 4.29Å; F441-H461 AromaticContact CD1-CG 3.88Å; F441-H461 AromaticContact CD1-ND1 3.5Å; F441-H461 HydrophobicContact CD2-CB 3.74Å; F441-H461 AromaticContact CE1-ND1 4Å; F441-H461 HydrophobicContact CE2-CB 4.03Å; F441-H461 HydrophobicContact CG-CB 3.87Å; F441-H461 AromaticContact CG-CD2 3.98Å; F441-H461 AromaticContact CG-CG 3.64Å; F441-H461 AromaticContact CG-ND1 3.78Å; F441-H461 HydrophobicContact CZ-CB 4.43Å
442	D	86.7	Confident	80.2	Confident	157 Å²	157	93.7 Å²	93.7	84%	0.84	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	147.9	-174.9	-167.5	21.5	0	0	0	112	C444	D442-C444 PolarHBondContact O-N 3.43Å
443	G	87.5	Confident	82.3	Confident	70 Å²	70	95.9 Å²	95.9	72%	0.722	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	-5.3	-170.5	0	0	0	0	0	115.9
444	C	89.1	Confident	84.2	Confident	18 Å²	18	84.8 Å²	84.8	12%	0.122	45%	0.447	C	S	.	.			trans	-98.5	99.3	-173	-159	0	0	0	0	114.6	C439 F441 D442 K446 H457 H461	C439-C444 HydrophobicContact CB-CB 4.11Å; F441-C444 HydrophobicContact CB-CB 4.34Å; F441-C444 VanDerWaalsContact O-CB 3.3Å; F441-C444 WeakPolarHBondContact O-CB 3.45Å; F441-C444 PolarHBondContact O-N 2.79Å; F441-C444 VanDerWaalsContact O-N 3.09Å; D442-C444 PolarHBondContact O-N 3.43Å; C444-K446 VanDerWaalsContact C-N 3.28Å; C444-K446 PolarHBondContact O-N 3.02Å; C444-H457 PolarHBondContact SG-NE2 3.4Å; C444-H461 WeakPolarHBondContact CB-CE1 3.45Å; C444-H461 WeakPolarHBondContact CB-NE2 3.26Å; C444-H461 PolarHBondContact SG-CE1 2.96Å; C444-H461 PolarHBondContact SG-NE2 2.98Å
445	T	88.6	Confident	85.4	Confident	137 Å²	137	87.4 Å²	87.4	84%	0.84	45%	0.452	S	S	*	.			trans	-79	2.3	-179.4	56	0	0	0	0	115.5
446	K	88.7	Confident	86.4	Confident	110 Å²	110	79.7 Å²	79.7	48%	0.478	42%	0.42	S	S	.	.			trans	-72.7	139.6	-170.7	-63.3	-176.9	-176.5	175.1	0	112.6	C439 C444 Y448	C439-K446 PolarHBondContact N-O 3.32Å; C444-K446 VanDerWaalsContact C-N 3.28Å; C444-K446 PolarHBondContact O-N 3.02Å; K446-Y448 HydrophobicContact CB-CE2 3.8Å
447	A	87.4	Confident	86.6	Confident	44 Å²	44	78.2 Å²	78.2	36%	0.364	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.9	-179.9	0	0	0	0	0	112	H437 R438	H437-A447 WeakPolarHBondContact O-CA 3.49Å; R438-A447 HydrophobicContact CG-CB 4.02Å
448	Y	88.2	Confident	86.8	Confident	60 Å²	60	78.6 Å²	78.6	24%	0.235	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.3	-169.7	-62.4	-89.8	0	0	0	111.7	H437 K446 H453 L454 H457	H437-Y448 WeakPolarHBondContact CB-O 3.44Å; H437-Y448 PolarHBondContact N-O 2.86Å; H437-Y448 PolarHBondContact O-N 3.09Å; K446-Y448 HydrophobicContact CB-CE2 3.8Å; Y448-H453 HydrophobicContact CD1-CB 3.65Å; Y448-H453 HydrophobicContact CG-CB 4.06Å; Y448-L454 HydrophobicContact CD2-CB 4.32Å; Y448-L454 HydrophobicContact CD2-CD1 4.06Å; Y448-H457 HydrophobicContact CD2-CB 4.36Å; Y448-H457 HydrophobicContact CE1-CB 4.43Å; Y448-H457 HydrophobicContact CE2-CB 3.6Å; Y448-H457 AromaticContact CE2-CD2 3.37Å; Y448-H457 WeakPolarHBondContact CE2-CD2 3.09Å; Y448-H457 AromaticContact CE2-CG 3.54Å; Y448-H457 AromaticContact CZ-CD2 3.99Å; Y448-H457 AromaticContact CZ-CG 3.71Å
449	F	83.7	Confident	86.9	Confident	131 Å²	131	71.7 Å²	71.7	58%	0.575	39%	0.386	S	S	*	.	S	Bend	trans	-79.3	-18	179.3	-57.5	-64.7	0	0	0	114.1	N426 V434	N426-F449 PolarHBondContact ND2-O 3.44Å; N426-F449 VanDerWaalsContact ND2-O 3.14Å; V434-F449 HydrophobicContact CB-CD1 4.16Å; V434-F449 HydrophobicContact CB-CE1 4.2Å; V434-F449 HydrophobicContact CG1-CD1 3.54Å; V434-F449 HydrophobicContact CG1-CE1 4.08Å; V434-F449 HydrophobicContact CG1-CG 4.37Å
450	K	82.3	Confident	86.7	Confident	18 Å²	18	75.7 Å²	75.7	8%	0.078	41%	0.41	C	S	.	.	S	Bend	trans	-107.7	139.1	169.8	-58.7	-161.6	-174.9	-171.9	0	110.7	D422 N424 H427 S452 H453 L454	D422-K450 WeakPolarHBondContact OD1-CD 3.17Å; D422-K450 IonicContact OD1-NZ 2.62Å; D422-K450 PolarHBondContact OD1-NZ 3.13Å; D422-K450 IonicContact OD2-NZ 3.21Å; D422-K450 PolarHBondContact OD2-NZ 3.18Å; N424-K450 PolarHBondContact OD1-NZ 2.89Å; H427-K450 WeakPolarHBondContact NE2-CE 3.39Å; H427-K450 PolarHBondContact NE2-NZ 3.32Å; K450-S452 VanDerWaalsContact C-N 3.32Å; K450-S452 WeakPolarHBondContact CB-OG 3.41Å; K450-H453 HydrophobicContact CB-CB 4.29Å; K450-H453 PolarHBondContact O-N 2.85Å; K450-L454 PolarHBondContact O-N 3.47Å
451	S	84.9	Confident	86.7	Confident	56 Å²	56	70.9 Å²	70.9	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-68.4	-30.5	173.6	57.2	0	0	0	0	112.6	H453 L454 K455	S451-H453 VanDerWaalsContact C-N 3.34Å; S451-L454 PolarHBondContact O-N 3.21Å; S451-K455 WeakPolarHBondContact O-CG 3.43Å; S451-K455 PolarHBondContact O-N 3.34Å
452	S	82.1	Confident	86.8	Confident	21 Å²	21	69.2 Å²	69.2	15%	0.147	38%	0.381	C	S	.	.	H	α-helix	trans	-55.2	-48.2	169.2	51.1	0	0	0	0	111	D422 K450 L454 K455 A456	D422-S452 PolarHBondContact OD1-OG 2.81Å; K450-S452 VanDerWaalsContact C-N 3.32Å; K450-S452 WeakPolarHBondContact CB-OG 3.41Å; S452-L454 PolarHBondContact O-N 2.83Å; S452-K455 PolarHBondContact O-N 2.84Å; S452-A456 WeakPolarHBondContact O-CB 3.46Å; S452-A456 PolarHBondContact O-N 2.79Å
453	H	85.4	Confident	86.7	Confident	97 Å²	97	64 Å²	64	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-36.4	178.2	-65.6	-170.1	0	0	0	112.8	Y448 K450 S451 H457	Y448-H453 HydrophobicContact CD1-CB 3.65Å; Y448-H453 HydrophobicContact CG-CB 4.06Å; K450-H453 HydrophobicContact CB-CB 4.29Å; K450-H453 PolarHBondContact O-N 2.85Å; S451-H453 VanDerWaalsContact C-N 3.34Å; H453-H457 WeakPolarHBondContact O-CB 3.32Å; H453-H457 PolarHBondContact O-N 3.3Å
454	L	87.9	Confident	86.7	Confident	24 Å²	24	65.8 Å²	65.8	13%	0.126	35%	0.354	C	S	.	.	H	α-helix	trans	-65.2	-45.3	172.4	177.5	63.5	0	0	0	111.4	H437 R438 C439 Y448 K450 S451 S452 A456 H457 I458	H437-L454 HydrophobicContact CB-CB 3.87Å; H437-L454 HydrophobicContact CB-CD2 3.67Å; H437-L454 HydrophobicContact CB-CG 4.33Å; R438-L454 VanDerWaalsContact O-CD2 3.27Å; R438-L454 WeakPolarHBondContact O-CD2 3.13Å; C439-L454 HydrophobicContact CB-CD1 4.31Å; Y448-L454 HydrophobicContact CD2-CB 4.32Å; Y448-L454 HydrophobicContact CD2-CD1 4.06Å; K450-L454 PolarHBondContact O-N 3.47Å; S451-L454 PolarHBondContact O-N 3.21Å; S452-L454 PolarHBondContact O-N 2.83Å; L454-A456 VanDerWaalsContact C-N 3.33Å; L454-A456 PolarHBondContact O-N 2.88Å; L454-H457 CarbonylContact O-C 3.58Å; L454-H457 WeakPolarHBondContact O-CA 3.27Å; L454-H457 WeakPolarHBondContact O-CB 3.48Å; L454-H457 PolarHBondContact O-N 3.3Å; L454-I458 HydrophobicContact CD1-CD1 4.17Å; L454-I458 HydrophobicContact CD1-CG1 4.12Å; L454-I458 HydrophobicContact CD2-CD1 4.27Å; L454-I458 HydrophobicContact CG-CD1 3.85Å; L454-I458 HydrophobicContact CG-CG1 4.28Å; L454-I458 WeakPolarHBondContact O-CG1 3.42Å; L454-I458 PolarHBondContact O-N 3.37Å
455	K	86.3	Confident	86.6	Confident	144 Å²	144	70.7 Å²	70.7	63%	0.626	37%	0.373	S	S	*	.	H	α-helix	trans	-57.3	-47.1	176.4	-74.5	-177.4	175.6	-172.7	0	111.3	S451 S452 H457 I458 R459	S451-K455 WeakPolarHBondContact O-CG 3.43Å; S451-K455 PolarHBondContact O-N 3.34Å; S452-K455 PolarHBondContact O-N 2.84Å; K455-H457 VanDerWaalsContact C-N 3.25Å; K455-H457 PolarHBondContact O-N 3.48Å; K455-I458 PolarHBondContact O-N 2.82Å; K455-R459 PolarHBondContact O-N 2.68Å
456	A	85.5	Confident	86.6	Confident	12 Å²	12	66.1 Å²	66.1	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-29.5	175.5	0	0	0	0	0	113.1	S452 L454 R480	S452-A456 WeakPolarHBondContact O-CB 3.46Å; S452-A456 PolarHBondContact O-N 2.79Å; L454-A456 VanDerWaalsContact C-N 3.33Å; L454-A456 PolarHBondContact O-N 2.88Å; A456-R480 HydrophobicContact CB-CG 4.12Å
457	H	88	Confident	86.6	Confident	8 Å²	8	61.1 Å²	61.1	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-74.5	-40.5	171.9	170.8	39.3	0	0	0	113	C439 C444 Y448 H453 L454 K455 R459 V460 H461	C439-H457 PolarHBondContact SG-NE2 2.81Å; C444-H457 PolarHBondContact SG-NE2 3.4Å; Y448-H457 HydrophobicContact CD2-CB 4.36Å; Y448-H457 HydrophobicContact CE1-CB 4.43Å; Y448-H457 HydrophobicContact CE2-CB 3.6Å; Y448-H457 AromaticContact CE2-CD2 3.37Å; Y448-H457 WeakPolarHBondContact CE2-CD2 3.09Å; Y448-H457 AromaticContact CE2-CG 3.54Å; Y448-H457 AromaticContact CZ-CD2 3.99Å; Y448-H457 AromaticContact CZ-CG 3.71Å; H453-H457 WeakPolarHBondContact O-CB 3.32Å; H453-H457 PolarHBondContact O-N 3.3Å; L454-H457 CarbonylContact O-C 3.58Å; L454-H457 WeakPolarHBondContact O-CA 3.27Å; L454-H457 WeakPolarHBondContact O-CB 3.48Å; L454-H457 PolarHBondContact O-N 3.3Å; K455-H457 VanDerWaalsContact C-N 3.25Å; K455-H457 PolarHBondContact O-N 3.48Å; H457-R459 PolarHBondContact O-N 3.24Å; H457-V460 WeakPolarHBondContact O-CB 3.44Å; H457-V460 WeakPolarHBondContact O-CG2 3.44Å; H457-V460 PolarHBondContact O-N 3.13Å; H457-H461 AromaticContact CD2-NE2 3.86Å; H457-H461 AromaticContact CE1-CD2 3.68Å; H457-H461 AromaticContact CE1-NE2 2.9Å; H457-H461 PolarHBondContact CE1-NE2 3.21Å; H457-H461 AromaticContact NE2-CD2 3.77Å; H457-H461 AromaticContact NE2-NE2 2.62Å; H457-H461 PolarHBondContact NE2-NE2 2.87Å
458	I	87.5	Confident	86.6	Confident	70 Å²	70	62.3 Å²	62.3	36%	0.359	32%	0.323	S	S	.	.	H	α-helix	trans	-58	-33.3	-179.3	-72.1	165.7	0	0	0	111.3	L454 K455 V460 H461 T462	L454-I458 HydrophobicContact CD1-CD1 4.17Å; L454-I458 HydrophobicContact CD1-CG1 4.12Å; L454-I458 HydrophobicContact CD2-CD1 4.27Å; L454-I458 HydrophobicContact CG-CD1 3.85Å; L454-I458 HydrophobicContact CG-CG1 4.28Å; L454-I458 WeakPolarHBondContact O-CG1 3.42Å; L454-I458 PolarHBondContact O-N 3.37Å; K455-I458 PolarHBondContact O-N 2.82Å; I458-V460 PolarHBondContact O-N 3.38Å; I458-V460 VanDerWaalsContact O-N 3.09Å; I458-H461 PolarHBondContact O-N 2.78Å; I458-T462 HydrophobicContact CG2-CG2 4.01Å; I458-T462 PolarHBondContact O-N 3.34Å; I458-T462 PolarHBondContact O-OG1 3.43Å
459	R	88.9	Confident	86.8	Confident	31 Å²	31	59.4 Å²	59.4	12%	0.117	31%	0.312	C	S	.	.	H	α-helix	trans	-55	-23.7	171.3	-64.8	178.4	-171.5	143.1	4.8	114.7	D420 K455 H457 H461 T462 G463 E464 A479	D420-R459 IonicContact OD1-CZ 2.74Å; D420-R459 IonicContact OD1-NH1 2.74Å; D420-R459 PolarHBondContact OD1-NH1 3.1Å; D420-R459 IonicContact OD1-NH2 3.44Å; D420-R459 PolarHBondContact OD1-NH2 2.96Å; D420-R459 IonicContact OD2-CZ 3.09Å; D420-R459 IonicContact OD2-NH1 2.83Å; D420-R459 PolarHBondContact OD2-NH1 3.47Å; D420-R459 IonicContact OD2-NH2 3.49Å; K455-R459 PolarHBondContact O-N 2.68Å; H457-R459 PolarHBondContact O-N 3.24Å; R459-H461 VanDerWaalsContact C-N 3.35Å; R459-T462 WeakPolarHBondContact CA-OG1 3.35Å; R459-G463 CarbonylContact O-C 3.49Å; R459-G463 WeakPolarHBondContact O-CA 3.16Å; R459-G463 PolarHBondContact O-N 2.94Å; R459-E464 HydrophobicContact CB-CB 4.29Å; R459-E464 HydrophobicContact CG-CB 4.11Å; R459-E464 PolarHBondContact O-N 3.29Å; R459-A479 HydrophobicContact CB-CB 4.23Å; R459-A479 WeakPolarHBondContact CD-O 3.23Å; R459-A479 PolarHBondContact NH1-O 3Å
460	V	86.6	Confident	86.9	Confident	99 Å²	99	57.4 Å²	57.4	60%	0.6	31%	0.307	S	S	*	.	H	α-helix	trans	-71.8	-30.3	174.4	-176	0	0	0	0	111.6	H457 I458	H457-V460 WeakPolarHBondContact O-CB 3.44Å; H457-V460 WeakPolarHBondContact O-CG2 3.44Å; H457-V460 PolarHBondContact O-N 3.13Å; I458-V460 PolarHBondContact O-N 3.38Å; I458-V460 VanDerWaalsContact O-N 3.09Å
461	H	88.8	Confident	87	Confident	68 Å²	68	62.2 Å²	62.2	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-89.4	-38.9	178	-64.4	-61.6	0	0	0	112.6	C439 F441 C444 H457 I458 R459 G463	C439-H461 PolarHBondContact SG-CD2 3.15Å; C439-H461 PolarHBondContact SG-NE2 3.49Å; F441-H461 HydrophobicContact CB-CB 4.38Å; F441-H461 HydrophobicContact CD1-CB 4.29Å; F441-H461 AromaticContact CD1-CG 3.88Å; F441-H461 AromaticContact CD1-ND1 3.5Å; F441-H461 HydrophobicContact CD2-CB 3.74Å; F441-H461 AromaticContact CE1-ND1 4Å; F441-H461 HydrophobicContact CE2-CB 4.03Å; F441-H461 HydrophobicContact CG-CB 3.87Å; F441-H461 AromaticContact CG-CD2 3.98Å; F441-H461 AromaticContact CG-CG 3.64Å; F441-H461 AromaticContact CG-ND1 3.78Å; F441-H461 HydrophobicContact CZ-CB 4.43Å; C444-H461 WeakPolarHBondContact CB-CE1 3.45Å; C444-H461 WeakPolarHBondContact CB-NE2 3.26Å; C444-H461 PolarHBondContact SG-CE1 2.96Å; C444-H461 PolarHBondContact SG-NE2 2.98Å; H457-H461 AromaticContact CD2-NE2 3.86Å; H457-H461 AromaticContact CE1-CD2 3.68Å; H457-H461 AromaticContact CE1-NE2 2.9Å; H457-H461 PolarHBondContact CE1-NE2 3.21Å; H457-H461 AromaticContact NE2-CD2 3.77Å; H457-H461 AromaticContact NE2-NE2 2.62Å; H457-H461 PolarHBondContact NE2-NE2 2.87Å; I458-H461 PolarHBondContact O-N 2.78Å; R459-H461 VanDerWaalsContact C-N 3.35Å; H461-G463 VanDerWaalsContact C-N 3.26Å; H461-G463 PolarHBondContact O-N 2.95Å
462	T	88	Confident	86.9	Confident	78 Å²	78	65.2 Å²	65.2	48%	0.479	34%	0.336	S	S	.	.	H	α-helix	trans	-77	-13.1	176.3	60.1	0	0	0	0	113.2	I458 R459 E464	I458-T462 HydrophobicContact CG2-CG2 4.01Å; I458-T462 PolarHBondContact O-N 3.34Å; I458-T462 PolarHBondContact O-OG1 3.43Å; R459-T462 WeakPolarHBondContact CA-OG1 3.35Å; T462-E464 PolarHBondContact O-N 3.06Å; T462-E464 WeakPolarHBondContact OG1-CB 3.17Å; T462-E464 WeakPolarHBondContact OG1-CG 3.25Å; T462-E464 PolarHBondContact OG1-N 2.96Å
463	G	86.2	Confident	86.7	Confident	47 Å²	47	72.1 Å²	72.1	49%	0.485	37%	0.366	S	S	.	.			trans	71.6	4	-174.4	0	0	0	0	0	114.3	R459 H461 K465	R459-G463 CarbonylContact O-C 3.49Å; R459-G463 WeakPolarHBondContact O-CA 3.16Å; R459-G463 PolarHBondContact O-N 2.94Å; H461-G463 VanDerWaalsContact C-N 3.26Å; H461-G463 PolarHBondContact O-N 2.95Å; G463-K465 PolarHBondContact O-N 3.49Å
464	E	86.3	Confident	86.7	Confident	109 Å²	109	68.5 Å²	68.5	51%	0.509	35%	0.352	S	S	.	.			trans	-60.2	124.3	-177.9	-79.1	176.8	175.3	0	0	112.1	R459 T462 P466	R459-E464 HydrophobicContact CB-CB 4.29Å; R459-E464 HydrophobicContact CG-CB 4.11Å; R459-E464 PolarHBondContact O-N 3.29Å; T462-E464 PolarHBondContact O-N 3.06Å; T462-E464 WeakPolarHBondContact OG1-CB 3.17Å; T462-E464 WeakPolarHBondContact OG1-CG 3.25Å; T462-E464 PolarHBondContact OG1-N 2.96Å; E464-P466 WeakPolarHBondContact O-CD 3.44Å
465	K	88.2	Confident	86.5	Confident	121 Å²	121	72.9 Å²	72.9	53%	0.526	38%	0.375	S	S	.	.			trans	-125.2	74.1	176.8	-68.6	170.7	-176.9	178.4	0	110.2	G463 Y467 K477 F478	G463-K465 PolarHBondContact O-N 3.49Å; K465-Y467 PolarHBondContact O-N 2.9Å; K465-K477 HydrophobicContact CB-CB 3.57Å; K465-K477 HydrophobicContact CD-CB 4.33Å; K465-F478 CarbonylContact C-O 3.59Å; K465-F478 WeakPolarHBondContact CA-O 3.35Å; K465-F478 WeakPolarHBondContact CB-O 3.02Å
466	P	87.4	Confident	86.5	Confident	40 Å²	40	72.7 Å²	72.7	26%	0.26	37%	0.37	S	S	.	.			trans	-75.7	-5.1	-174.2	31.7	-35.5	0	0	0	113.8	N417 P418 E464	N417-P466 PolarHBondContact OD1-O 2.62Å; P418-P466 HydrophobicContact CG-CB 4.26Å; E464-P466 WeakPolarHBondContact O-CD 3.44Å
467	Y	88.8	Confident	86.8	Confident	5 Å²	5	78 Å²	78	2%	0.02	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	99.2	179.4	-65.1	-81.8	0	0	0	111	N417 P418 D420 K465 K477 F478 L484	N417-Y467 HydrophobicContact CB-CD1 3.75Å; N417-Y467 HydrophobicContact CB-CE1 4.16Å; N417-Y467 VanDerWaalsContact OD1-CA 3.32Å; N417-Y467 WeakPolarHBondContact OD1-CA 3.33Å; P418-Y467 WeakPolarHBondContact O-CE1 3.4Å; P418-Y467 PolarHBondContact O-OH 2.36Å; D420-Y467 PolarHBondContact OD1-OH 3.33Å; D420-Y467 PolarHBondContact OD2-OH 3.32Å; D420-Y467 VanDerWaalsContact OD2-OH 3.14Å; K465-Y467 PolarHBondContact O-N 2.9Å; Y467-K477 CarbonylContact O-C 3.11Å; Y467-K477 VanDerWaalsContact O-CA 3.31Å; Y467-K477 WeakPolarHBondContact O-CA 3.19Å; Y467-F478 WeakPolarHBondContact CB-O 3.34Å; Y467-F478 PolarHBondContact N-O 2.88Å; Y467-F478 VanDerWaalsContact N-O 3.14Å; Y467-F478 PolarHBondContact O-N 3.05Å; Y467-L484 HydrophobicContact CD1-CD2 4.28Å
468	I	88.5	Confident	86.8	Confident	69 Å²	69	79.3 Å²	79.3	35%	0.354	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	135.4	179.9	-48.9	-175.5	0	0	0	109.9	N417 D470 R476 K477	N417-I468 PolarHBondContact ND2-O 3.02Å; N417-I468 PolarHBondContact OD1-N 2.86Å; I468-D470 PolarHBondContact O-N 3.2Å; I468-R476 CarbonylContact C-O 3.53Å; I468-K477 HydrophobicContact CD1-CD 4.29Å; I468-K477 HydrophobicContact CG1-CD 4.18Å; I468-K477 HydrophobicContact CG1-CG 4.1Å; I468-K477 HydrophobicContact CG2-CG 4.45Å
469	C	91.2	Very high	86.7	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.385	C	S	.	.			trans	-77.2	117.3	169.3	-167.8	0	0	0	0	110.8	W471 N475 R476 F478 L484 H491	C469-W471 VanDerWaalsContact C-N 3.29Å; C469-N475 PolarHBondContact O-N 2.69Å; C469-R476 HydrophobicContact CB-CB 4.47Å; C469-R476 PolarHBondContact N-O 3.09Å; C469-F478 HydrophobicContact CB-CE2 4.41Å; C469-L484 HydrophobicContact CB-CD1 3.75Å; C469-H491 PolarHBondContact SG-NE2 3.28Å
470	D	86.6	Confident	86.5	Confident	88 Å²	88	78.9 Å²	78.9	47%	0.471	39%	0.394	S	S	.	.			trans	-70.5	-13.1	175.2	54.6	-31	0	0	0	114.6	I468 R488	I468-D470 PolarHBondContact O-N 3.2Å; D470-R488 IonicContact OD1-CZ 3.71Å; D470-R488 IonicContact OD1-NE 3.48Å; D470-R488 PolarHBondContact OD1-NE 3.08Å; D470-R488 IonicContact OD1-NH2 2.72Å; D470-R488 IonicContact OD2-CZ 2.77Å; D470-R488 IonicContact OD2-NE 3.2Å; D470-R488 PolarHBondContact OD2-NE 3.36Å; D470-R488 IonicContact OD2-NH2 2.79Å; D470-R488 PolarHBondContact OD2-NH2 3.3Å
471	W	85	Confident	86.4	Confident	119 Å²	119	76.3 Å²	76.3	45%	0.451	38%	0.38	S	S	.	.	S	Bend	trans	-68.3	136	-179.7	-165.1	-82.6	0	0	0	111.8	C469 H473 C474 H491 T492	C469-W471 VanDerWaalsContact C-N 3.29Å; W471-H473 PolarHBondContact O-N 3.27Å; W471-C474 HydrophobicContact CB-CB 4.24Å; W471-C474 VanDerWaalsContact O-CB 3.25Å; W471-C474 WeakPolarHBondContact O-CB 3.48Å; W471-C474 PolarHBondContact O-N 3.2Å; W471-H491 VanDerWaalsContact CB-CD2 3.42Å; W471-H491 WeakPolarHBondContact CB-CD2 3.3Å; W471-H491 AromaticContact CD1-CG 3.84Å; W471-H491 AromaticContact CD1-ND1 3.76Å; W471-H491 HydrophobicContact CD2-CB 3.47Å; W471-H491 VanDerWaalsContact CD2-CB 3.47Å; W471-H491 AromaticContact CD2-CD2 3.95Å; W471-H491 AromaticContact CD2-CG 3.68Å; W471-H491 HydrophobicContact CE3-CB 3.64Å; W471-H491 HydrophobicContact CG-CB 3.94Å; W471-H491 AromaticContact CG-CD2 3.54Å; W471-H491 AromaticContact CG-CG 3.56Å; W471-H491 AromaticContact CG-ND1 3.94Å; W471-H491 HydrophobicContact CH2-CB 4.13Å; W471-H491 HydrophobicContact CZ2-CB 3.98Å; W471-H491 HydrophobicContact CZ3-CB 3.97Å; W471-T492 HydrophobicContact CZ3-CG2 4.38Å
472	N	80.9	Confident	86.1	Confident	119 Å²	119	76.2 Å²	76.2	64%	0.636	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	138.4	-173	-166.2	11.7	0	0	0	112.5	C474	N472-C474 PolarHBondContact O-N 3.18Å
473	H	79.5	Confident	86	Confident	167 Å²	167	74.4 Å²	74.4	77%	0.773	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	0.7	-171.9	-45.9	-70.2	0	0	0	116.8	W471	W471-H473 PolarHBondContact O-N 3.27Å
474	C	85	Confident	86.2	Confident	21 Å²	21	72.3 Å²	72.3	14%	0.142	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-53.4	-175	-159.9	0	0	0	0	113.3	W471 N472 R476 H487 H491	W471-C474 HydrophobicContact CB-CB 4.24Å; W471-C474 VanDerWaalsContact O-CB 3.25Å; W471-C474 WeakPolarHBondContact O-CB 3.48Å; W471-C474 PolarHBondContact O-N 3.2Å; N472-C474 PolarHBondContact O-N 3.18Å; C474-R476 PolarHBondContact O-N 3.47Å; C474-H487 PolarHBondContact SG-NE2 3.25Å; C474-H491 WeakPolarHBondContact CB-CE1 2.99Å; C474-H491 VanDerWaalsContact CB-NE2 3.27Å; C474-H491 WeakPolarHBondContact CB-NE2 3.41Å; C474-H491 PolarHBondContact SG-CE1 2.99Å; C474-H491 PolarHBondContact SG-NE2 2.87Å
475	N	83.7	Confident	86.2	Confident	116 Å²	116	70.3 Å²	70.3	62%	0.62	34%	0.344	S	S	*	.			trans	50	13.8	176.6	-68.7	-24.6	0	0	0	116.5	C469	C469-N475 PolarHBondContact O-N 2.69Å
476	R	86.5	Confident	86	Confident	139 Å²	139	69.2 Å²	69.2	53%	0.525	34%	0.336	S	S	.	.			trans	-68.7	133.8	-174.7	-74.1	-175.7	-179.5	-151.1	-1.8	110.9	I468 C469 C474 F478	I468-R476 CarbonylContact C-O 3.53Å; C469-R476 HydrophobicContact CB-CB 4.47Å; C469-R476 PolarHBondContact N-O 3.09Å; C474-R476 PolarHBondContact O-N 3.47Å; R476-F478 HydrophobicContact CB-CE2 3.6Å; R476-F478 HydrophobicContact CB-CZ 3.74Å; R476-F478 WeakPolarHBondContact O-CE2 3.09Å
477	K	90.8	Very high	86.1	Confident	123 Å²	123	68.4 Å²	68.4	54%	0.535	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.4	-178.8	-47.7	-166.4	-179.5	-176.9	0	111.5	K465 Y467 I468	K465-K477 HydrophobicContact CB-CB 3.57Å; K465-K477 HydrophobicContact CD-CB 4.33Å; Y467-K477 CarbonylContact O-C 3.11Å; Y467-K477 VanDerWaalsContact O-CA 3.31Å; Y467-K477 WeakPolarHBondContact O-CA 3.19Å; I468-K477 HydrophobicContact CD1-CD 4.29Å; I468-K477 HydrophobicContact CG1-CD 4.18Å; I468-K477 HydrophobicContact CG1-CG 4.1Å; I468-K477 HydrophobicContact CG2-CG 4.45Å
478	F	87.7	Confident	85.9	Confident	36 Å²	36	70.5 Å²	70.5	16%	0.158	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	156.8	-176.6	-57.1	-89	0	0	0	111.3	K465 Y467 C469 R476 E483 L484 H487	K465-F478 CarbonylContact C-O 3.59Å; K465-F478 WeakPolarHBondContact CA-O 3.35Å; K465-F478 WeakPolarHBondContact CB-O 3.02Å; Y467-F478 WeakPolarHBondContact CB-O 3.34Å; Y467-F478 PolarHBondContact N-O 2.88Å; Y467-F478 VanDerWaalsContact N-O 3.14Å; Y467-F478 PolarHBondContact O-N 3.05Å; C469-F478 HydrophobicContact CB-CE2 4.41Å; R476-F478 HydrophobicContact CB-CE2 3.6Å; R476-F478 HydrophobicContact CB-CZ 3.74Å; R476-F478 WeakPolarHBondContact O-CE2 3.09Å; F478-E483 HydrophobicContact CB-CB 3.93Å; F478-E483 HydrophobicContact CD1-CB 3.89Å; F478-E483 HydrophobicContact CG-CB 4.17Å; F478-L484 HydrophobicContact CD2-CB 4.12Å; F478-L484 HydrophobicContact CD2-CD1 4.05Å; F478-L484 HydrophobicContact CE2-CD1 4.2Å; F478-L484 HydrophobicContact CG-CB 4.47Å; F478-H487 HydrophobicContact CE1-CB 4.07Å; F478-H487 HydrophobicContact CE2-CB 4.06Å; F478-H487 AromaticContact CE2-CD2 3.23Å; F478-H487 WeakPolarHBondContact CE2-CD2 3.41Å; F478-H487 AromaticContact CE2-CG 3.79Å; F478-H487 HydrophobicContact CZ-CB 3.61Å; F478-H487 AromaticContact CZ-CD2 3.24Å; F478-H487 WeakPolarHBondContact CZ-CD2 3.44Å; F478-H487 AromaticContact CZ-CG 3.36Å; F478-H487 AromaticContact CZ-NE2 3.91Å
479	A	86.3	Confident	85.8	Confident	14 Å²	14	70 Å²	70	12%	0.116	33%	0.331	C	S	.	.	S	Bend	trans	-86.6	-19.3	-177.6	0	0	0	0	0	112.8	R459 E483	R459-A479 HydrophobicContact CB-CB 4.23Å; R459-A479 WeakPolarHBondContact CD-O 3.23Å; R459-A479 PolarHBondContact NH1-O 3Å; A479-E483 PolarHBondContact N-OE2 3.21Å
480	R	84.1	Confident	85.4	Confident	78 Å²	78	73.5 Å²	73.5	29%	0.294	36%	0.359	S	S	.	.	S	Bend	trans	-140.2	151.3	-173.7	-52.8	-176.2	-61.4	111.2	14.1	111.8	A456 D482 E483 L484	A456-R480 HydrophobicContact CB-CG 4.12Å; R480-D482 WeakPolarHBondContact CB-OD1 3.38Å; R480-D482 IonicContact CZ-OD1 2.85Å; R480-D482 IonicContact CZ-OD2 3.67Å; R480-D482 IonicContact NE-OD1 3.44Å; R480-D482 IonicContact NH1-OD1 3.97Å; R480-D482 PolarHBondContact NH1-OD1 3.38Å; R480-D482 IonicContact NH1-OD2 3.18Å; R480-D482 PolarHBondContact NH1-OD2 3.28Å; R480-D482 IonicContact NH2-OD1 2.68Å; R480-D482 PolarHBondContact NH2-OD1 2.85Å; R480-D482 IonicContact NH2-OD2 3.65Å; R480-D482 PolarHBondContact NH2-OD2 3.41Å; R480-D482 PolarHBondContact O-N 3.28Å; R480-E483 HydrophobicContact CB-CG 4.18Å; R480-E483 IonicContact CZ-OE1 3.68Å; R480-E483 PolarHBondContact N-OE2 2.85Å; R480-E483 IonicContact NE-OE1 2.79Å; R480-E483 PolarHBondContact NE-OE1 2.94Å; R480-E483 VanDerWaalsContact NH2-CG 3.26Å; R480-E483 IonicContact NH2-OE1 3.32Å; R480-E483 PolarHBondContact NH2-OE1 3.09Å; R480-E483 WeakPolarHBondContact O-CB 3.49Å; R480-E483 PolarHBondContact O-N 3.41Å; R480-L484 PolarHBondContact O-N 3.28Å
481	S	85.7	Confident	85.2	Confident	46 Å²	46	72.2 Å²	72.2	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-37.4	-177.5	56.8	0	0	0	0	113.6	E483 L484 S485	S481-E483 VanDerWaalsContact C-N 3.28Å; S481-E483 PolarHBondContact O-N 2.88Å; S481-L484 PolarHBondContact O-N 2.89Å; S481-S485 PolarHBondContact O-N 3.19Å; S481-S485 PolarHBondContact O-OG 3.32Å
482	D	82.2	Confident	85	Confident	66 Å²	66	69.9 Å²	69.9	35%	0.353	35%	0.349	S	S	.	.	H	α-helix	trans	-63.9	-32.3	176.3	68.4	-53	0	0	0	112.6	R480 R486	R480-D482 WeakPolarHBondContact CB-OD1 3.38Å; R480-D482 IonicContact CZ-OD1 2.85Å; R480-D482 IonicContact CZ-OD2 3.67Å; R480-D482 IonicContact NE-OD1 3.44Å; R480-D482 IonicContact NH1-OD1 3.97Å; R480-D482 PolarHBondContact NH1-OD1 3.38Å; R480-D482 IonicContact NH1-OD2 3.18Å; R480-D482 PolarHBondContact NH1-OD2 3.28Å; R480-D482 IonicContact NH2-OD1 2.68Å; R480-D482 PolarHBondContact NH2-OD1 2.85Å; R480-D482 IonicContact NH2-OD2 3.65Å; R480-D482 PolarHBondContact NH2-OD2 3.41Å; R480-D482 PolarHBondContact O-N 3.28Å; D482-R486 WeakPolarHBondContact O-CB 3.23Å; D482-R486 PolarHBondContact O-N 2.73Å
483	E	86.3	Confident	84.8	Confident	40 Å²	40	66.3 Å²	66.3	19%	0.187	34%	0.341	C	S	.	.	H	α-helix	trans	-69.5	-43.5	177.8	-63.5	172.6	173.6	0	0	111.3	F478 A479 R480 S481 H487	F478-E483 HydrophobicContact CB-CB 3.93Å; F478-E483 HydrophobicContact CD1-CB 3.89Å; F478-E483 HydrophobicContact CG-CB 4.17Å; A479-E483 PolarHBondContact N-OE2 3.21Å; R480-E483 HydrophobicContact CB-CG 4.18Å; R480-E483 IonicContact CZ-OE1 3.68Å; R480-E483 PolarHBondContact N-OE2 2.85Å; R480-E483 IonicContact NE-OE1 2.79Å; R480-E483 PolarHBondContact NE-OE1 2.94Å; R480-E483 VanDerWaalsContact NH2-CG 3.26Å; R480-E483 IonicContact NH2-OE1 3.32Å; R480-E483 PolarHBondContact NH2-OE1 3.09Å; R480-E483 WeakPolarHBondContact O-CB 3.49Å; R480-E483 PolarHBondContact O-N 3.41Å; S481-E483 VanDerWaalsContact C-N 3.28Å; S481-E483 PolarHBondContact O-N 2.88Å; E483-H487 VanDerWaalsContact O-CB 3.31Å; E483-H487 WeakPolarHBondContact O-CB 3.48Å; E483-H487 PolarHBondContact O-N 3.44Å
484	L	90	Very high	84.7	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-49.2	173.8	173.2	61.6	0	0	0	111.2	N417 Y467 C469 F478 R480 S481 R486 H487 R488	N417-L484 VanDerWaalsContact ND2-CD2 3.27Å; N417-L484 WeakPolarHBondContact ND2-CD2 3.48Å; Y467-L484 HydrophobicContact CD1-CD2 4.28Å; C469-L484 HydrophobicContact CB-CD1 3.75Å; F478-L484 HydrophobicContact CD2-CB 4.12Å; F478-L484 HydrophobicContact CD2-CD1 4.05Å; F478-L484 HydrophobicContact CE2-CD1 4.2Å; F478-L484 HydrophobicContact CG-CB 4.47Å; R480-L484 PolarHBondContact O-N 3.28Å; S481-L484 PolarHBondContact O-N 2.89Å; L484-R486 VanDerWaalsContact C-N 3.3Å; L484-R486 PolarHBondContact O-N 3.39Å; L484-H487 CarbonylContact O-C 3.59Å; L484-H487 WeakPolarHBondContact O-CA 3.27Å; L484-H487 WeakPolarHBondContact O-CB 3.35Å; L484-H487 PolarHBondContact O-N 2.62Å; L484-R488 HydrophobicContact CD1-CG 3.99Å; L484-R488 HydrophobicContact CG-CG 4.42Å; L484-R488 WeakPolarHBondContact O-CG 3.48Å; L484-R488 PolarHBondContact O-N 2.92Å
485	S	86.1	Confident	84.4	Confident	66 Å²	66	66.6 Å²	66.6	46%	0.462	34%	0.335	S	S	.	.	H	α-helix	trans	-60.7	-39.5	179	-65	0	0	0	0	112.2	S481 H487 R488 R489	S481-S485 PolarHBondContact O-N 3.19Å; S481-S485 PolarHBondContact O-OG 3.32Å; S485-H487 VanDerWaalsContact C-N 3.31Å; S485-H487 PolarHBondContact O-N 2.92Å; S485-R488 PolarHBondContact O-N 3.38Å; S485-R489 PolarHBondContact O-N 3.22Å
486	R	84.7	Confident	84.4	Confident	98 Å²	98	65 Å²	65	37%	0.37	33%	0.326	S	S	.	.	H	α-helix	trans	-66.5	-31.3	172.4	-176.4	-176.4	68.1	-163.5	-4	112.6	D482 L484 R508	D482-R486 WeakPolarHBondContact O-CB 3.23Å; D482-R486 PolarHBondContact O-N 2.73Å; L484-R486 VanDerWaalsContact C-N 3.3Å; L484-R486 PolarHBondContact O-N 3.39Å; R486-R508 HydrophobicContact CG-CG 4.09Å
487	H	88.5	Confident	84.3	Confident	24 Å²	24	61.4 Å²	61.4	11%	0.111	32%	0.315	C	S	.	.	H	α-helix	trans	-74.5	-40.5	175.1	169.6	49	0	0	0	112.6	C474 F478 E483 L484 S485 R489 A490 H491	C474-H487 PolarHBondContact SG-NE2 3.25Å; F478-H487 HydrophobicContact CE1-CB 4.07Å; F478-H487 HydrophobicContact CE2-CB 4.06Å; F478-H487 AromaticContact CE2-CD2 3.23Å; F478-H487 WeakPolarHBondContact CE2-CD2 3.41Å; F478-H487 AromaticContact CE2-CG 3.79Å; F478-H487 HydrophobicContact CZ-CB 3.61Å; F478-H487 AromaticContact CZ-CD2 3.24Å; F478-H487 WeakPolarHBondContact CZ-CD2 3.44Å; F478-H487 AromaticContact CZ-CG 3.36Å; F478-H487 AromaticContact CZ-NE2 3.91Å; E483-H487 VanDerWaalsContact O-CB 3.31Å; E483-H487 WeakPolarHBondContact O-CB 3.48Å; E483-H487 PolarHBondContact O-N 3.44Å; L484-H487 CarbonylContact O-C 3.59Å; L484-H487 WeakPolarHBondContact O-CA 3.27Å; L484-H487 WeakPolarHBondContact O-CB 3.35Å; L484-H487 PolarHBondContact O-N 2.62Å; S485-H487 VanDerWaalsContact C-N 3.31Å; S485-H487 PolarHBondContact O-N 2.92Å; H487-R489 PolarHBondContact O-N 3.27Å; H487-A490 WeakPolarHBondContact O-CA 3.43Å; H487-A490 WeakPolarHBondContact O-CB 2.86Å; H487-A490 PolarHBondContact O-N 2.88Å; H487-H491 AromaticContact CD2-NE2 3.42Å; H487-H491 PolarHBondContact CD2-NE2 3.28Å; H487-H491 AromaticContact CE1-CE1 3.72Å; H487-H491 AromaticContact CE1-NE2 2.96Å; H487-H491 PolarHBondContact CE1-NE2 2.95Å; H487-H491 AromaticContact ND1-NE2 3.97Å; H487-H491 AromaticContact NE2-NE2 2.52Å; H487-H491 PolarHBondContact NE2-NE2 3.28Å
488	R	85.6	Confident	84	Confident	49 Å²	49	59.2 Å²	59.2	19%	0.185	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-31.8	178.5	-69.3	174.7	91.8	-111.5	9.6	112.2	D412 D470 L484 S485 A490 H491 T492	D412-R488 IonicContact OD2-CZ 3.26Å; D412-R488 IonicContact OD2-NH1 3.37Å; D412-R488 PolarHBondContact OD2-NH1 3.24Å; D412-R488 IonicContact OD2-NH2 2.88Å; D412-R488 PolarHBondContact OD2-NH2 3.3Å; D470-R488 IonicContact OD1-CZ 3.71Å; D470-R488 IonicContact OD1-NE 3.48Å; D470-R488 PolarHBondContact OD1-NE 3.08Å; D470-R488 IonicContact OD1-NH2 2.72Å; D470-R488 IonicContact OD2-CZ 2.77Å; D470-R488 IonicContact OD2-NE 3.2Å; D470-R488 PolarHBondContact OD2-NE 3.36Å; D470-R488 IonicContact OD2-NH2 2.79Å; D470-R488 PolarHBondContact OD2-NH2 3.3Å; L484-R488 HydrophobicContact CD1-CG 3.99Å; L484-R488 HydrophobicContact CG-CG 4.42Å; L484-R488 WeakPolarHBondContact O-CG 3.48Å; L484-R488 PolarHBondContact O-N 2.92Å; S485-R488 PolarHBondContact O-N 3.38Å; R488-A490 PolarHBondContact O-N 3.24Å; R488-H491 WeakPolarHBondContact O-CB 3.37Å; R488-H491 PolarHBondContact O-N 3.3Å; R488-T492 PolarHBondContact O-N 2.88Å; R488-T492 VanDerWaalsContact O-N 3.11Å
489	R	85.1	Confident	84	Confident	59 Å²	59	57.7 Å²	57.7	22%	0.223	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-22.3	169.6	-66.5	-175.7	-173.1	154.1	6	115	S485 H487 H491 T492 G493 E494	S485-R489 PolarHBondContact O-N 3.22Å; H487-R489 PolarHBondContact O-N 3.27Å; R489-H491 VanDerWaalsContact C-N 3.3Å; R489-T492 WeakPolarHBondContact CA-OG1 3.45Å; R489-G493 WeakPolarHBondContact O-CA 3.45Å; R489-G493 PolarHBondContact O-N 2.82Å; R489-E494 HydrophobicContact CB-CB 4.18Å; R489-E494 HydrophobicContact CG-CB 4.06Å; R489-E494 PolarHBondContact O-N 3.29Å
490	A	82.4	Confident	84	Confident	72 Å²	72	65.7 Å²	65.7	60%	0.595	34%	0.337	S	S	*	.	H	α-helix	trans	-75.5	-21.2	173.5	0	0	0	0	0	112.4	H487 R488	H487-A490 WeakPolarHBondContact O-CA 3.43Å; H487-A490 WeakPolarHBondContact O-CB 2.86Å; H487-A490 PolarHBondContact O-N 2.88Å; R488-A490 PolarHBondContact O-N 3.24Å
491	H	84	Confident	84	Confident	61 Å²	61	69 Å²	69	28%	0.282	35%	0.349	S	S	.	.	H	α-helix	trans	-86	-46.5	173.3	-60.2	-51	0	0	0	111.7	C469 W471 C474 H487 R488 R489 G493	C469-H491 PolarHBondContact SG-NE2 3.28Å; W471-H491 VanDerWaalsContact CB-CD2 3.42Å; W471-H491 WeakPolarHBondContact CB-CD2 3.3Å; W471-H491 AromaticContact CD1-CG 3.84Å; W471-H491 AromaticContact CD1-ND1 3.76Å; W471-H491 HydrophobicContact CD2-CB 3.47Å; W471-H491 VanDerWaalsContact CD2-CB 3.47Å; W471-H491 AromaticContact CD2-CD2 3.95Å; W471-H491 AromaticContact CD2-CG 3.68Å; W471-H491 HydrophobicContact CE3-CB 3.64Å; W471-H491 HydrophobicContact CG-CB 3.94Å; W471-H491 AromaticContact CG-CD2 3.54Å; W471-H491 AromaticContact CG-CG 3.56Å; W471-H491 AromaticContact CG-ND1 3.94Å; W471-H491 HydrophobicContact CH2-CB 4.13Å; W471-H491 HydrophobicContact CZ2-CB 3.98Å; W471-H491 HydrophobicContact CZ3-CB 3.97Å; C474-H491 WeakPolarHBondContact CB-CE1 2.99Å; C474-H491 VanDerWaalsContact CB-NE2 3.27Å; C474-H491 WeakPolarHBondContact CB-NE2 3.41Å; C474-H491 PolarHBondContact SG-CE1 2.99Å; C474-H491 PolarHBondContact SG-NE2 2.87Å; H487-H491 AromaticContact CD2-NE2 3.42Å; H487-H491 PolarHBondContact CD2-NE2 3.28Å; H487-H491 AromaticContact CE1-CE1 3.72Å; H487-H491 AromaticContact CE1-NE2 2.96Å; H487-H491 PolarHBondContact CE1-NE2 2.95Å; H487-H491 AromaticContact ND1-NE2 3.97Å; H487-H491 AromaticContact NE2-NE2 2.52Å; H487-H491 PolarHBondContact NE2-NE2 3.28Å; R488-H491 WeakPolarHBondContact O-CB 3.37Å; R488-H491 PolarHBondContact O-N 3.3Å; R489-H491 VanDerWaalsContact C-N 3.3Å; H491-G493 VanDerWaalsContact C-N 3.26Å; H491-G493 PolarHBondContact O-N 2.87Å
492	T	80.2	Confident	84.1	Confident	70 Å²	70	68.5 Å²	68.5	43%	0.429	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-22.9	177.1	63.2	0	0	0	0	113	W471 R488 R489 E494	W471-T492 HydrophobicContact CZ3-CG2 4.38Å; R488-T492 PolarHBondContact O-N 2.88Å; R488-T492 VanDerWaalsContact O-N 3.11Å; R489-T492 WeakPolarHBondContact CA-OG1 3.45Å; T492-E494 VanDerWaalsContact C-N 3.28Å; T492-E494 WeakPolarHBondContact CB-OE1 3.46Å; T492-E494 WeakPolarHBondContact OG1-CG 3.31Å; T492-E494 PolarHBondContact OG1-N 3.34Å; T492-E494 PolarHBondContact OG1-OE1 2.92Å
493	G	77.3	Confident	84.3	Confident	45 Å²	45	71.3 Å²	71.3	46%	0.464	37%	0.367	S	S	.	.			trans	78.6	9.8	-176	0	0	0	0	0	114.1	R489 H491 R495	R489-G493 WeakPolarHBondContact O-CA 3.45Å; R489-G493 PolarHBondContact O-N 2.82Å; H491-G493 VanDerWaalsContact C-N 3.26Å; H491-G493 PolarHBondContact O-N 2.87Å; G493-R495 WeakPolarHBondContact O-CG 3.41Å; G493-R495 PolarHBondContact O-N 3.49Å
494	E	76.6	Confident	84.1	Confident	61 Å²	61	73.6 Å²	73.6	29%	0.285	37%	0.374	S	S	.	.			trans	-55.8	113.4	-179.2	-90.6	172.2	-101.2	0	0	113.7	R489 T492 N496 T507	R489-E494 HydrophobicContact CB-CB 4.18Å; R489-E494 HydrophobicContact CG-CB 4.06Å; R489-E494 PolarHBondContact O-N 3.29Å; T492-E494 VanDerWaalsContact C-N 3.28Å; T492-E494 WeakPolarHBondContact CB-OE1 3.46Å; T492-E494 WeakPolarHBondContact OG1-CG 3.31Å; T492-E494 PolarHBondContact OG1-N 3.34Å; T492-E494 PolarHBondContact OG1-OE1 2.92Å; E494-N496 WeakPolarHBondContact CB-OD1 3.49Å; E494-N496 PolarHBondContact OE2-ND2 3.48Å; E494-T507 WeakPolarHBondContact O-CA 3.41Å; E494-T507 WeakPolarHBondContact O-CG2 3.44Å
495	R	79.3	Confident	83.9	Confident	133 Å²	133	80.6 Å²	80.6	50%	0.502	40%	0.4	S	S	.	.			trans	-113.9	63.6	-179.8	-72.7	168.9	172.4	-162.3	-7.6	110.9	G493 F497 R505 F506 T507	G493-R495 WeakPolarHBondContact O-CG 3.41Å; G493-R495 PolarHBondContact O-N 3.49Å; R495-F497 PolarHBondContact O-N 3.12Å; R495-F497 VanDerWaalsContact O-N 3.16Å; R495-R505 HydrophobicContact CB-CB 3.59Å; R495-R505 WeakPolarHBondContact CD-O 3.29Å; R495-F506 CarbonylContact C-O 3.58Å; R495-F506 VanDerWaalsContact CA-O 3.26Å; R495-F506 WeakPolarHBondContact CA-O 3.3Å; R495-T507 HydrophobicContact CG-CG2 3.93Å
496	N	82.8	Confident	83.7	Confident	83 Å²	83	79.1 Å²	79.1	44%	0.444	39%	0.386	S	S	.	.			trans	-75.7	-2.7	-166.3	-51.2	-0.9	0	0	0	113.7	E494 F506	E494-N496 WeakPolarHBondContact CB-OD1 3.49Å; E494-N496 PolarHBondContact OE2-ND2 3.48Å; N496-F506 PolarHBondContact N-O 3.1Å
497	F	84	Confident	83.5	Confident	63 Å²	63	76.6 Å²	76.6	28%	0.276	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	103	179.1	-59.4	-85	0	0	0	110.3	R495 R505 F506 R508 L512	R495-F497 PolarHBondContact O-N 3.12Å; R495-F497 VanDerWaalsContact O-N 3.16Å; F497-R505 CarbonylContact O-C 3.19Å; F497-F506 HydrophobicContact CB-CB 4.27Å; F497-F506 WeakPolarHBondContact CB-O 3.06Å; F497-F506 PolarHBondContact N-O 3.07Å; F497-F506 WeakPolarHBondContact O-CD2 3.35Å; F497-F506 PolarHBondContact O-N 2.77Å; F497-R508 VanDerWaalsContact CD2-CA 3.5Å; F497-L512 HydrophobicContact CB-CB 4.07Å; F497-L512 HydrophobicContact CB-CD2 3.9Å
498	I	84.6	Confident	83.3	Confident	76 Å²	76	78.9 Å²	78.9	39%	0.39	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	140.1	-172.9	-54.9	-179.2	0	0	0	110.3	R505 L512	I498-R505 HydrophobicContact CG1-CG 4.04Å; I498-R505 HydrophobicContact CG2-CG 4.36Å; I498-L512 WeakPolarHBondContact O-CD2 3.16Å
499	C	87.5	Confident	83.3	Confident	5 Å²	5	79.6 Å²	79.6	3%	0.034	40%	0.402	C	S	.	.			trans	-82.2	131	167.7	-170.7	0	0	0	0	110.9	R501 R504 F506 L512 H515	C499-R501 PolarHBondContact O-N 3.4Å; C499-R501 PolarHBondContact SG-N 3.28Å; C499-R501 VanDerWaalsContact SG-N 3.42Å; C499-R504 PolarHBondContact N-O 3.14Å; C499-F506 HydrophobicContact CB-CE2 4.42Å; C499-L512 HydrophobicContact CB-CD1 3.88Å; C499-H515 WeakPolarHBondContact CB-NE2 3.27Å; C499-H515 PolarHBondContact SG-NE2 2.88Å
500	Q	87.7	Confident	83.3	Confident	181 Å²	181	79.1 Å²	79.1	85%	0.846	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	3.1	176.2	-57.2	-63.8	-1.6	0	0	113.6
501	R	83.4	Confident	83.6	Confident	148 Å²	148	78.9 Å²	78.9	56%	0.558	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-6.6	179.6	-64.3	-172.2	-173.5	168.7	9.6	114.6	C499 H519 N520	C499-R501 PolarHBondContact O-N 3.4Å; C499-R501 PolarHBondContact SG-N 3.28Å; C499-R501 VanDerWaalsContact SG-N 3.42Å; R501-H519 PolarHBondContact NH1-O 3.35Å; R501-N520 PolarHBondContact NH1-OD1 3.1Å; R501-N520 PolarHBondContact NH2-OD1 3Å
502	C	87.6	Confident	83.7	Confident	36 Å²	36	77.1 Å²	77.1	24%	0.243	38%	0.382	C	S	.	.	S	Bend	trans	-163	161.6	173.3	76.3	0	0	0	0	109.9	R504 H515 H519	C502-R504 PolarHBondContact O-N 3.48Å; C502-H515 PolarHBondContact SG-CE1 2.86Å; C502-H515 PolarHBondContact SG-NE2 3.35Å; C502-H519 PolarHBondContact SG-NE2 3.12Å; C502-H519 VanDerWaalsContact SG-NE2 3.37Å
503	P	86.1	Confident	84.1	Confident	125 Å²	125	77 Å²	77	81%	0.812	38%	0.384	S	S	*	.	S	Bend	trans	-68.6	3.7	-173.7	27.1	-36	0	0	0	115.7	R505	P503-R505 PolarHBondContact O-N 3.25Å
504	R	82.2	Confident	84.5	Confident	88 Å²	88	81 Å²	81	33%	0.332	39%	0.389	S	S	.	.			trans	-69.4	132.6	-178.5	-65.3	-158.6	-167.3	-153.6	13.3	111.9	D298 D301 C499 C502 F506	D298-R504 IonicContact OD2-CZ 3.14Å; D298-R504 VanDerWaalsContact OD2-CZ 3.26Å; D298-R504 IonicContact OD2-NH1 3.75Å; D298-R504 PolarHBondContact OD2-NH1 2.97Å; D298-R504 IonicContact OD2-NH2 2.61Å; D298-R504 PolarHBondContact OD2-NH2 3Å; D301-R504 IonicContact OD2-CZ 2.85Å; D301-R504 IonicContact OD2-NH1 3.92Å; D301-R504 PolarHBondContact OD2-NH1 3.16Å; C499-R504 PolarHBondContact N-O 3.14Å; C502-R504 PolarHBondContact O-N 3.48Å; R504-F506 HydrophobicContact CB-CE2 3.78Å; R504-F506 HydrophobicContact CB-CZ 3.66Å
505	R	86.7	Confident	85.1	Confident	150 Å²	150	79.2 Å²	79.2	57%	0.566	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.7	176.2	-51.3	-171.4	-178.8	-178.6	1	109.9	R495 F497 I498 P503	R495-R505 HydrophobicContact CB-CB 3.59Å; R495-R505 WeakPolarHBondContact CD-O 3.29Å; F497-R505 CarbonylContact O-C 3.19Å; I498-R505 HydrophobicContact CG1-CG 4.04Å; I498-R505 HydrophobicContact CG2-CG 4.36Å; P503-R505 PolarHBondContact O-N 3.25Å
506	F	81.1	Confident	85.4	Confident	35 Å²	35	75.8 Å²	75.8	15%	0.154	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	148.9	-171.9	-56.6	-87.7	0	0	0	111.6	R495 N496 F497 C499 R504 R508 H511 L512 H515	R495-F506 CarbonylContact C-O 3.58Å; R495-F506 VanDerWaalsContact CA-O 3.26Å; R495-F506 WeakPolarHBondContact CA-O 3.3Å; N496-F506 PolarHBondContact N-O 3.1Å; F497-F506 HydrophobicContact CB-CB 4.27Å; F497-F506 WeakPolarHBondContact CB-O 3.06Å; F497-F506 PolarHBondContact N-O 3.07Å; F497-F506 WeakPolarHBondContact O-CD2 3.35Å; F497-F506 PolarHBondContact O-N 2.77Å; C499-F506 HydrophobicContact CB-CE2 4.42Å; R504-F506 HydrophobicContact CB-CE2 3.78Å; R504-F506 HydrophobicContact CB-CZ 3.66Å; F506-R508 VanDerWaalsContact C-N 3.28Å; F506-R508 PolarHBondContact O-N 3.44Å; F506-H511 HydrophobicContact CB-CB 4.2Å; F506-H511 HydrophobicContact CD1-CB 3.98Å; F506-H511 HydrophobicContact CG-CB 4.34Å; F506-L512 HydrophobicContact CB-CB 4.42Å; F506-L512 HydrophobicContact CD2-CB 3.9Å; F506-L512 HydrophobicContact CD2-CD1 3.92Å; F506-L512 HydrophobicContact CE2-CD1 4.02Å; F506-L512 HydrophobicContact CG-CB 4.32Å; F506-H515 HydrophobicContact CE1-CB 4Å; F506-H515 HydrophobicContact CE2-CB 4Å; F506-H515 AromaticContact CE2-CD2 3.36Å; F506-H515 WeakPolarHBondContact CE2-CD2 3.47Å; F506-H515 AromaticContact CE2-CG 3.7Å; F506-H515 HydrophobicContact CZ-CB 3.5Å; F506-H515 VanDerWaalsContact CZ-CB 3.5Å; F506-H515 AromaticContact CZ-CD2 3.45Å; F506-H515 VanDerWaalsContact CZ-CD2 3.45Å; F506-H515 WeakPolarHBondContact CZ-CD2 3.44Å; F506-H515 AromaticContact CZ-CG 3.28Å; F506-H515 AromaticContact CZ-ND1 3.8Å
507	T	81.7	Confident	85.6	Confident	45 Å²	45	80.8 Å²	80.8	28%	0.276	38%	0.384	S	S	.	.	S	Bend	trans	-77.2	-13	177.9	61.5	0	0	0	0	113.5	E494 R495	E494-T507 WeakPolarHBondContact O-CA 3.41Å; E494-T507 WeakPolarHBondContact O-CG2 3.44Å; R495-T507 HydrophobicContact CG-CG2 3.93Å
508	R	83.2	Confident	85.5	Confident	71 Å²	71	84.5 Å²	84.5	27%	0.268	40%	0.397	S	S	.	.	S	Bend	trans	-143.5	143.3	-172.2	-68.5	165.2	55.2	165.5	-3.7	111.9	R486 F497 F506 D510 H511 L512	R486-R508 HydrophobicContact CG-CG 4.09Å; F497-R508 VanDerWaalsContact CD2-CA 3.5Å; F506-R508 VanDerWaalsContact C-N 3.28Å; F506-R508 PolarHBondContact O-N 3.44Å; R508-D510 IonicContact CZ-OD1 3.75Å; R508-D510 IonicContact CZ-OD2 3.08Å; R508-D510 IonicContact NE-OD1 2.81Å; R508-D510 PolarHBondContact NE-OD1 3.26Å; R508-D510 VanDerWaalsContact NH2-CG 3.27Å; R508-D510 IonicContact NH2-OD1 3.2Å; R508-D510 PolarHBondContact NH2-OD1 3.01Å; R508-D510 IonicContact NH2-OD2 3.32Å; R508-D510 PolarHBondContact NH2-OD2 3.03Å; R508-D510 VanDerWaalsContact NH2-OD2 3.14Å; R508-H511 HydrophobicContact CB-CB 4.4Å; R508-H511 WeakPolarHBondContact CD-NE2 3.3Å; R508-H511 PolarHBondContact NE-CE1 3.3Å; R508-H511 PolarHBondContact O-N 2.95Å; R508-L512 PolarHBondContact O-N 3.2Å
509	S	86.6	Confident	85.4	Confident	65 Å²	65	83.9 Å²	83.9	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-59.9	-44.2	175.5	48.8	0	0	0	0	113	H511 L512 S513	S509-H511 PolarHBondContact O-N 3.47Å; S509-L512 CarbonylContact O-C 3.59Å; S509-L512 WeakPolarHBondContact O-CB 3.38Å; S509-L512 PolarHBondContact O-N 2.84Å; S509-L512 VanDerWaalsContact O-N 3.1Å; S509-S513 PolarHBondContact O-N 3.26Å; S509-S513 PolarHBondContact O-OG 3.21Å; S509-S513 VanDerWaalsContact O-OG 3.12Å
510	D	84	Confident	84.5	Confident	49 Å²	49	88.9 Å²	88.9	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-25.8	-178.3	76.4	-81	0	0	0	113.2	R508 K514	R508-D510 IonicContact CZ-OD1 3.75Å; R508-D510 IonicContact CZ-OD2 3.08Å; R508-D510 IonicContact NE-OD1 2.81Å; R508-D510 PolarHBondContact NE-OD1 3.26Å; R508-D510 VanDerWaalsContact NH2-CG 3.27Å; R508-D510 IonicContact NH2-OD1 3.2Å; R508-D510 PolarHBondContact NH2-OD1 3.01Å; R508-D510 IonicContact NH2-OD2 3.32Å; R508-D510 PolarHBondContact NH2-OD2 3.03Å; R508-D510 VanDerWaalsContact NH2-OD2 3.14Å; D510-K514 WeakPolarHBondContact O-CB 3.31Å; D510-K514 VanDerWaalsContact O-CG 3.26Å; D510-K514 WeakPolarHBondContact O-CG 3.46Å; D510-K514 PolarHBondContact O-N 3.46Å; D510-K514 IonicContact OD2-NZ 2.83Å
511	H	88.2	Confident	83.1	Confident	66 Å²	66	83.9 Å²	83.9	31%	0.306	40%	0.403	S	S	.	.	H	α-helix	trans	-74.3	-43.4	173.8	-64.4	1.6	0	0	0	110.7	F506 R508 S509 K514 H515	F506-H511 HydrophobicContact CB-CB 4.2Å; F506-H511 HydrophobicContact CD1-CB 3.98Å; F506-H511 HydrophobicContact CG-CB 4.34Å; R508-H511 HydrophobicContact CB-CB 4.4Å; R508-H511 WeakPolarHBondContact CD-NE2 3.3Å; R508-H511 PolarHBondContact NE-CE1 3.3Å; R508-H511 PolarHBondContact O-N 2.95Å; S509-H511 PolarHBondContact O-N 3.47Å; H511-K514 PolarHBondContact O-N 2.87Å; H511-H515 WeakPolarHBondContact O-CB 3.36Å; H511-H515 PolarHBondContact O-N 3.29Å
512	L	88	Confident	81.6	Confident	25 Å²	25	82.3 Å²	82.3	13%	0.131	41%	0.413	C	S	.	.	H	α-helix	trans	-58.9	-46.1	169.7	173.9	61	0	0	0	111.3	F497 I498 C499 F506 R508 S509 K514 H515 L516	F497-L512 HydrophobicContact CB-CB 4.07Å; F497-L512 HydrophobicContact CB-CD2 3.9Å; I498-L512 WeakPolarHBondContact O-CD2 3.16Å; C499-L512 HydrophobicContact CB-CD1 3.88Å; F506-L512 HydrophobicContact CB-CB 4.42Å; F506-L512 HydrophobicContact CD2-CB 3.9Å; F506-L512 HydrophobicContact CD2-CD1 3.92Å; F506-L512 HydrophobicContact CE2-CD1 4.02Å; F506-L512 HydrophobicContact CG-CB 4.32Å; R508-L512 PolarHBondContact O-N 3.2Å; S509-L512 CarbonylContact O-C 3.59Å; S509-L512 WeakPolarHBondContact O-CB 3.38Å; S509-L512 PolarHBondContact O-N 2.84Å; S509-L512 VanDerWaalsContact O-N 3.1Å; L512-K514 PolarHBondContact O-N 3.44Å; L512-H515 WeakPolarHBondContact O-CB 3.46Å; L512-H515 PolarHBondContact O-N 3.22Å; L512-H515 VanDerWaalsContact O-N 3.15Å; L512-L516 HydrophobicContact CD1-CD1 4.01Å; L512-L516 HydrophobicContact CD1-CD2 4.42Å; L512-L516 HydrophobicContact CD1-CG 3.92Å; L512-L516 HydrophobicContact CG-CD1 3.94Å; L512-L516 HydrophobicContact CG-CG 4.32Å; L512-L516 WeakPolarHBondContact O-CG 3.37Å; L512-L516 PolarHBondContact O-N 3.44Å
513	S	87.2	Confident	79.9	Confident	66 Å²	66	86.5 Å²	86.5	46%	0.462	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-37.8	178.2	-55.3	0	0	0	0	113	S509 R517	S509-S513 PolarHBondContact O-N 3.26Å; S509-S513 PolarHBondContact O-OG 3.21Å; S509-S513 VanDerWaalsContact O-OG 3.12Å; S513-R517 PolarHBondContact O-N 3.28Å
514	K	86.4	Confident	77.9	Confident	131 Å²	131	85.7 Å²	85.7	57%	0.57	43%	0.431	S	S	*	.	H	α-helix	trans	-67.7	-39.1	172.5	-77.3	169.3	178.2	172.1	0	112	D510 H511 L512 R517	D510-K514 WeakPolarHBondContact O-CB 3.31Å; D510-K514 VanDerWaalsContact O-CG 3.26Å; D510-K514 WeakPolarHBondContact O-CG 3.46Å; D510-K514 PolarHBondContact O-N 3.46Å; D510-K514 IonicContact OD2-NZ 2.83Å; H511-K514 PolarHBondContact O-N 2.87Å; L512-K514 PolarHBondContact O-N 3.44Å; K514-R517 WeakPolarHBondContact O-CB 3.42Å; K514-R517 PolarHBondContact O-N 3.25Å
515	H	88.8	Confident	75.7	Confident	22 Å²	22	89.9 Å²	89.9	10%	0.102	46%	0.459	C	S	.	.	H	α-helix	trans	-67.3	-42.7	176.8	163.6	70	0	0	0	112.5	C499 C502 F506 H511 L512 R517 R518 H519	C499-H515 WeakPolarHBondContact CB-NE2 3.27Å; C499-H515 PolarHBondContact SG-NE2 2.88Å; C502-H515 PolarHBondContact SG-CE1 2.86Å; C502-H515 PolarHBondContact SG-NE2 3.35Å; F506-H515 HydrophobicContact CE1-CB 4Å; F506-H515 HydrophobicContact CE2-CB 4Å; F506-H515 AromaticContact CE2-CD2 3.36Å; F506-H515 WeakPolarHBondContact CE2-CD2 3.47Å; F506-H515 AromaticContact CE2-CG 3.7Å; F506-H515 HydrophobicContact CZ-CB 3.5Å; F506-H515 VanDerWaalsContact CZ-CB 3.5Å; F506-H515 AromaticContact CZ-CD2 3.45Å; F506-H515 VanDerWaalsContact CZ-CD2 3.45Å; F506-H515 WeakPolarHBondContact CZ-CD2 3.44Å; F506-H515 AromaticContact CZ-CG 3.28Å; F506-H515 AromaticContact CZ-ND1 3.8Å; H511-H515 WeakPolarHBondContact O-CB 3.36Å; H511-H515 PolarHBondContact O-N 3.29Å; L512-H515 WeakPolarHBondContact O-CB 3.46Å; L512-H515 PolarHBondContact O-N 3.22Å; L512-H515 VanDerWaalsContact O-N 3.15Å; H515-R517 PolarHBondContact O-N 3.4Å; H515-R518 WeakPolarHBondContact O-CA 3.31Å; H515-R518 VanDerWaalsContact O-CB 3.3Å; H515-R518 WeakPolarHBondContact O-CB 3.46Å; H515-R518 PolarHBondContact O-N 3.48Å; H515-H519 AromaticContact CE1-CD2 3.63Å; H515-H519 AromaticContact CE1-NE2 3.29Å; H515-H519 PolarHBondContact CE1-NE2 3.49Å; H515-H519 VanDerWaalsContact CE1-NE2 3.29Å; H515-H519 AromaticContact NE2-CD2 3.46Å; H515-H519 PolarHBondContact NE2-CD2 3.49Å; H515-H519 AromaticContact NE2-NE2 3.21Å; H515-H519 PolarHBondContact NE2-NE2 3.03Å
516	L	85.8	Confident	73.3	Confident	62 Å²	62	95.5 Å²	95.5	33%	0.325	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-28.2	176.2	-73.3	169.3	0	0	0	112.7	L512 R518 H519 N520	L512-L516 HydrophobicContact CD1-CD1 4.01Å; L512-L516 HydrophobicContact CD1-CD2 4.42Å; L512-L516 HydrophobicContact CD1-CG 3.92Å; L512-L516 HydrophobicContact CG-CD1 3.94Å; L512-L516 HydrophobicContact CG-CG 4.32Å; L512-L516 WeakPolarHBondContact O-CG 3.37Å; L512-L516 PolarHBondContact O-N 3.44Å; L516-R518 VanDerWaalsContact C-N 3.3Å; L516-R518 PolarHBondContact O-N 3.45Å; L516-H519 PolarHBondContact O-N 3.44Å; L516-H519 VanDerWaalsContact O-N 3.13Å; L516-N520 PolarHBondContact O-N 3.04Å
517	R	87.6	Confident	72.9	Confident	187 Å²	187	98.5 Å²	98.5	71%	0.706	50%	0.504	S	S	*	.	H	α-helix	trans	-61.7	-35.4	170.5	-65.3	176.6	-172.8	-160	-0.6	112.5	S513 K514 H515 H519 N520 S521	S513-R517 PolarHBondContact O-N 3.28Å; K514-R517 WeakPolarHBondContact O-CB 3.42Å; K514-R517 PolarHBondContact O-N 3.25Å; H515-R517 PolarHBondContact O-N 3.4Å; R517-H519 VanDerWaalsContact C-N 3.26Å; R517-H519 PolarHBondContact O-N 2.94Å; R517-N520 CarbonylContact O-C 3.47Å; R517-N520 PolarHBondContact O-N 3.1Å; R517-N520 VanDerWaalsContact O-N 3.07Å; R517-S521 PolarHBondContact O-N 3.33Å; R517-S521 PolarHBondContact O-OG 3.38Å
518	R	81.5	Confident	72.4	Confident	142 Å²	142	101.3 Å²	101.3	54%	0.536	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-28.8	174.3	-59.4	-172.8	179.9	-179.1	1.8	112.2	N300 H515 L516	N300-R518 PolarHBondContact ND2-NH1 3.35Å; N300-R518 PolarHBondContact OD1-NH2 3.49Å; H515-R518 WeakPolarHBondContact O-CA 3.31Å; H515-R518 VanDerWaalsContact O-CB 3.3Å; H515-R518 WeakPolarHBondContact O-CB 3.46Å; H515-R518 PolarHBondContact O-N 3.48Å; L516-R518 VanDerWaalsContact C-N 3.3Å; L516-R518 PolarHBondContact O-N 3.45Å
519	H	81.8	Confident	71.8	Confident	62 Å²	62	103 Å²	103	29%	0.287	53%	0.53	S	S	.	.	H	α-helix	trans	-81	-12.5	172.7	-74.7	-69.6	0	0	0	114.1	R501 C502 H515 L516 R517	R501-H519 PolarHBondContact NH1-O 3.35Å; C502-H519 PolarHBondContact SG-NE2 3.12Å; C502-H519 VanDerWaalsContact SG-NE2 3.37Å; H515-H519 AromaticContact CE1-CD2 3.63Å; H515-H519 AromaticContact CE1-NE2 3.29Å; H515-H519 PolarHBondContact CE1-NE2 3.49Å; H515-H519 VanDerWaalsContact CE1-NE2 3.29Å; H515-H519 AromaticContact NE2-CD2 3.46Å; H515-H519 PolarHBondContact NE2-CD2 3.49Å; H515-H519 AromaticContact NE2-NE2 3.21Å; H515-H519 PolarHBondContact NE2-NE2 3.03Å; L516-H519 PolarHBondContact O-N 3.44Å; L516-H519 VanDerWaalsContact O-N 3.13Å; R517-H519 VanDerWaalsContact C-N 3.26Å; R517-H519 PolarHBondContact O-N 2.94Å
520	N	68.4	Low	70.9	Confident	110 Å²	110	105.2 Å²	105.2	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-104.6	-2.6	173.4	-75	-3.2	0	0	0	112.4	R501 L516 R517	R501-N520 PolarHBondContact NH1-OD1 3.1Å; R501-N520 PolarHBondContact NH2-OD1 3Å; L516-N520 PolarHBondContact O-N 3.04Å; R517-N520 CarbonylContact O-C 3.47Å; R517-N520 PolarHBondContact O-N 3.1Å; R517-N520 VanDerWaalsContact O-N 3.07Å
521	S	58.4	Low	70.1	Confident	76 Å²	76	108.8 Å²	108.8	53%	0.531	55%	0.552	S	S	.	*	S	Bend	trans	-65.7	123.8	164.9	-62.7	0	0	0	0	108.2	R517 V523	R517-S521 PolarHBondContact O-N 3.33Å; R517-S521 PolarHBondContact O-OG 3.38Å; S521-V523 PolarHBondContact O-N 3.1Å
522	P	51.9	Low	68.9	Low	116 Å²	116	111.6 Å²	111.6	75%	0.753	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-59.3	140.5	166.6	27	-33.3	0	0	0	108.2
523	V	51.3	Low	67.5	Low	124 Å²	124	117.8 Å²	117.8	75%	0.752	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-58.2	126	171.8	179.6	0	0	0	0	106.9	S521 L525	S521-V523 PolarHBondContact O-N 3.1Å; V523-L525 PolarHBondContact O-N 3.27Å
524	P	44.3	Very low	66	Low	107 Å²	107	121.8 Å²	121.8	70%	0.695	61%	0.61	S	S	*	*			trans	-63.5	113.2	174.2	26.1	-32.4	0	0	0	107.9	K526	P524-K526 PolarHBondContact O-N 3.43Å
525	L	36.3	Very low	64.3	Low	176 Å²	176	121 Å²	121	92%	0.921	61%	0.613	S	S	*	*			trans	-57	121.2	175	-64.9	172.7	0	0	0	108.5	V523	V523-L525 PolarHBondContact O-N 3.27Å
526	K	36	Very low	62.1	Low	268 Å²	268	130 Å²	130	100%	1.165	66%	0.66	S	S	*	*			trans	-156	0	-173	-137	-171.5	-176.4	-166.7	0	111.6	P524	P524-K526 PolarHBondContact O-N 3.43Å

Retrieved 526 of 526 residues in 69.6 ms (Link to these results)

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