A0A077Z8E3_TRITR Loading...

T box transcription factor TBX20

AlphaFold DB , UniProt , Accession A0A077Z8E3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 486 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	37.9	Very low	232 Å²	232	146.4 Å²	146.4	100%	1.143	79%	0.794	S	S	*	*				0	96.9	0	-72.4	-178.7	166.2	0	0	106.6
2	I	36.6	Very low	37.7	Very low	154 Å²	154	143.1 Å²	143.1	79%	0.79	80%	0.802	S	S	*	*				71.2	100.1	116.4	-57.8	169.8	0	0	0	110.3
3	S	36.3	Very low	37.5	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	80%	0.799	S	S	*	*				55.7	140.6	88.2	-83.4	0	0	0	0	111.9
4	D	39.6	Very low	37	Very low	131 Å²	131	142.1 Å²	142.1	70%	0.701	81%	0.808	S	S	*	*			cis	179.4	173.3	5.3	-116.2	-44.3	0	0	0	105.4
5	K	41.8	Very low	36.8	Very low	194 Å²	194	139.8 Å²	139.8	84%	0.843	80%	0.804	S	S	*	*			trans	76.1	145.2	156.4	-71.9	164	-176.7	-171.8	0	117.9
6	S	40.1	Very low	36.6	Very low	88 Å²	88	140.6 Å²	140.6	62%	0.615	81%	0.805	S	S	*	*			cis	-177.6	138.1	-6.9	44.6	0	0	0	0	107.8
7	E	38	Very low	36.3	Very low	194 Å²	194	145.4 Å²	145.4	91%	0.907	82%	0.815	S	S	*	*			trans	69	145.6	137.3	-64.9	178.9	169.3	0	0	122.8
8	S	32.2	Very low	36.2	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	81%	0.809	S	S	*	*			trans	-114.8	-153.4	-165.3	57.5	0	0	0	0	110.2
9	P	44.6	Very low	35.9	Very low	103 Å²	103	145.3 Å²	145.3	67%	0.669	81%	0.813	S	S	*	*				-125.1	-176.9	-56.2	27	-6.6	0	0	0	111
10	F	34	Very low	35.6	Very low	202 Å²	202	148.4 Å²	148.4	89%	0.886	82%	0.82	S	S	*	*			trans	179.2	144.3	132.1	-114.4	-86.8	0	0	0	114.3
11	S	36.2	Very low	35.2	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	81%	0.814	S	S	*	*			trans	94.2	91.7	151.1	-110.7	0	0	0	0	122.8
12	A	35.8	Very low	34.8	Very low	107 Å²	107	144 Å²	144	88%	0.884	80%	0.802	S	S	*	*				45.6	130.6	120.9	0	0	0	0	0	123.1
13	G	34.4	Very low	34.3	Very low	75 Å²	75	145 Å²	145	77%	0.773	81%	0.807	S	S	*	*			trans	146.3	88.4	142	0	0	0	0	0	118.8
14	Q	31.3	Very low	34	Very low	198 Å²	198	144.6 Å²	144.6	93%	0.925	80%	0.804	S	S	*	*			trans	48.1	106.5	145.8	-67.1	-179.5	-14.8	0	0	121.9
15	S	33.2	Very low	33.4	Very low	107 Å²	107	148 Å²	148	75%	0.748	82%	0.816	S	S	*	*				170.3	118.9	120.1	58.1	0	0	0	0	109.6
16	D	33.3	Very low	32.8	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	81%	0.805	S	S	*	*			trans	176.1	112.8	143.7	-88.4	-21.1	0	0	0	110.5
17	K	32.2	Very low	32.2	Very low	222 Å²	222	149.8 Å²	149.8	97%	0.965	82%	0.817	S	S	*	*			trans	-102	77	169	-86.1	-173.8	175.2	178.7	0	108.2
18	S	33.5	Very low	31.7	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	81%	0.806	S	S	*	*			trans	-164.4	56.8	167	56.9	0	0	0	0	111.4
19	E	31.9	Very low	31.6	Very low	186 Å²	186	147.1 Å²	147.1	87%	0.869	80%	0.804	S	S	*	*			trans	-156.7	66.8	172.2	-141.7	174.7	-179.7	0	0	111.5
20	Q	28.4	Very low	30.9	Very low	207 Å²	207	149 Å²	149	97%	0.967	81%	0.808	S	S	*	*			trans	-120.4	61.2	161.9	-83.7	-177.8	-1.3	0	0	108.4
21	A	28.2	Very low	30.6	Very low	83 Å²	83	148.2 Å²	148.2	69%	0.686	81%	0.805	S	S	*	*	S	Bend	trans	-151.8	94.4	170.2	0	0	0	0	0	108.6
22	K	29	Very low	30.5	Very low	205 Å²	205	146.3 Å²	146.3	89%	0.891	79%	0.788	S	S	*	*			trans	117.8	86.4	176.3	-76.8	175.3	169.4	177.2	0	112.8
23	I	26.9	Very low	30.6	Very low	175 Å²	175	143.2 Å²	143.2	90%	0.897	76%	0.757	S	S	*	*			trans	174.4	104.5	153.2	-79.7	137.8	0	0	0	100.1
24	S	28.7	Very low	30.6	Very low	89 Å²	89	142.8 Å²	142.8	62%	0.622	75%	0.746	S	S	*	*			cis	-160.5	114.5	42.4	49.5	0	0	0	0	109	I26	S24-I26 PolarHBondContact O-N 2.9Å
25	E	27.3	Very low	30.6	Very low	201 Å²	201	136.8 Å²	136.8	94%	0.939	73%	0.73	S	S	*	*			trans	-67.3	82.9	161.5	-88.9	-179.1	139.4	0	0	108.9	K27	E25-K27 PolarHBondContact O-N 3.38Å
26	I	28.6	Very low	30.7	Very low	120 Å²	120	134.7 Å²	134.7	62%	0.615	71%	0.71	S	S	*	*			trans	-90.6	101.2	163.3	-64.3	175.9	0	0	0	106.4	S24 H28	S24-I26 PolarHBondContact O-N 2.9Å; I26-H28 PolarHBondContact O-N 3.17Å; I26-H28 PolarHBondContact O-ND1 3.26Å
27	K	27.4	Very low	30.9	Very low	200 Å²	200	129.4 Å²	129.4	87%	0.87	68%	0.683	S	S	*	*			trans	-50.8	100.3	171.7	-70.2	174.1	176.6	175.4	0	109.6	E25	E25-K27 PolarHBondContact O-N 3.38Å
28	H	29.2	Very low	30.9	Very low	146 Å²	146	122.3 Å²	122.3	68%	0.676	67%	0.673	S	S	*	*			trans	-73.9	124.8	169.8	-76.2	58.7	0	0	0	108.2	I26 N30	I26-H28 PolarHBondContact O-N 3.17Å; I26-H28 PolarHBondContact O-ND1 3.26Å; H28-N30 PolarHBondContact O-N 3.04Å; H28-N30 VanDerWaalsContact O-N 3.15Å
29	S	28.2	Very low	30.8	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	68%	0.68	S	S	*	*			trans	-61.2	112.1	177.9	57	0	0	0	0	110.6	F31	S29-F31 PolarHBondContact O-N 3.49Å
30	N	30	Very low	30.7	Very low	143 Å²	143	118.8 Å²	118.8	77%	0.765	67%	0.674	S	S	*	*			trans	-69	91.8	177.4	-71.1	-40.5	0	0	0	111.6	H28 T32	H28-N30 PolarHBondContact O-N 3.04Å; H28-N30 VanDerWaalsContact O-N 3.15Å; N30-T32 VanDerWaalsContact C-N 3.34Å; N30-T32 PolarHBondContact O-N 3.33Å
31	F	29.3	Very low	30.9	Very low	185 Å²	185	118.4 Å²	118.4	81%	0.811	67%	0.673	S	S	*	*			trans	-92.4	71.9	156.4	-83.6	-87.4	0	0	0	108.8	S29	S29-F31 PolarHBondContact O-N 3.49Å
32	T	34.2	Very low	31.1	Very low	66 Å²	66	120.9 Å²	120.9	41%	0.405	68%	0.68	S	S	.	*			trans	-104.1	148.7	173.7	-44	0	0	0	0	108.6	N30 A34 A35	N30-T32 VanDerWaalsContact C-N 3.34Å; N30-T32 PolarHBondContact O-N 3.33Å; T32-A34 PolarHBondContact O-N 3.1Å; T32-A35 PolarHBondContact O-N 3.41Å
33	I	38.1	Very low	31	Very low	42 Å²	42	116.7 Å²	116.7	22%	0.215	68%	0.676	C	S	.	*	G	3₁₀ helix	trans	-43.3	-14.2	175.6	-66.2	169.2	0	0	0	114.8	A35 I36 Y481	I33-A35 VanDerWaalsContact C-N 3.29Å; I33-A35 PolarHBondContact O-N 3.27Å; I33-I36 PolarHBondContact O-N 2.93Å; I33-Y481 HydrophobicContact CD1-CE2 3.99Å
34	A	33.6	Very low	31.3	Very low	67 Å²	67	113.8 Å²	113.8	55%	0.554	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-55.5	-33.8	164.6	0	0	0	0	0	114.2	T32 I36 V37	T32-A34 PolarHBondContact O-N 3.1Å; A34-I36 PolarHBondContact O-N 2.88Å; A34-V37 PolarHBondContact O-N 3.24Å
35	A	31.8	Very low	31.2	Very low	72 Å²	72	115.5 Å²	115.5	60%	0.595	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-69.1	-12.6	179.8	0	0	0	0	0	114	T32 I33	T32-A35 PolarHBondContact O-N 3.41Å; I33-A35 VanDerWaalsContact C-N 3.29Å; I33-A35 PolarHBondContact O-N 3.27Å
36	I	35.7	Very low	31.2	Very low	63 Å²	63	112.2 Å²	112.2	32%	0.323	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-91.5	-14.8	-179.7	-56.5	176.2	0	0	0	111.9	I33 A34 A306 F309	I33-I36 PolarHBondContact O-N 2.93Å; A34-I36 PolarHBondContact O-N 2.88Å; I36-A306 HydrophobicContact CG2-CB 4.44Å; I36-F309 HydrophobicContact CB-CE2 4.02Å; I36-F309 HydrophobicContact CB-CZ 4.39Å; I36-F309 HydrophobicContact CD1-CE2 4.46Å; I36-F309 HydrophobicContact CD1-CZ 4.31Å; I36-F309 HydrophobicContact CG1-CD2 4.46Å; I36-F309 HydrophobicContact CG1-CE1 4.35Å; I36-F309 HydrophobicContact CG1-CE2 3.57Å; I36-F309 HydrophobicContact CG1-CZ 3.5Å; I36-F309 HydrophobicContact CG2-CD2 4.4Å; I36-F309 HydrophobicContact CG2-CE2 3.98Å
37	V	37.1	Very low	31.1	Very low	41 Å²	41	114.3 Å²	114.3	25%	0.248	68%	0.676	C	S	.	*	S	Bend	trans	-142.1	104.3	178.9	178.1	0	0	0	0	109.2	A34 S39	A34-V37 PolarHBondContact O-N 3.24Å; V37-S39 PolarHBondContact O-N 3.11Å; V37-S39 VanDerWaalsContact O-N 3.09Å
38	G	30.8	Very low	30.9	Very low	74 Å²	74	110.4 Å²	110.4	76%	0.763	67%	0.669	S	S	*	*			trans	-47	112.9	178.7	0	0	0	0	0	112.2
39	S	31.7	Very low	30.7	Very low	123 Å²	123	111.4 Å²	111.4	86%	0.86	68%	0.678	S	S	*	*			trans	-95.4	97	158.6	-62.4	0	0	0	0	106.4	V37	V37-S39 PolarHBondContact O-N 3.11Å; V37-S39 VanDerWaalsContact O-N 3.09Å
40	A	29.6	Very low	30.4	Very low	91 Å²	91	111.6 Å²	111.6	75%	0.752	68%	0.68	S	S	*	*			trans	-115.5	101.8	160.8	0	0	0	0	0	105.6
41	E	32.9	Very low	30.1	Very low	199 Å²	199	113.4 Å²	113.4	93%	0.93	69%	0.686	S	S	*	*			trans	-169.8	129.8	145.8	-104.7	167.7	-149.2	0	0	109.3
42	T	33.6	Very low	29.9	Very low	136 Å²	136	113.4 Å²	113.4	83%	0.834	69%	0.686	S	S	*	*			trans	-90.1	133.1	-171.2	44.8	0	0	0	0	111.6
43	S	27	Very low	29.6	Very low	116 Å²	116	118 Å²	118	81%	0.811	71%	0.706	S	S	*	*			trans	6.6	170.8	150.6	-57.8	0	0	0	0	122.2
44	P	32.7	Very low	29.2	Very low	114 Å²	114	122.4 Å²	122.4	74%	0.74	73%	0.73	S	S	*	*			cis	-140	166.4	8	19.9	7.7	0	0	0	118.2
45	T	25.5	Very low	28.8	Very low	125 Å²	125	127.3 Å²	127.3	77%	0.767	74%	0.741	S	S	*	*			trans	52.1	121.4	141.8	-49.2	0	0	0	0	121.6
46	V	28.4	Very low	28.6	Very low	133 Å²	133	131 Å²	131	81%	0.806	76%	0.756	S	S	*	*				-163.4	128.6	121.8	174.1	0	0	0	0	111.9
47	Q	27.3	Very low	28	Very low	163 Å²	163	134.3 Å²	134.3	76%	0.762	78%	0.779	S	S	*	*			trans	-8.1	127.6	163.2	-65.7	160.6	-17	0	0	121.9
48	T	22.4	Very low	27.6	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	80%	0.802	S	S	*	*				71.5	118.2	92.6	-29.6	0	0	0	0	113.5
49	L	24.8	Very low	27.4	Very low	167 Å²	167	138.4 Å²	138.4	87%	0.874	80%	0.802	S	S	*	*				-174.1	145.1	78.6	-85.9	160.7	0	0	0	111.6
50	S	21.4	Very low	27.3	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	79%	0.792	S	S	*	*			trans	-91	143.1	175.3	176.7	0	0	0	0	111.4
51	M	25.4	Very low	27.4	Very low	180 Å²	180	141.6 Å²	141.6	89%	0.887	79%	0.792	S	S	*	*			trans	-135.9	126.8	155.8	-67.8	-173.9	74.8	0	0	109.9
52	K	23.3	Very low	27.1	Very low	186 Å²	186	138.3 Å²	138.3	81%	0.809	79%	0.785	S	S	*	*			trans	-78	154.4	166.6	-70.7	172	172.3	176.9	0	109.6
53	I	29.2	Very low	27	Very low	163 Å²	163	141 Å²	141	84%	0.836	79%	0.788	S	S	*	*			trans	-165.1	146.3	136.9	-92.9	145.9	0	0	0	109.6
54	D	28.7	Very low	27	Very low	133 Å²	133	144.6 Å²	144.6	71%	0.711	79%	0.792	S	S	*	*			trans	-80.6	161.1	-161.1	-65.2	-68.1	0	0	0	117.9
55	Q	25.1	Very low	26.9	Very low	170 Å²	170	145 Å²	145	79%	0.794	80%	0.795	S	S	*	*			trans	26.2	123.6	141.2	-62.5	177.8	29.7	0	0	120.5
56	V	28.6	Very low	27.2	Very low	149 Å²	149	147.8 Å²	147.8	90%	0.903	80%	0.804	S	S	*	*				-151.5	133	126.1	-178.6	0	0	0	0	110
57	T	23.7	Very low	27.3	Very low	133 Å²	133	149.8 Å²	149.8	82%	0.816	80%	0.802	S	S	*	*			trans	-103.3	143.1	177.3	-53.5	0	0	0	0	110.7
58	A	28.4	Very low	27.2	Very low	87 Å²	87	149.2 Å²	149.2	72%	0.719	80%	0.804	S	S	*	*			trans	157.2	120.7	144.2	0	0	0	0	0	110.1
59	C	27	Very low	27.7	Very low	114 Å²	114	147.5 Å²	147.5	77%	0.77	81%	0.81	S	S	*	*				54.3	134.3	95.7	-84	0	0	0	0	113.3
60	D	29.6	Very low	28	Very low	122 Å²	122	148 Å²	148	65%	0.652	81%	0.808	S	S	*	*			cis	-170.9	155.8	13.9	-111.6	-42.5	0	0	0	108.3
61	Q	31.6	Very low	28.8	Very low	160 Å²	160	153.2 Å²	153.2	75%	0.748	82%	0.818	S	S	*	*			trans	54	116.2	142.9	-56	-175.5	31.1	0	0	123
62	V	26	Very low	29.2	Very low	129 Å²	129	151.2 Å²	151.2	78%	0.782	81%	0.81	S	S	*	*				69.6	109.2	98.6	-171.7	0	0	0	0	115.6
63	E	30.7	Very low	29.9	Very low	193 Å²	193	147 Å²	147	90%	0.902	81%	0.81	S	S	*	*				-177.4	159	128.3	-106	-179.4	171.7	0	0	113.8
64	Q	27.8	Very low	30.2	Very low	191 Å²	191	145.6 Å²	145.6	89%	0.893	81%	0.805	S	S	*	*			trans	-86	170.8	-164.2	-80.6	-176.4	-10.8	0	0	115.6
65	P	30.3	Very low	30.7	Very low	124 Å²	124	146.7 Å²	146.7	81%	0.805	81%	0.81	S	S	*	*			trans	-97.9	155.8	-162.2	37.8	-31.9	0	0	0	115.5
66	L	31.1	Very low	31.3	Very low	182 Å²	182	143.4 Å²	143.4	95%	0.953	80%	0.801	S	S	*	*			trans	-109.3	151.9	172.4	-99	151.4	0	0	0	112
67	K	30.3	Very low	31.6	Very low	176 Å²	176	144.1 Å²	144.1	77%	0.765	80%	0.799	S	S	*	*			trans	-97.5	156.5	-169.9	-94.3	-176.5	175.4	-173.6	0	113.3
68	D	26.8	Very low	32.4	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	80%	0.796	S	S	*	*			trans	68.4	130.6	147.7	-50	-21.2	0	0	0	120.5
69	G	33.2	Very low	33	Very low	82 Å²	82	143.2 Å²	143.2	85%	0.845	80%	0.796	S	S	*	*			trans	176	90.2	172.1	0	0	0	0	0	112.4
70	E	29.2	Very low	33.4	Very low	179 Å²	179	144.3 Å²	144.3	84%	0.836	80%	0.799	S	S	*	*			trans	-79.3	141	176	-168.3	171	-165.1	0	0	110.6
71	F	39.5	Very low	33.8	Very low	215 Å²	215	143.6 Å²	143.6	94%	0.943	81%	0.81	S	S	*	*			trans	-144.4	124.9	166.9	-139.6	-89.2	0	0	0	110.3
72	D	32.3	Very low	34.1	Very low	137 Å²	137	140.4 Å²	140.4	73%	0.733	81%	0.811	S	S	*	*			trans	-99.2	169	-172.6	-114.9	-26.1	0	0	0	112.6
73	A	40	Very low	35	Very low	97 Å²	97	140 Å²	140	80%	0.802	81%	0.811	S	S	*	*			trans	76.6	144.6	158.9	0	0	0	0	0	117.8
74	D	34.9	Very low	35.3	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	81%	0.807	S	S	*	*			cis	-177.1	163	-9.1	-177.5	12.7	0	0	0	104.9
75	L	38.7	Very low	35.9	Very low	156 Å²	156	130.8 Å²	130.8	82%	0.817	80%	0.8	S	S	*	*			trans	137.9	81.4	155.6	-72.2	151.5	0	0	0	116.7
76	T	36.8	Very low	36.3	Very low	100 Å²	100	132.4 Å²	132.4	61%	0.613	80%	0.802	S	S	*	*				38.6	125	120	12	0	0	0	0	123.9
77	L	36.3	Very low	36.8	Very low	165 Å²	165	131.7 Å²	131.7	86%	0.864	80%	0.799	S	S	*	*				49.8	137.9	128.6	-68.1	168.7	0	0	0	119.9
78	A	39.4	Very low	37.2	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	80%	0.803	S	S	*	*			cis	-169.4	173.9	33.1	0	0	0	0	0	111.6
79	P	41.9	Very low	37.8	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	81%	0.805	S	S	*	*			trans	-115.1	177.7	-166	38.9	-25.3	0	0	0	115.7
80	T	35.9	Very low	37.9	Very low	138 Å²	138	137.1 Å²	137.1	85%	0.847	80%	0.804	S	S	*	*			trans	136.8	130	141.1	48.7	0	0	0	0	116.1
81	A	37.8	Very low	38.3	Very low	106 Å²	106	135.1 Å²	135.1	88%	0.876	81%	0.805	S	S	*	*			trans	141.5	126.5	133.9	0	0	0	0	0	113.8
82	A	37.9	Very low	37.9	Very low	93 Å²	93	134.7 Å²	134.7	77%	0.769	81%	0.806	S	S	*	*			trans	-107.3	-161.8	174.5	0	0	0	0	0	109.4
83	P	44.1	Very low	38	Very low	122 Å²	122	131.5 Å²	131.5	79%	0.792	81%	0.806	S	S	*	*			cis	-135.9	-170.4	-32.4	27.9	-4.5	0	0	0	113.8
84	A	36.2	Very low	37.7	Very low	99 Å²	99	132.8 Å²	132.8	82%	0.818	81%	0.805	S	S	*	*			trans	90.9	120.8	146.3	0	0	0	0	0	121.5
85	A	41.3	Very low	37.7	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	81%	0.809	S	S	*	*				166.3	110.9	127.1	0	0	0	0	0	112.7
86	D	39.7	Very low	37.5	Very low	159 Å²	159	132.9 Å²	132.9	85%	0.85	81%	0.813	S	S	*	*			trans	15	132	135.8	-41.4	-29.9	0	0	0	120.7
87	D	41	Very low	37.2	Very low	166 Å²	166	135.8 Å²	135.8	89%	0.888	83%	0.825	S	S	*	*				173.8	151.2	107.6	-124.5	-31.4	0	0	0	113.6
88	E	39.2	Very low	37.1	Very low	179 Å²	179	132.1 Å²	132.1	84%	0.836	81%	0.813	S	S	*	*			trans	-77.9	147.6	-173.3	-64.7	-169.3	139.1	0	0	115.6
89	H	39.5	Very low	36.9	Very low	183 Å²	183	139.2 Å²	139.2	85%	0.847	82%	0.82	S	S	*	*			trans	-159.8	125.1	141.5	-145.8	-69.1	0	0	0	113.1
90	L	34.7	Very low	36.5	Very low	160 Å²	160	141.8 Å²	141.8	84%	0.838	82%	0.82	S	S	*	*			trans	-75.6	137	171.2	-73.5	154.3	0	0	0	111.7
91	T	37.9	Very low	36.5	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	81%	0.806	S	S	*	*			trans	-160.7	132.5	149.8	47.8	0	0	0	0	111.4
92	E	31.2	Very low	36.7	Very low	206 Å²	206	140.2 Å²	140.2	96%	0.963	79%	0.786	S	S	*	*			trans	-74.2	152.5	-178	-64.2	-167.9	144.4	0	0	115.9
93	G	34.1	Very low	36.8	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	78%	0.781	S	S	*	*			trans	148.5	158.4	152.3	0	0	0	0	0	115.1
94	P	34.2	Very low	36.5	Very low	123 Å²	123	138 Å²	138	80%	0.799	76%	0.764	S	S	*	*			cis	-119.5	178.6	-48.9	37.5	-21.7	0	0	0	110.9
95	P	33.3	Very low	36.7	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	77%	0.765	S	S	*	*			trans	-78.1	134.7	-164.3	31.8	-32.3	0	0	0	113.5	N97	P95-N97 PolarHBondContact O-N 3.37Å
96	L	34.3	Very low	36.6	Very low	171 Å²	171	146.4 Å²	146.4	90%	0.895	77%	0.768	S	S	*	*			trans	-70.9	84.1	173.8	-89.4	149	0	0	0	111.1
97	N	30.9	Very low	37	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	74%	0.739	S	S	*	*			trans	-117	81	164.7	-121.9	-4.8	0	0	0	108.4	P95	P95-N97 PolarHBondContact O-N 3.37Å
98	S	35.3	Very low	37.5	Very low	88 Å²	88	142.6 Å²	142.6	62%	0.615	73%	0.731	S	S	*	*			trans	-135.6	113.7	167.1	64.9	0	0	0	0	110.6	K100	S98-K100 PolarHBondContact O-N 3.46Å
99	R	34.5	Very low	38.4	Very low	239 Å²	239	138.6 Å²	138.6	90%	0.902	71%	0.712	S	S	*	*			trans	-59.3	116.4	173.4	-71.2	171.5	178.6	162.1	-0	109.1
100	K	34.4	Very low	39.6	Very low	164 Å²	164	130.6 Å²	130.6	71%	0.713	68%	0.675	S	S	*	*			trans	-96.5	95.9	162.2	-69	-173.3	-178.5	-179.3	0	108.3	S98 F102	S98-K100 PolarHBondContact O-N 3.46Å; K100-F102 HydrophobicContact CB-CD2 4.44Å; K100-F102 HydrophobicContact CB-CE2 3.87Å; K100-F102 HydrophobicContact CB-CZ 4.01Å; K100-F102 HydrophobicContact CD-CZ 4.33Å; K100-F102 WeakPolarHBondContact O-CD2 3.39Å
101	I	34.4	Very low	40.9	Very low	106 Å²	106	124.9 Å²	124.9	54%	0.544	66%	0.655	S	S	.	*			trans	-86.3	113.6	164.2	-62.3	173	0	0	0	105.3
102	F	43.5	Very low	42.1	Very low	105 Å²	105	122.7 Å²	122.7	46%	0.461	64%	0.644	S	S	.	*			trans	-82.7	127.2	-174.3	-68.6	-92.6	0	0	0	110.8	K100	K100-F102 HydrophobicContact CB-CD2 4.44Å; K100-F102 HydrophobicContact CB-CE2 3.87Å; K100-F102 HydrophobicContact CB-CZ 4.01Å; K100-F102 HydrophobicContact CD-CZ 4.33Å; K100-F102 WeakPolarHBondContact O-CD2 3.39Å
103	P	38.8	Very low	43.5	Very low	103 Å²	103	113.2 Å²	113.2	67%	0.669	60%	0.602	S	S	*	*			trans	-71.4	149.4	167.9	29.4	-31.6	0	0	0	110.4	K105	P103-K105 PolarHBondContact O-N 3.23Å; P103-K105 VanDerWaalsContact O-N 3.12Å
104	P	39.2	Very low	44.9	Very low	65 Å²	65	116.2 Å²	116.2	42%	0.422	60%	0.601	S	S	.	*			trans	-80.1	101.6	-168.9	31.8	-32.1	0	0	0	111
105	K	39.5	Very low	46.9	Very low	197 Å²	197	112.6 Å²	112.6	86%	0.857	57%	0.573	S	S	*	*	S	Bend	trans	-95.7	100.8	157.4	-71.6	-172.8	-179.9	-179.3	0	108.3	P103 Q107	P103-K105 PolarHBondContact O-N 3.23Å; P103-K105 VanDerWaalsContact O-N 3.12Å; K105-Q107 PolarHBondContact O-N 3.37Å
106	Q	39.9	Very low	48.8	Very low	169 Å²	169	109.8 Å²	109.8	79%	0.79	56%	0.561	S	S	*	*			trans	45.9	60.3	169.9	-66.1	179.5	0.9	0	0	116.1	R108	Q106-R108 PolarHBondContact O-N 2.91Å
107	Q	47.7	Very low	50.8	Low	52 Å²	52	106 Å²	106	24%	0.243	55%	0.545	C	S	.	.			trans	-71.4	100.7	167.1	-79.8	-179.8	-8.5	0	0	109.5	K105 T202	K105-Q107 PolarHBondContact O-N 3.37Å; Q107-T202 VanDerWaalsContact CB-O 3.31Å; Q107-T202 WeakPolarHBondContact CB-O 3.27Å; Q107-T202 PolarHBondContact OE1-O 2.83Å
108	R	51.9	Low	53.4	Low	192 Å²	192	98.3 Å²	98.3	73%	0.725	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-68.6	142.1	171.5	-66.1	176.8	175.4	172	-3	108.8	Q106 L110	Q106-R108 PolarHBondContact O-N 2.91Å; R108-L110 PolarHBondContact O-N 3.01Å
109	H	58.1	Low	55.6	Low	95 Å²	95	101.1 Å²	101.1	44%	0.44	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-48.2	126.4	171.3	-84	-67.6	0	0	0	110.5	G111 T202	H109-G111 PolarHBondContact O-N 3.39Å; H109-T202 PolarHBondContact CE1-OG1 3.38Å; H109-T202 PolarHBondContact ND1-OG1 2.82Å; H109-T202 PolarHBondContact NE2-OG1 2.87Å
110	L	64.6	Low	58.1	Low	15 Å²	15	96.3 Å²	96.3	8%	0.079	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-62.8	132.3	172.2	-77.4	156.3	0	0	0	108.4	R108 L170 I204 R251 F255 L269 Y274	R108-L110 PolarHBondContact O-N 3.01Å; L110-L170 HydrophobicContact CD1-CD1 3.93Å; L110-I204 HydrophobicContact CD1-CG2 3.78Å; L110-R251 VanDerWaalsContact O-CZ 3.28Å; L110-R251 PolarHBondContact O-NH1 2.69Å; L110-R251 PolarHBondContact O-NH2 2.97Å; L110-F255 HydrophobicContact CD2-CZ 4.3Å; L110-L269 HydrophobicContact CD1-CD2 3.93Å; L110-L269 HydrophobicContact CD2-CD2 3.57Å; L110-L269 HydrophobicContact CG-CD2 4.15Å; L110-Y274 HydrophobicContact CB-CE2 4.39Å; L110-Y274 HydrophobicContact CD2-CD1 4.35Å; L110-Y274 HydrophobicContact CD2-CE1 3.55Å; L110-Y274 HydrophobicContact CD2-CE2 4.14Å; L110-Y274 VanDerWaalsContact CD2-CZ 3.45Å; L110-Y274 WeakPolarHBondContact CD2-OH 3.17Å
111	G	61.7	Low	61	Low	40 Å²	40	88.8 Å²	88.8	41%	0.412	46%	0.464	S	S	.	.			trans	-68.1	-173.2	168.3	0	0	0	0	0	111.6	H109 G113 Y274	H109-G111 PolarHBondContact O-N 3.39Å; G111-G113 PolarHBondContact O-N 2.9Å; G111-Y274 WeakPolarHBondContact CA-OH 3.38Å; G111-Y274 PolarHBondContact N-OH 3.47Å; G111-Y274 WeakPolarHBondContact O-CE2 3.49Å; G111-Y274 PolarHBondContact O-OH 2.89Å; G111-Y274 VanDerWaalsContact O-OH 3.14Å
112	C	62.2	Low	63.9	Low	91 Å²	91	89 Å²	89	62%	0.615	46%	0.463	S	S	*	.			trans	-86.8	91.8	163.4	-66.2	0	0	0	0	107.9
113	G	60.8	Low	66.4	Low	8 Å²	8	84.7 Å²	84.7	8%	0.082	45%	0.446	C	S	.	.			trans	-68.5	137	172.3	0	0	0	0	0	110.6	G111 Y274 K275 T276	G111-G113 PolarHBondContact O-N 2.9Å; G113-Y274 CarbonylContact C-O 3.54Å; G113-Y274 VanDerWaalsContact CA-O 3.3Å; G113-Y274 WeakPolarHBondContact CA-O 3.36Å; G113-K275 WeakPolarHBondContact O-CA 3.42Å; G113-T276 PolarHBondContact N-OG1 2.84Å; G113-T276 PolarHBondContact O-N 3.5Å
114	N	64.2	Low	69.2	Low	133 Å²	133	83.9 Å²	83.9	71%	0.711	43%	0.433	S	S	*	.	B	Isolated β-bridge	trans	-132.7	71.3	175.6	-76.2	-21.4	0	0	0	110.1	A116 Y274	N114-A116 PolarHBondContact O-N 3.41Å; N114-Y274 PolarHBondContact N-O 3.17Å
115	K	75.4	Confident	72	Confident	47 Å²	47	81.5 Å²	81.5	20%	0.204	42%	0.416	C	S	.	.			trans	-60.6	125	172.3	-163	-176.9	-173.3	176.1	0	109.9	T117 M118 E256 E273 Y274	K115-T117 VanDerWaalsContact C-N 3.28Å; K115-T117 VanDerWaalsContact CD-OG1 3.24Å; K115-T117 WeakPolarHBondContact CD-OG1 3.39Å; K115-T117 WeakPolarHBondContact CE-OG1 3.38Å; K115-T117 WeakPolarHBondContact CG-OG1 3.49Å; K115-T117 PolarHBondContact O-N 3.18Å; K115-M118 HydrophobicContact CB-CE 3.57Å; K115-M118 HydrophobicContact CD-CE 3.75Å; K115-M118 HydrophobicContact CG-CE 4.26Å; K115-M118 PolarHBondContact O-N 3.47Å; K115-M118 VanDerWaalsContact O-N 3.14Å; K115-E256 WeakPolarHBondContact CE-OE2 3.37Å; K115-E256 IonicContact NZ-OE2 3.83Å; K115-E256 PolarHBondContact NZ-OE2 3.29Å; K115-E273 HydrophobicContact CD-CB 4.08Å; K115-E273 WeakPolarHBondContact CE-OE2 3.14Å; K115-E273 HydrophobicContact CG-CB 4.39Å; K115-E273 IonicContact NZ-OE2 3.11Å; K115-E273 PolarHBondContact NZ-OE2 3.1Å; K115-Y274 PolarHBondContact N-O 3.44Å; K115-Y274 VanDerWaalsContact N-O 3.14Å
116	A	73	Confident	74.8	Confident	64 Å²	64	75 Å²	75	53%	0.529	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-63.9	-31.3	-173.5	0	0	0	0	0	113.6	N114 M118 K119	N114-A116 PolarHBondContact O-N 3.41Å; A116-M118 PolarHBondContact O-N 3.08Å; A116-K119 HydrophobicContact CB-CD 4.5Å; A116-K119 WeakPolarHBondContact O-CB 3.24Å; A116-K119 WeakPolarHBondContact O-CD 3.2Å; A116-K119 WeakPolarHBondContact O-CG 3.44Å; A116-K119 PolarHBondContact O-N 2.73Å
117	T	78.1	Confident	77.4	Confident	92 Å²	92	69.1 Å²	69.1	56%	0.564	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-66.4	-26.8	177.6	54.4	0	0	0	0	112.8	K115 E256	K115-T117 VanDerWaalsContact C-N 3.28Å; K115-T117 VanDerWaalsContact CD-OG1 3.24Å; K115-T117 WeakPolarHBondContact CD-OG1 3.39Å; K115-T117 WeakPolarHBondContact CE-OG1 3.38Å; K115-T117 WeakPolarHBondContact CG-OG1 3.49Å; K115-T117 PolarHBondContact O-N 3.18Å; T117-E256 PolarHBondContact OG1-OE2 3.18Å
118	M	84.5	Confident	79.8	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-92.8	9.8	-179.2	-68.1	-166.6	-86.2	0	0	113.2	K115 A116 D120 I121 Y167 M254 E256 K275	K115-M118 HydrophobicContact CB-CE 3.57Å; K115-M118 HydrophobicContact CD-CE 3.75Å; K115-M118 HydrophobicContact CG-CE 4.26Å; K115-M118 PolarHBondContact O-N 3.47Å; K115-M118 VanDerWaalsContact O-N 3.14Å; A116-M118 PolarHBondContact O-N 3.08Å; M118-D120 VanDerWaalsContact C-N 3.26Å; M118-D120 PolarHBondContact O-N 3.26Å; M118-I121 HydrophobicContact CB-CD1 3.86Å; M118-I121 HydrophobicContact CB-CG1 4.37Å; M118-I121 HydrophobicContact CG-CD1 3.71Å; M118-I121 PolarHBondContact O-N 3.29Å; M118-I121 VanDerWaalsContact O-N 3.17Å; M118-I121 HydrophobicContact SD-CD1 4.17Å; M118-Y167 HydrophobicContact SD-CD1 4.48Å; M118-Y167 HydrophobicContact SD-CE1 4.21Å; M118-M254 WeakPolarHBondContact CE-O 3.33Å; M118-M254 HydrophobicContact SD-CG 3.84Å; M118-M254 HydrophobicContact SD-SD 3.86Å; M118-E256 HydrophobicContact CE-CG 4.3Å; M118-E256 HydrophobicContact CG-CG 4.06Å; M118-E256 WeakPolarHBondContact CG-OE1 3.33Å; M118-E256 HydrophobicContact SD-CG 3.81Å; M118-K275 HydrophobicContact CB-CB 4.13Å; M118-K275 HydrophobicContact CB-CD 3.95Å; M118-K275 HydrophobicContact CE-CB 4.06Å; M118-K275 WeakPolarHBondContact O-CD 3.4Å; M118-K275 WeakPolarHBondContact O-CE 3.34Å; M118-K275 PolarHBondContact O-NZ 3.29Å; M118-K275 HydrophobicContact SD-CB 4.17Å
119	K	81.5	Confident	82	Confident	147 Å²	147	68.7 Å²	68.7	64%	0.639	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-39	-174.6	-82.1	174.1	-179.3	-178.6	0	113.3	A116 I121 K275	A116-K119 HydrophobicContact CB-CD 4.5Å; A116-K119 WeakPolarHBondContact O-CB 3.24Å; A116-K119 WeakPolarHBondContact O-CD 3.2Å; A116-K119 WeakPolarHBondContact O-CG 3.44Å; A116-K119 PolarHBondContact O-N 2.73Å; K119-I121 PolarHBondContact O-N 3.12Å; K119-K275 PolarHBondContact O-NZ 2.93Å
120	D	88	Confident	83.8	Confident	138 Å²	138	66.1 Å²	66.1	74%	0.738	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.5	-175.4	-57.7	-36.6	0	0	0	113.9	M118 Q122	M118-D120 VanDerWaalsContact C-N 3.26Å; M118-D120 PolarHBondContact O-N 3.26Å; D120-Q122 PolarHBondContact O-N 3.18Å
121	I	94.1	Very high	85.4	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	36%	0.357	C	S	.	.			trans	-69.3	122.5	178.4	-57.3	-179.3	0	0	0	109.9	M118 K119 F158 S159 Y167 M254 K275 F277	M118-I121 HydrophobicContact CB-CD1 3.86Å; M118-I121 HydrophobicContact CB-CG1 4.37Å; M118-I121 HydrophobicContact CG-CD1 3.71Å; M118-I121 PolarHBondContact O-N 3.29Å; M118-I121 VanDerWaalsContact O-N 3.17Å; M118-I121 HydrophobicContact SD-CD1 4.17Å; K119-I121 PolarHBondContact O-N 3.12Å; I121-F158 HydrophobicContact CG2-CD1 4.47Å; I121-S159 CarbonylContact C-O 3.52Å; I121-S159 VanDerWaalsContact CA-O 3.3Å; I121-S159 WeakPolarHBondContact CA-O 3.44Å; I121-Y167 HydrophobicContact CD1-CE1 3.86Å; I121-M254 HydrophobicContact CD1-SD 3.66Å; I121-M254 HydrophobicContact CG2-CE 4.01Å; I121-M254 HydrophobicContact CG2-SD 3.88Å; I121-K275 PolarHBondContact O-NZ 3.32Å; I121-F277 HydrophobicContact CG2-CZ 4.12Å
122	Q	94.7	Very high	87.2	Confident	111 Å²	111	65.9 Å²	65.9	52%	0.519	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	153.2	173.7	-49	-176.5	-1.3	0	0	110.7	D120 H124 F158 S159	D120-Q122 PolarHBondContact O-N 3.18Å; Q122-H124 PolarHBondContact OE1-CE1 2.94Å; Q122-F158 CarbonylContact O-C 3.58Å; Q122-F158 VanDerWaalsContact O-CA 3.29Å; Q122-F158 WeakPolarHBondContact O-CA 3.26Å; Q122-S159 WeakPolarHBondContact CB-OG 3.4Å; Q122-S159 PolarHBondContact N-O 2.97Å; Q122-S159 PolarHBondContact O-N 3Å
123	C	97	Very high	88.9	Confident	15 Å²	15	68.6 Å²	68.6	10%	0.101	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127	174.8	-176.1	0	0	0	0	107.5	T157 F158 F277 F279	C123-T157 CarbonylContact C-O 3.49Å; C123-T157 WeakPolarHBondContact CA-O 3.31Å; C123-F158 HydrophobicContact CB-CD1 3.86Å; C123-F158 HydrophobicContact CB-CE1 3.77Å; C123-F158 WeakPolarHBondContact SG-CE1 3.48Å; C123-F277 HydrophobicContact CB-CB 3.99Å; C123-F277 HydrophobicContact CB-CD1 3.26Å; C123-F277 HydrophobicContact CB-CD2 3.94Å; C123-F277 HydrophobicContact CB-CE1 3.55Å; C123-F277 HydrophobicContact CB-CE2 4.19Å; C123-F277 HydrophobicContact CB-CG 3.45Å; C123-F277 VanDerWaalsContact CB-CG 3.45Å; C123-F277 HydrophobicContact CB-CZ 4Å; C123-F279 HydrophobicContact CB-CZ 4.2Å; C123-F279 WeakPolarHBondContact O-CZ 3.19Å
124	H	97.6	Very high	90.7	Very high	85 Å²	85	68.2 Å²	68.2	39%	0.394	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.9	179.6	-53.1	-76.9	0	0	0	109.8	Q122 V156 T157 S159	Q122-H124 PolarHBondContact OE1-CE1 2.94Å; H124-V156 CarbonylContact O-C 3.54Å; H124-V156 WeakPolarHBondContact O-CA 3.3Å; H124-V156 WeakPolarHBondContact O-CB 3.45Å; H124-T157 PolarHBondContact N-O 2.81Å; H124-T157 PolarHBondContact O-N 3.36Å; H124-S159 PolarHBondContact NE2-OG 3.44Å
125	L	98.4	Very high	92.3	Very high	15 Å²	15	65.4 Å²	65.4	8%	0.079	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	119.8	175.5	-180	67.6	0	0	0	109.6	R128 W131 V156 F279 E281 T282	L125-R128 HydrophobicContact CD2-CG 4.44Å; L125-W131 HydrophobicContact CD2-CB 4.26Å; L125-W131 HydrophobicContact CD2-CG 4.03Å; L125-V156 HydrophobicContact CD1-CG1 4.38Å; L125-F279 HydrophobicContact CB-CD1 3.75Å; L125-F279 HydrophobicContact CB-CD2 4.43Å; L125-F279 HydrophobicContact CB-CE1 3.78Å; L125-F279 HydrophobicContact CB-CE2 4.46Å; L125-F279 HydrophobicContact CB-CG 4.08Å; L125-F279 HydrophobicContact CB-CZ 4.14Å; L125-F279 HydrophobicContact CD2-CB 4.14Å; L125-F279 HydrophobicContact CD2-CD1 4.41Å; L125-F279 HydrophobicContact CD2-CG 4.26Å; L125-E281 HydrophobicContact CD2-CG 3.71Å; L125-T282 HydrophobicContact CD1-CG2 4.16Å; L125-T282 HydrophobicContact CD2-CG2 3.74Å
126	E	97.9	Very high	93.3	Very high	60 Å²	60	70.6 Å²	70.6	28%	0.28	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	147.9	176.6	-68.1	-62.8	145.3	0	0	111.6	R128 R155 T157 V221	E126-R128 PolarHBondContact O-N 2.88Å; E126-R155 HydrophobicContact CB-CB 3.74Å; E126-R155 WeakPolarHBondContact CB-O 3.27Å; E126-R155 HydrophobicContact CG-CB 4.32Å; E126-R155 PolarHBondContact N-O 2.69Å; E126-T157 HydrophobicContact CG-CG2 4.14Å; E126-T157 WeakPolarHBondContact OE1-CG2 3.36Å; E126-T157 PolarHBondContact OE1-OG1 2.79Å; E126-V221 HydrophobicContact CG-CG1 3.82Å; E126-V221 HydrophobicContact CG-CG2 4.24Å
127	A	94.9	Very high	94.4	Very high	47 Å²	47	70.3 Å²	70.3	39%	0.388	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	39.8	-176.7	0	0	0	0	0	113.1	E129 L130 W131	A127-E129 PolarHBondContact O-N 2.76Å; A127-L130 WeakPolarHBondContact O-CB 3.32Å; A127-L130 PolarHBondContact O-N 2.93Å; A127-W131 PolarHBondContact O-N 2.88Å
128	R	97.1	Very high	95.2	Very high	113 Å²	113	67.1 Å²	67.1	43%	0.426	33%	0.325	S	S	.	.	H	α-helix	trans	-53.8	-36.8	-177.6	-175.5	177.3	-174.7	-95.4	-13.2	113	L125 E126 L130 W131 L132 E281	L125-R128 HydrophobicContact CD2-CG 4.44Å; E126-R128 PolarHBondContact O-N 2.88Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.2Å; R128-W131 WeakPolarHBondContact O-CB 3.48Å; R128-W131 PolarHBondContact O-N 3.06Å; R128-W131 VanDerWaalsContact O-N 3.11Å; R128-L132 HydrophobicContact CG-CD1 4.27Å; R128-L132 HydrophobicContact CG-CG 4.43Å; R128-L132 WeakPolarHBondContact O-CG 3.27Å; R128-L132 PolarHBondContact O-N 3.14Å; R128-E281 IonicContact CZ-OE1 3.27Å; R128-E281 VanDerWaalsContact CZ-OE1 3.27Å; R128-E281 IonicContact NE-OE1 2.69Å; R128-E281 PolarHBondContact NE-OE1 3.3Å; R128-E281 IonicContact NH2-OE1 3.01Å; R128-E281 PolarHBondContact NH2-OE1 3.04Å
129	E	97.6	Very high	95.9	Very high	122 Å²	122	67.2 Å²	67.2	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-61.7	-36.2	179.6	-65.6	68.8	-154.6	0	0	111.6	A127 R133	A127-E129 PolarHBondContact O-N 2.76Å; E129-R133 WeakPolarHBondContact O-CG 3.44Å; E129-R133 PolarHBondContact O-N 3.14Å
130	L	97.4	Very high	96.7	Very high	40 Å²	40	60.2 Å²	60.2	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-42.2	175.2	-178.4	61.1	0	0	0	110.7	A127 R128 L132 R133 F134 F151 P152	A127-L130 WeakPolarHBondContact O-CB 3.32Å; A127-L130 PolarHBondContact O-N 2.93Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.2Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 2.94Å; L130-R133 PolarHBondContact O-N 3.17Å; L130-F134 HydrophobicContact CD1-CD2 4.14Å; L130-F134 HydrophobicContact CD1-CE2 3.82Å; L130-F134 HydrophobicContact CG-CD2 4.19Å; L130-F134 HydrophobicContact CG-CE2 4.1Å; L130-F134 WeakPolarHBondContact O-CD2 3.46Å; L130-F134 PolarHBondContact O-N 3.21Å; L130-F151 HydrophobicContact CD2-CZ 4.38Å; L130-P152 HydrophobicContact CD2-CB 4.05Å; L130-P152 HydrophobicContact CD2-CG 3.85Å; L130-P152 HydrophobicContact CG-CB 4.45Å; L130-P152 HydrophobicContact CG-CG 3.82Å
131	W	98.4	Very high	97.2	Very high	1 Å²	1	53.8 Å²	53.8	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-44.7	174.4	-80.4	104.4	0	0	0	112	L125 A127 R128 R133 F134 H135 M141 M150 P152 I154 E281 T282	L125-W131 HydrophobicContact CD2-CB 4.26Å; L125-W131 HydrophobicContact CD2-CG 4.03Å; A127-W131 PolarHBondContact O-N 2.88Å; R128-W131 WeakPolarHBondContact O-CB 3.48Å; R128-W131 PolarHBondContact O-N 3.06Å; R128-W131 VanDerWaalsContact O-N 3.11Å; W131-R133 PolarHBondContact O-N 3.42Å; W131-F134 PolarHBondContact O-N 2.86Å; W131-F134 VanDerWaalsContact O-N 3.17Å; W131-H135 WeakPolarHBondContact O-CB 3.42Å; W131-H135 PolarHBondContact O-N 3.38Å; W131-M141 HydrophobicContact CH2-CE 3.67Å; W131-M141 HydrophobicContact CZ3-CE 3.78Å; W131-M150 HydrophobicContact CH2-CE 4.49Å; W131-P152 HydrophobicContact CD2-CB 4.24Å; W131-P152 HydrophobicContact CD2-CG 4.25Å; W131-P152 HydrophobicContact CH2-CB 4.5Å; W131-P152 WeakPolarHBondContact CH2-O 3.45Å; W131-P152 HydrophobicContact CZ2-CB 3.9Å; W131-P152 WeakPolarHBondContact CZ2-O 3.4Å; W131-I154 HydrophobicContact CH2-CG1 3.92Å; W131-I154 HydrophobicContact CZ2-CB 4.5Å; W131-I154 HydrophobicContact CZ2-CG1 3.57Å; W131-E281 HydrophobicContact CB-CG 4.27Å; W131-T282 HydrophobicContact CD2-CG2 3.97Å; W131-T282 HydrophobicContact CE3-CG2 4.01Å; W131-T282 HydrophobicContact CG-CG2 4.47Å; W131-T282 HydrophobicContact CH2-CG2 4.44Å; W131-T282 HydrophobicContact CZ2-CG2 4.4Å; W131-T282 HydrophobicContact CZ3-CG2 4.25Å
132	L	98.2	Very high	97.4	Very high	50 Å²	50	54 Å²	54	26%	0.262	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-43.5	177.4	-71.2	170.4	0	0	0	112.4	R128 L130 F134 H135 E136 E281	R128-L132 HydrophobicContact CG-CD1 4.27Å; R128-L132 HydrophobicContact CG-CG 4.43Å; R128-L132 WeakPolarHBondContact O-CG 3.27Å; R128-L132 PolarHBondContact O-N 3.14Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 2.94Å; L132-F134 VanDerWaalsContact C-N 3.3Å; L132-F134 PolarHBondContact O-N 3.18Å; L132-H135 WeakPolarHBondContact O-CB 3.19Å; L132-H135 PolarHBondContact O-N 3.14Å; L132-H135 VanDerWaalsContact O-N 3.1Å; L132-E136 WeakPolarHBondContact O-CG 3.2Å; L132-E136 PolarHBondContact O-N 3.34Å; L132-E281 HydrophobicContact CD2-CB 3.89Å
133	R	98	Very high	97.5	Very high	147 Å²	147	48.8 Å²	48.8	56%	0.555	24%	0.238	S	C	*	.	H	α-helix	trans	-60	-39	175.5	-68.2	179.5	-157.2	177.2	5.5	112.8	E129 L130 W131 L298	E129-R133 WeakPolarHBondContact O-CG 3.44Å; E129-R133 PolarHBondContact O-N 3.14Å; L130-R133 PolarHBondContact O-N 3.17Å; W131-R133 PolarHBondContact O-N 3.42Å; R133-L298 HydrophobicContact CB-CD2 4Å
134	F	98	Very high	97.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-41.8	173.8	-85.7	-73.3	0	0	0	111.6	L130 W131 L132 L137 G138 T139 F151 P152 I295 L298 K299	L130-F134 HydrophobicContact CD1-CD2 4.14Å; L130-F134 HydrophobicContact CD1-CE2 3.82Å; L130-F134 HydrophobicContact CG-CD2 4.19Å; L130-F134 HydrophobicContact CG-CE2 4.1Å; L130-F134 WeakPolarHBondContact O-CD2 3.46Å; L130-F134 PolarHBondContact O-N 3.21Å; W131-F134 PolarHBondContact O-N 2.86Å; W131-F134 VanDerWaalsContact O-N 3.17Å; L132-F134 VanDerWaalsContact C-N 3.3Å; L132-F134 PolarHBondContact O-N 3.18Å; F134-L137 PolarHBondContact O-N 3.31Å; F134-G138 CarbonylContact O-C 3.52Å; F134-G138 PolarHBondContact O-N 3.47Å; F134-T139 HydrophobicContact CB-CG2 4.12Å; F134-T139 PolarHBondContact O-N 3.12Å; F134-T139 VanDerWaalsContact O-N 3.09Å; F134-T139 PolarHBondContact O-OG1 2.68Å; F134-F151 HydrophobicContact CE2-CD1 4.36Å; F134-F151 AromaticContact CE2-CE1 3.87Å; F134-F151 HydrophobicContact CE2-CE1 3.87Å; F134-F151 HydrophobicContact CZ-CD1 4.13Å; F134-F151 AromaticContact CZ-CE1 3.82Å; F134-F151 HydrophobicContact CZ-CE1 3.82Å; F134-P152 HydrophobicContact CD2-CG 3.44Å; F134-P152 VanDerWaalsContact CD2-CG 3.44Å; F134-P152 HydrophobicContact CE2-CG 3.57Å; F134-P152 HydrophobicContact CG-CG 4.41Å; F134-I295 HydrophobicContact CD1-CD1 3.96Å; F134-I295 HydrophobicContact CD1-CG2 4.47Å; F134-I295 HydrophobicContact CE1-CG2 4.3Å; F134-L298 HydrophobicContact CB-CD2 4.49Å; F134-L298 HydrophobicContact CD1-CD2 3.71Å; F134-L298 HydrophobicContact CD1-CG 4.29Å; F134-L298 HydrophobicContact CD2-CD2 3.88Å; F134-L298 HydrophobicContact CD2-CG 4.38Å; F134-L298 HydrophobicContact CE1-CB 4.02Å; F134-L298 HydrophobicContact CE1-CD2 3.72Å; F134-L298 HydrophobicContact CE1-CG 3.77Å; F134-L298 HydrophobicContact CE2-CD2 3.92Å; F134-L298 HydrophobicContact CE2-CG 3.89Å; F134-L298 HydrophobicContact CG-CD2 3.78Å; F134-L298 HydrophobicContact CZ-CB 4.13Å; F134-L298 HydrophobicContact CZ-CD2 3.83Å; F134-L298 HydrophobicContact CZ-CG 3.56Å; F134-K299 HydrophobicContact CE1-CD 3.56Å; F134-K299 VanDerWaalsContact CE1-CE 3.48Å; F134-K299 HydrophobicContact CE1-CG 3.83Å; F134-K299 HydrophobicContact CZ-CD 3.7Å; F134-K299 HydrophobicContact CZ-CG 4.13Å
135	H	97.7	Very high	97.4	Very high	74 Å²	74	53.2 Å²	53.2	34%	0.343	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-43.4	-178.5	-171.9	75.5	0	0	0	112.2	W131 L132 L137 G138 T139 P280 E281	W131-H135 WeakPolarHBondContact O-CB 3.42Å; W131-H135 PolarHBondContact O-N 3.38Å; L132-H135 WeakPolarHBondContact O-CB 3.19Å; L132-H135 PolarHBondContact O-N 3.14Å; L132-H135 VanDerWaalsContact O-N 3.1Å; H135-L137 PolarHBondContact O-N 3.27Å; H135-G138 PolarHBondContact O-N 3.3Å; H135-T139 WeakPolarHBondContact CA-OG1 3.49Å; H135-T139 PolarHBondContact N-OG1 3.1Å; H135-P280 PolarHBondContact CE1-O 2.85Å; H135-E281 HydrophobicContact CB-CB 4.46Å
136	E	97.1	Very high	97.3	Very high	157 Å²	157	56.5 Å²	56.5	73%	0.734	28%	0.281	S	S	*	.	H	α-helix	trans	-56.2	-34.8	176.3	-75.6	170.1	-170.9	0	0	113	L132	L132-E136 WeakPolarHBondContact O-CG 3.2Å; L132-E136 PolarHBondContact O-N 3.34Å
137	L	95.4	Very high	97.1	Very high	57 Å²	57	54 Å²	54	30%	0.298	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.9	178.8	-64.3	177.5	0	0	0	113.5	F134 H135 N292 L294 I295 L298	F134-L137 PolarHBondContact O-N 3.31Å; H135-L137 PolarHBondContact O-N 3.27Å; L137-N292 PolarHBondContact O-ND2 2.58Å; L137-N292 VanDerWaalsContact O-ND2 3.16Å; L137-L294 HydrophobicContact CD1-CB 3.99Å; L137-L294 HydrophobicContact CD2-CB 4.17Å; L137-L294 HydrophobicContact CD2-CD1 3.98Å; L137-I295 HydrophobicContact CB-CD1 3.47Å; L137-I295 VanDerWaalsContact CB-CD1 3.47Å; L137-I295 HydrophobicContact CB-CG1 4.14Å; L137-I295 HydrophobicContact CD1-CD1 4.28Å; L137-L298 HydrophobicContact CD1-CD2 4.06Å
138	G	96.3	Very high	97.2	Very high	25 Å²	25	53.8 Å²	53.8	26%	0.258	26%	0.261	S	S	.	.			trans	77.1	86.2	-169.3	0	0	0	0	0	111.6	F134 H135 E140	F134-G138 CarbonylContact O-C 3.52Å; F134-G138 PolarHBondContact O-N 3.47Å; H135-G138 PolarHBondContact O-N 3.3Å; G138-E140 PolarHBondContact O-N 2.86Å
139	T	98.3	Very high	97.2	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.018	26%	0.261	C	S	.	.			trans	-49.3	133.7	-177.1	-49.3	0	0	0	0	112.7	F134 H135 M141 Q283 F284 T285	F134-T139 HydrophobicContact CB-CG2 4.12Å; F134-T139 PolarHBondContact O-N 3.12Å; F134-T139 VanDerWaalsContact O-N 3.09Å; F134-T139 PolarHBondContact O-OG1 2.68Å; H135-T139 WeakPolarHBondContact CA-OG1 3.49Å; H135-T139 PolarHBondContact N-OG1 3.1Å; T139-M141 HydrophobicContact CG2-CE 3.9Å; T139-Q283 VanDerWaalsContact CB-O 3.3Å; T139-Q283 WeakPolarHBondContact CB-O 3.2Å; T139-Q283 PolarHBondContact OG1-O 3.12Å; T139-F284 HydrophobicContact CG2-CB 3.77Å; T139-F284 CarbonylContact O-C 3.6Å; T139-F284 VanDerWaalsContact O-CA 3.27Å; T139-F284 WeakPolarHBondContact O-CA 3.4Å; T139-T285 PolarHBondContact O-N 3.2Å
140	E	98.6	Very high	97.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.1	173.8	-56.7	179	-161.1	0	0	110.7	G138 W190 T285 V287 Y290 Q291 N292 I295 K299	G138-E140 PolarHBondContact O-N 2.86Å; E140-W190 HydrophobicContact CG-CZ2 4.01Å; E140-T285 WeakPolarHBondContact CA-O 3.37Å; E140-V287 HydrophobicContact CB-CG2 3.95Å; E140-Y290 HydrophobicContact CB-CD1 3.96Å; E140-Y290 HydrophobicContact CB-CE1 4.28Å; E140-Y290 VanDerWaalsContact OE2-CA 3.23Å; E140-Y290 WeakPolarHBondContact OE2-CA 3.43Å; E140-Q291 PolarHBondContact OE2-N 3.27Å; E140-N292 VanDerWaalsContact OE1-CB 3.26Å; E140-N292 WeakPolarHBondContact OE1-CB 3.03Å; E140-N292 PolarHBondContact OE1-N 3.25Å; E140-I295 HydrophobicContact CB-CG2 4.12Å; E140-I295 HydrophobicContact CG-CG1 4.35Å; E140-I295 HydrophobicContact CG-CG2 4.41Å; E140-K299 WeakPolarHBondContact O-CE 3.26Å; E140-K299 PolarHBondContact O-NZ 3.23Å
141	M	98.5	Very high	97.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.8	175.3	-64.9	-68.8	-179.9	0	0	110.3	W131 T139 M150 F151 L229 F284 T285 V287	W131-M141 HydrophobicContact CH2-CE 3.67Å; W131-M141 HydrophobicContact CZ3-CE 3.78Å; T139-M141 HydrophobicContact CG2-CE 3.9Å; M141-M150 HydrophobicContact CE-CB 4.4Å; M141-M150 HydrophobicContact CE-CE 3.79Å; M141-M150 HydrophobicContact CG-CE 4.2Å; M141-M150 HydrophobicContact SD-CB 4.15Å; M141-M150 HydrophobicContact SD-CE 4.25Å; M141-M150 HydrophobicContact SD-CG 4.44Å; M141-F151 VanDerWaalsContact CE-O 3.26Å; M141-F151 WeakPolarHBondContact CE-O 3.3Å; M141-F151 VanDerWaalsContact SD-O 3.33Å; M141-L229 HydrophobicContact CB-CD1 3.85Å; M141-L229 HydrophobicContact CG-CD1 4.42Å; M141-F284 HydrophobicContact CB-CD2 3.46Å; M141-F284 VanDerWaalsContact CB-CD2 3.46Å; M141-F284 HydrophobicContact CB-CE2 3.73Å; M141-F284 HydrophobicContact CB-CG 4.11Å; M141-F284 HydrophobicContact CG-CB 3.79Å; M141-F284 HydrophobicContact CG-CD1 4.07Å; M141-F284 HydrophobicContact CG-CD2 3.37Å; M141-F284 HydrophobicContact CG-CE2 3.9Å; M141-F284 HydrophobicContact CG-CG 3.46Å; M141-F284 VanDerWaalsContact CG-CG 3.46Å; M141-F284 HydrophobicContact CG-CZ 4.44Å; M141-T285 PolarHBondContact N-O 2.9Å; M141-V287 PolarHBondContact O-N 2.86Å
142	I	97.8	Very high	97.2	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.051	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	132.6	177.2	-64.5	-74.7	0	0	0	109.6	T144 R148 V287 Y290	I142-T144 HydrophobicContact CG2-CG2 3.86Å; I142-R148 HydrophobicContact CB-CG 4.05Å; I142-R148 HydrophobicContact CG2-CB 4.49Å; I142-R148 HydrophobicContact CG2-CG 3.96Å; I142-R148 WeakPolarHBondContact O-CB 3.34Å; I142-R148 WeakPolarHBondContact O-CG 3.33Å; I142-V287 CarbonylContact C-O 3.55Å; I142-V287 VanDerWaalsContact CA-O 3.22Å; I142-V287 WeakPolarHBondContact CA-O 3.46Å; I142-V287 HydrophobicContact CD1-CG2 4.04Å; I142-Y290 HydrophobicContact CD1-CD1 4.07Å; I142-Y290 HydrophobicContact CD1-CD2 4.27Å; I142-Y290 HydrophobicContact CD1-CE1 4.04Å; I142-Y290 HydrophobicContact CD1-CE2 4.25Å; I142-Y290 HydrophobicContact CD1-CG 4.18Å; I142-Y290 HydrophobicContact CG1-CD1 4.22Å; I142-Y290 HydrophobicContact CG1-CD2 4.48Å; I142-Y290 HydrophobicContact CG1-CE1 3.66Å; I142-Y290 HydrophobicContact CG1-CE2 3.96Å
143	I	97.4	Very high	97.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	23%	0.233	C	C	.	.			trans	-113.7	140.7	168.7	64.5	-176.9	0	0	0	109.4	L229 N231 L242 A286 V287 T288	I143-L229 HydrophobicContact CG2-CB 3.8Å; I143-L229 HydrophobicContact CG2-CD1 4.45Å; I143-N231 HydrophobicContact CD1-CB 3.67Å; I143-N231 HydrophobicContact CG1-CB 3.98Å; I143-L242 HydrophobicContact CG2-CD1 4.45Å; I143-A286 HydrophobicContact CD1-CB 4.19Å; I143-A286 HydrophobicContact CG2-CB 4.03Å; I143-V287 PolarHBondContact N-O 2.83Å; I143-T288 HydrophobicContact CG1-CG2 4.26Å
144	T	96.6	Very high	97.1	Very high	33 Å²	33	41 Å²	41	20%	0.202	21%	0.208	C	C	.	.			trans	-138.6	159.6	179.9	64.7	0	0	0	0	110.8	I142 S146 G147 R148 T230 N231	I142-T144 HydrophobicContact CG2-CG2 3.86Å; T144-S146 PolarHBondContact O-N 3.09Å; T144-S146 PolarHBondContact OG1-OG 3.03Å; T144-G147 PolarHBondContact O-N 2.93Å; T144-G147 VanDerWaalsContact OG1-C 3.31Å; T144-G147 PolarHBondContact OG1-N 3.12Å; T144-G147 PolarHBondContact OG1-O 3.12Å; T144-R148 HydrophobicContact CG2-CB 4.19Å; T144-T230 VanDerWaalsContact O-CA 3.27Å; T144-T230 WeakPolarHBondContact O-CA 3.49Å; T144-T230 WeakPolarHBondContact O-CB 3.49Å; T144-T230 PolarHBondContact O-OG1 2.94Å; T144-N231 VanDerWaalsContact C-OD1 3.23Å
145	K	96	Very high	97.2	Very high	160 Å²	160	46 Å²	46	70%	0.696	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-38.9	177.4	-174.3	178	179.9	178.3	0	113.2	G147 T230 N231 N232	K145-G147 VanDerWaalsContact C-N 3.35Å; K145-T230 PolarHBondContact O-OG1 3.31Å; K145-N231 PolarHBondContact N-OD1 3.4Å; K145-N232 HydrophobicContact CG-CB 4.28Å
146	S	95.3	Very high	97.2	Very high	84 Å²	84	42.5 Å²	42.5	59%	0.587	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.4	-178	64.6	0	0	0	0	114.6	T144 H239	T144-S146 PolarHBondContact O-N 3.09Å; T144-S146 PolarHBondContact OG1-OG 3.03Å; S146-H239 PolarHBondContact O-CE1 2.81Å; S146-H239 VanDerWaalsContact O-CE1 3.3Å
147	G	95.6	Very high	97.2	Very high	8 Å²	8	36.4 Å²	36.4	8%	0.082	18%	0.184	C	C	.	.			trans	84.5	133.8	-169.5	0	0	0	0	0	113.3	T144 K145 L229	T144-G147 PolarHBondContact O-N 2.93Å; T144-G147 VanDerWaalsContact OG1-C 3.31Å; T144-G147 PolarHBondContact OG1-N 3.12Å; T144-G147 PolarHBondContact OG1-O 3.12Å; K145-G147 VanDerWaalsContact C-N 3.35Å; G147-L229 CarbonylContact C-O 3.52Å; G147-L229 VanDerWaalsContact CA-O 3.31Å; G147-L229 WeakPolarHBondContact CA-O 3.36Å
148	R	96.1	Very high	97.3	Very high	41 Å²	41	34 Å²	34	16%	0.155	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.1	178.6	-172.9	66.3	168.7	-164.4	-7.9	110.9	I142 T144 K228 L229	I142-R148 HydrophobicContact CB-CG 4.05Å; I142-R148 HydrophobicContact CG2-CB 4.49Å; I142-R148 HydrophobicContact CG2-CG 3.96Å; I142-R148 WeakPolarHBondContact O-CB 3.34Å; I142-R148 WeakPolarHBondContact O-CG 3.33Å; T144-R148 HydrophobicContact CG2-CB 4.19Å; R148-K228 CarbonylContact O-C 3.53Å; R148-K228 VanDerWaalsContact O-CA 3.31Å; R148-K228 WeakPolarHBondContact O-CA 3.31Å; R148-L229 PolarHBondContact N-O 2.82Å; R148-L229 PolarHBondContact O-N 2.84Å
149	R	97	Very high	97.3	Very high	115 Å²	115	34.9 Å²	34.9	43%	0.434	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	143.9	174.8	-68	-175.4	-178.3	-173.5	-1.7	110.9	E225 K228	R149-E225 WeakPolarHBondContact CD-O 3.38Å; R149-E225 IonicContact CZ-OE1 3.85Å; R149-E225 IonicContact NH1-OE1 2.97Å; R149-E225 PolarHBondContact NH1-OE1 2.91Å; R149-K228 HydrophobicContact CG-CG 4.18Å
150	M	97.7	Very high	97	Very high	14 Å²	14	37.5 Å²	37.5	7%	0.069	20%	0.2	C	C	.	.			trans	-67.6	149.5	172.3	-64.6	-175.4	75.8	0	0	110.8	W131 M141 I154 I173 L227 L229 P250 F284	W131-M150 HydrophobicContact CH2-CE 4.49Å; M141-M150 HydrophobicContact CE-CB 4.4Å; M141-M150 HydrophobicContact CE-CE 3.79Å; M141-M150 HydrophobicContact CG-CE 4.2Å; M141-M150 HydrophobicContact SD-CB 4.15Å; M141-M150 HydrophobicContact SD-CE 4.25Å; M141-M150 HydrophobicContact SD-CG 4.44Å; M150-I154 HydrophobicContact CE-CD1 4.04Å; M150-I154 HydrophobicContact SD-CD1 4.13Å; M150-I173 HydrophobicContact SD-CD1 4.38Å; M150-L227 HydrophobicContact CG-CD2 3.99Å; M150-L227 HydrophobicContact SD-CD2 3.71Å; M150-L229 HydrophobicContact CG-CD1 3.73Å; M150-L229 HydrophobicContact CG-CD2 4.28Å; M150-L229 HydrophobicContact CG-CG 3.9Å; M150-L229 HydrophobicContact SD-CD1 4.32Å; M150-L229 HydrophobicContact SD-CD2 4.31Å; M150-P250 HydrophobicContact CE-CG 4.36Å; M150-F284 HydrophobicContact CE-CD1 4.03Å; M150-F284 HydrophobicContact CE-CE1 3.72Å; M150-F284 HydrophobicContact CE-CZ 4.31Å
151	F	97.1	Very high	96.8	Very high	30 Å²	30	38 Å²	38	13%	0.132	20%	0.204	C	C	.	.	S	Bend	trans	-146.6	127.7	166.3	-177.9	-86	0	0	0	109.3	L130 F134 M141 K299 S302 N303	L130-F151 HydrophobicContact CD2-CZ 4.38Å; F134-F151 HydrophobicContact CE2-CD1 4.36Å; F134-F151 AromaticContact CE2-CE1 3.87Å; F134-F151 HydrophobicContact CE2-CE1 3.87Å; F134-F151 HydrophobicContact CZ-CD1 4.13Å; F134-F151 AromaticContact CZ-CE1 3.82Å; F134-F151 HydrophobicContact CZ-CE1 3.82Å; M141-F151 VanDerWaalsContact CE-O 3.26Å; M141-F151 WeakPolarHBondContact CE-O 3.3Å; M141-F151 VanDerWaalsContact SD-O 3.33Å; F151-K299 HydrophobicContact CD1-CD 3.69Å; F151-K299 HydrophobicContact CE1-CD 4.39Å; F151-K299 PolarHBondContact O-NZ 2.9Å; F151-S302 WeakPolarHBondContact CE1-OG 3.21Å; F151-S302 WeakPolarHBondContact CZ-OG 3.2Å; F151-N303 HydrophobicContact CD1-CB 4.08Å; F151-N303 HydrophobicContact CD2-CB 3.91Å; F151-N303 HydrophobicContact CE1-CB 3.8Å; F151-N303 HydrophobicContact CE2-CB 3.61Å; F151-N303 HydrophobicContact CG-CB 4.14Å; F151-N303 HydrophobicContact CZ-CB 3.56Å
152	P	97.6	Very high	96.4	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.039	22%	0.22	C	C	.	.	S	Bend	cis	-59.1	153.4	-4.3	-20.4	33.1	0	0	0	112.1	L130 W131 F134	L130-P152 HydrophobicContact CD2-CB 4.05Å; L130-P152 HydrophobicContact CD2-CG 3.85Å; L130-P152 HydrophobicContact CG-CB 4.45Å; L130-P152 HydrophobicContact CG-CG 3.82Å; W131-P152 HydrophobicContact CD2-CB 4.24Å; W131-P152 HydrophobicContact CD2-CG 4.25Å; W131-P152 HydrophobicContact CH2-CB 4.5Å; W131-P152 WeakPolarHBondContact CH2-O 3.45Å; W131-P152 HydrophobicContact CZ2-CB 3.9Å; W131-P152 WeakPolarHBondContact CZ2-O 3.4Å; F134-P152 HydrophobicContact CD2-CG 3.44Å; F134-P152 VanDerWaalsContact CD2-CG 3.44Å; F134-P152 HydrophobicContact CE2-CG 3.57Å; F134-P152 HydrophobicContact CG-CG 4.41Å
153	T	97.6	Very high	96.1	Very high	36 Å²	36	44.2 Å²	44.2	22%	0.221	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-73.6	137.8	174.3	-56	0	0	0	0	108.9	R155 E225	T153-R155 HydrophobicContact CG2-CG 4.28Å; T153-R155 PolarHBondContact O-N 2.82Å; T153-E225 HydrophobicContact CG2-CB 4.12Å
154	I	98.3	Very high	95.7	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-72.5	118.8	172.9	-62.4	172.5	0	0	0	108	W131 M150 V156 L171 F224 P250 I252	W131-I154 HydrophobicContact CH2-CG1 3.92Å; W131-I154 HydrophobicContact CZ2-CB 4.5Å; W131-I154 HydrophobicContact CZ2-CG1 3.57Å; M150-I154 HydrophobicContact CE-CD1 4.04Å; M150-I154 HydrophobicContact SD-CD1 4.13Å; I154-V156 HydrophobicContact CG2-CG1 4.47Å; I154-L171 HydrophobicContact CB-CD1 4.35Å; I154-L171 HydrophobicContact CD1-CD1 3.67Å; I154-L171 HydrophobicContact CG2-CD1 4.12Å; I154-F224 HydrophobicContact CB-CB 4.44Å; I154-F224 HydrophobicContact CB-CD2 4.27Å; I154-F224 HydrophobicContact CG2-CD2 3.94Å; I154-F224 HydrophobicContact CG2-CE2 4.48Å; I154-F224 PolarHBondContact O-N 2.8Å; I154-P250 HydrophobicContact CD1-CB 3.57Å; I154-P250 HydrophobicContact CD1-CG 3.83Å; I154-I252 HydrophobicContact CG2-CD1 3.91Å
155	R	98.2	Very high	95.4	Very high	104 Å²	104	53 Å²	53	39%	0.392	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.6	-178.6	-70.2	176.7	66.9	-153.1	-1.1	108	E126 T153 V221 V222	E126-R155 HydrophobicContact CB-CB 3.74Å; E126-R155 WeakPolarHBondContact CB-O 3.27Å; E126-R155 HydrophobicContact CG-CB 4.32Å; E126-R155 PolarHBondContact N-O 2.69Å; T153-R155 HydrophobicContact CG2-CG 4.28Å; T153-R155 PolarHBondContact O-N 2.82Å; R155-V221 HydrophobicContact CB-CG1 3.92Å; R155-V222 CarbonylContact C-O 2.85Å; R155-V222 WeakPolarHBondContact CA-O 3.36Å
156	V	98.3	Very high	95.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.8	-176.7	-64.4	0	0	0	0	112.6	H124 L125 I154 F158 V222 F224 I252 F279	H124-V156 CarbonylContact O-C 3.54Å; H124-V156 WeakPolarHBondContact O-CA 3.3Å; H124-V156 WeakPolarHBondContact O-CB 3.45Å; L125-V156 HydrophobicContact CD1-CG1 4.38Å; I154-V156 HydrophobicContact CG2-CG1 4.47Å; V156-F158 HydrophobicContact CG2-CD2 4.49Å; V156-F158 HydrophobicContact CG2-CE2 3.66Å; V156-F158 HydrophobicContact CG2-CZ 3.85Å; V156-V222 HydrophobicContact CG2-CB 4.11Å; V156-V222 PolarHBondContact N-O 2.89Å; V156-V222 PolarHBondContact O-N 3.3Å; V156-F224 HydrophobicContact CG2-CE2 4.39Å; V156-I252 HydrophobicContact CB-CD1 4.31Å; V156-I252 HydrophobicContact CG1-CD1 3.38Å; V156-I252 HydrophobicContact CG2-CD1 4Å; V156-F279 HydrophobicContact CG1-CE2 4.04Å
157	T	97.9	Very high	95.1	Very high	30 Å²	30	47 Å²	47	18%	0.184	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.5	169.2	43.3	0	0	0	0	109.5	C123 H124 E126 V221	C123-T157 CarbonylContact C-O 3.49Å; C123-T157 WeakPolarHBondContact CA-O 3.31Å; H124-T157 PolarHBondContact N-O 2.81Å; H124-T157 PolarHBondContact O-N 3.36Å; E126-T157 HydrophobicContact CG-CG2 4.14Å; E126-T157 WeakPolarHBondContact OE1-CG2 3.36Å; E126-T157 PolarHBondContact OE1-OG1 2.79Å; T157-V221 HydrophobicContact CG2-CB 4.27Å; T157-V221 HydrophobicContact CG2-CG2 3.68Å
158	F	97.3	Very high	95	Very high	7 Å²	7	47 Å²	47	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	145.7	178.4	-64.2	-86.4	0	0	0	110.3	I121 Q122 C123 V156 I169 L217 V222 I252 M254 F277	I121-F158 HydrophobicContact CG2-CD1 4.47Å; Q122-F158 CarbonylContact O-C 3.58Å; Q122-F158 VanDerWaalsContact O-CA 3.29Å; Q122-F158 WeakPolarHBondContact O-CA 3.26Å; C123-F158 HydrophobicContact CB-CD1 3.86Å; C123-F158 HydrophobicContact CB-CE1 3.77Å; C123-F158 WeakPolarHBondContact SG-CE1 3.48Å; V156-F158 HydrophobicContact CG2-CD2 4.49Å; V156-F158 HydrophobicContact CG2-CE2 3.66Å; V156-F158 HydrophobicContact CG2-CZ 3.85Å; F158-I169 HydrophobicContact CE1-CD1 4.49Å; F158-I169 HydrophobicContact CE2-CD1 4.23Å; F158-I169 HydrophobicContact CE2-CG1 4.44Å; F158-I169 HydrophobicContact CE2-CG2 4.44Å; F158-I169 HydrophobicContact CZ-CD1 3.97Å; F158-I169 HydrophobicContact CZ-CG2 4.21Å; F158-L217 HydrophobicContact CB-CB 4.31Å; F158-L217 HydrophobicContact CD2-CD2 3.95Å; F158-L217 HydrophobicContact CE2-CD2 4.28Å; F158-V222 HydrophobicContact CD2-CG2 4.18Å; F158-V222 HydrophobicContact CE2-CB 4.27Å; F158-V222 HydrophobicContact CE2-CG2 3.96Å; F158-I252 HydrophobicContact CZ-CG2 4.15Å; F158-M254 HydrophobicContact CB-CE 4.47Å; F158-M254 HydrophobicContact CD1-CE 3.39Å; F158-M254 HydrophobicContact CD2-CE 4.49Å; F158-M254 HydrophobicContact CE1-CE 3.58Å; F158-M254 HydrophobicContact CG-CE 3.88Å; F158-M254 HydrophobicContact CZ-CE 4.22Å; F158-F277 HydrophobicContact CD1-CE2 4.35Å; F158-F277 HydrophobicContact CD1-CZ 4.46Å; F158-F277 HydrophobicContact CE1-CD2 4.08Å; F158-F277 AromaticContact CE1-CE2 3.76Å; F158-F277 HydrophobicContact CE1-CE2 3.76Å; F158-F277 HydrophobicContact CE1-CZ 4.29Å
159	S	95.2	Very high	95	Very high	43 Å²	43	45 Å²	45	30%	0.301	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.5	174.2	64	0	0	0	0	110.2	I121 Q122 H124 C161	I121-S159 CarbonylContact C-O 3.52Å; I121-S159 VanDerWaalsContact CA-O 3.3Å; I121-S159 WeakPolarHBondContact CA-O 3.44Å; Q122-S159 WeakPolarHBondContact CB-OG 3.4Å; Q122-S159 PolarHBondContact N-O 2.97Å; Q122-S159 PolarHBondContact O-N 3Å; H124-S159 PolarHBondContact NE2-OG 3.44Å; S159-C161 VanDerWaalsContact C-N 3.34Å; S159-C161 PolarHBondContact O-N 3Å
160	G	93.5	Very high	94.9	Very high	57 Å²	57	39.6 Å²	39.6	59%	0.588	22%	0.215	S	C	*	.	S	Bend	trans	77.1	12.5	-177.6	0	0	0	0	0	115.4
161	C	93	Very high	94.9	Very high	11 Å²	11	39 Å²	39	7%	0.074	21%	0.212	C	C	.	.			trans	-69.9	142.8	175.1	-63.2	0	0	0	0	110.9	S159 P163 Y167	S159-C161 VanDerWaalsContact C-N 3.34Å; S159-C161 PolarHBondContact O-N 3Å; C161-P163 WeakPolarHBondContact O-CD 3.37Å; C161-Y167 HydrophobicContact CB-CE2 4.05Å
162	N	91.5	Very high	94.8	Very high	63 Å²	63	37.5 Å²	37.5	34%	0.337	21%	0.206	S	C	.	.			trans	-74.4	120.6	173.4	-178.7	-23	0	0	0	109.4	E164 I165 Y167 G214	N162-E164 PolarHBondContact O-N 3.29Å; N162-E164 VanDerWaalsContact O-N 3.17Å; N162-E164 PolarHBondContact OD1-N 3.35Å; N162-I165 HydrophobicContact CB-CB 4.27Å; N162-I165 HydrophobicContact CB-CD1 3.88Å; N162-I165 HydrophobicContact CB-CG1 4.02Å; N162-I165 PolarHBondContact O-N 3.39Å; N162-Y167 WeakPolarHBondContact CB-OH 3.45Å; N162-Y167 PolarHBondContact N-OH 3.15Å; N162-G214 WeakPolarHBondContact O-CA 3.32Å
163	P	91.8	Very high	94.8	Very high	80 Å²	80	37.6 Å²	37.6	52%	0.519	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.2	-176.5	25.2	-34.9	0	0	0	114.4	C161 D215	C161-P163 WeakPolarHBondContact O-CD 3.37Å; P163-D215 HydrophobicContact CB-CB 4.06Å
164	E	87.7	Confident	94.7	Very high	176 Å²	176	37 Å²	37	82%	0.822	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-15.8	-177.6	-59.2	-177.1	167.6	0	0	113.2	N162	N162-E164 PolarHBondContact O-N 3.29Å; N162-E164 VanDerWaalsContact O-N 3.17Å; N162-E164 PolarHBondContact OD1-N 3.35Å
165	I	89.7	Confident	94.6	Very high	42 Å²	42	39.8 Å²	39.8	22%	0.215	22%	0.22	C	C	.	.	S	Bend	trans	-96.2	143.2	-176.5	-60.4	179	0	0	0	110.1	N162 Y167 G214 E256	N162-I165 HydrophobicContact CB-CB 4.27Å; N162-I165 HydrophobicContact CB-CD1 3.88Å; N162-I165 HydrophobicContact CB-CG1 4.02Å; N162-I165 PolarHBondContact O-N 3.39Å; I165-Y167 HydrophobicContact CB-CE2 3.91Å; I165-Y167 HydrophobicContact CG2-CD2 4.45Å; I165-Y167 HydrophobicContact CG2-CE1 4.18Å; I165-Y167 HydrophobicContact CG2-CE2 4.01Å; I165-Y167 WeakPolarHBondContact O-CD2 3.01Å; I165-Y167 WeakPolarHBondContact O-CE2 3.49Å; I165-G214 PolarHBondContact O-N 3.04Å; I165-E256 HydrophobicContact CG2-CB 4.15Å; I165-E256 HydrophobicContact CG2-CG 3.97Å
166	K	92.5	Very high	94.5	Very high	118 Å²	118	38.2 Å²	38.2	51%	0.513	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	139.6	169.4	-69.1	-175.1	-176.9	179.4	0	110.4	P211 F212 L257	K166-P211 HydrophobicContact CB-CB 4.37Å; K166-F212 CarbonylContact C-O 3.53Å; K166-F212 VanDerWaalsContact CA-O 3.27Å; K166-F212 WeakPolarHBondContact CA-O 3.29Å; K166-L257 HydrophobicContact CB-CB 4.15Å; K166-L257 HydrophobicContact CB-CD2 4.3Å; K166-L257 WeakPolarHBondContact O-CB 3.36Å; K166-L257 PolarHBondContact O-N 3.31Å
167	Y	93.4	Very high	94.4	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.4	-176.2	-63.7	-87.7	0	0	0	111.1	M118 I121 C161 N162 I165 P211 F212 L217 M254 F255 E256	M118-Y167 HydrophobicContact SD-CD1 4.48Å; M118-Y167 HydrophobicContact SD-CE1 4.21Å; I121-Y167 HydrophobicContact CD1-CE1 3.86Å; C161-Y167 HydrophobicContact CB-CE2 4.05Å; N162-Y167 WeakPolarHBondContact CB-OH 3.45Å; N162-Y167 PolarHBondContact N-OH 3.15Å; I165-Y167 HydrophobicContact CB-CE2 3.91Å; I165-Y167 HydrophobicContact CG2-CD2 4.45Å; I165-Y167 HydrophobicContact CG2-CE1 4.18Å; I165-Y167 HydrophobicContact CG2-CE2 4.01Å; I165-Y167 WeakPolarHBondContact O-CD2 3.01Å; I165-Y167 WeakPolarHBondContact O-CE2 3.49Å; Y167-P211 CarbonylContact O-C 3.59Å; Y167-P211 WeakPolarHBondContact O-CA 3.49Å; Y167-F212 PolarHBondContact N-O 2.89Å; Y167-F212 PolarHBondContact O-N 3.2Å; Y167-L217 HydrophobicContact CD2-CD1 3.84Å; Y167-L217 HydrophobicContact CG-CD1 3.89Å; Y167-M254 HydrophobicContact CD1-CE 4.4Å; Y167-M254 HydrophobicContact CD1-CG 3.69Å; Y167-M254 HydrophobicContact CD1-SD 3.7Å; Y167-M254 HydrophobicContact CE1-CG 4.45Å; Y167-M254 HydrophobicContact CE1-SD 4Å; Y167-M254 HydrophobicContact CG-CG 4.39Å; Y167-M254 HydrophobicContact CG-SD 4.43Å; Y167-F255 CarbonylContact C-O 3.58Å; Y167-F255 WeakPolarHBondContact CA-O 3.37Å; Y167-E256 HydrophobicContact CD1-CG 3.84Å; Y167-E256 HydrophobicContact CE1-CG 3.4Å; Y167-E256 VanDerWaalsContact CE1-CG 3.4Å
168	V	94.4	Very high	94.3	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.4	169.3	176.3	0	0	0	0	108.4	V206 P211 M254 F255 L268	V168-V206 HydrophobicContact CG1-CG1 4.16Å; V168-P211 HydrophobicContact CG2-CB 4.07Å; V168-M254 WeakPolarHBondContact O-CA 3.4Å; V168-F255 HydrophobicContact CB-CB 4.3Å; V168-F255 PolarHBondContact N-O 3.15Å; V168-F255 PolarHBondContact O-N 3.33Å; V168-L268 HydrophobicContact CB-CD1 4.2Å; V168-L268 HydrophobicContact CG2-CD1 3.85Å
169	I	95.7	Very high	94.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.3	179.9	-53.4	-59.7	0	0	0	109.1	F158 H207 S210 F212 L217 V222 F224 I252 H253 M254	F158-I169 HydrophobicContact CE1-CD1 4.49Å; F158-I169 HydrophobicContact CE2-CD1 4.23Å; F158-I169 HydrophobicContact CE2-CG1 4.44Å; F158-I169 HydrophobicContact CE2-CG2 4.44Å; F158-I169 HydrophobicContact CZ-CD1 3.97Å; F158-I169 HydrophobicContact CZ-CG2 4.21Å; I169-H207 HydrophobicContact CB-CB 4.47Å; I169-H207 VanDerWaalsContact O-CB 3.27Å; I169-H207 WeakPolarHBondContact O-CB 3.22Å; I169-H207 PolarHBondContact O-N 2.95Å; I169-S210 PolarHBondContact N-OG 3.37Å; I169-S210 PolarHBondContact O-OG 2.86Å; I169-S210 VanDerWaalsContact O-OG 3.09Å; I169-F212 HydrophobicContact CB-CD2 4.33Å; I169-F212 HydrophobicContact CB-CE2 4.16Å; I169-F212 HydrophobicContact CG1-CD2 3.79Å; I169-F212 HydrophobicContact CG1-CE2 4.05Å; I169-L217 HydrophobicContact CD1-CD1 4.19Å; I169-L217 HydrophobicContact CG1-CD1 4.46Å; I169-L217 HydrophobicContact CG1-CD2 4.09Å; I169-V222 HydrophobicContact CG2-CG1 4.39Å; I169-F224 HydrophobicContact CG2-CZ 3.87Å; I169-I252 HydrophobicContact CG2-CG2 4.09Å; I169-H253 WeakPolarHBondContact CA-O 3.43Å; I169-M254 HydrophobicContact CD1-CB 3.81Å; I169-M254 HydrophobicContact CD1-CE 3.61Å; I169-M254 HydrophobicContact CD1-CG 3.77Å
170	L	95.2	Very high	94.5	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	163.4	176.2	66.6	83.6	0	0	0	111.5	L110 I204 F205 V206 I252 H253 F255 L269	L110-L170 HydrophobicContact CD1-CD1 3.93Å; L170-I204 HydrophobicContact CD1-CB 4.34Å; L170-I204 HydrophobicContact CD1-CG2 4.28Å; L170-I204 HydrophobicContact CD2-CD1 4.12Å; L170-F205 CarbonylContact C-O 3.51Å; L170-F205 VanDerWaalsContact CA-O 3.26Å; L170-F205 WeakPolarHBondContact CA-O 3.37Å; L170-F205 WeakPolarHBondContact CB-O 3.39Å; L170-V206 HydrophobicContact CB-CB 4.3Å; L170-V206 HydrophobicContact CB-CG2 3.86Å; L170-V206 HydrophobicContact CD2-CG2 4.11Å; L170-I252 WeakPolarHBondContact O-CA 3.15Å; L170-H253 HydrophobicContact CD1-CB 3.7Å; L170-H253 HydrophobicContact CG-CB 4.03Å; L170-H253 PolarHBondContact N-O 3.13Å; L170-H253 PolarHBondContact O-N 3.41Å; L170-F255 HydrophobicContact CD1-CE2 4.43Å; L170-F255 HydrophobicContact CD2-CD2 4.13Å; L170-F255 HydrophobicContact CD2-CE2 3.52Å; L170-F255 HydrophobicContact CD2-CZ 4.24Å; L170-F255 HydrophobicContact CG-CD2 4.49Å; L170-F255 HydrophobicContact CG-CE2 3.91Å; L170-L269 HydrophobicContact CD2-CD2 4.32Å
171	L	96.9	Very high	94.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135	177.5	-171.2	150.1	0	0	0	109.7	I154 I173 F205 F224 L227 I240 R251 I252	I154-L171 HydrophobicContact CB-CD1 4.35Å; I154-L171 HydrophobicContact CD1-CD1 3.67Å; I154-L171 HydrophobicContact CG2-CD1 4.12Å; L171-I173 HydrophobicContact CD2-CD1 4.27Å; L171-I173 HydrophobicContact CD2-CG1 3.69Å; L171-F205 PolarHBondContact N-O 2.97Å; L171-F205 PolarHBondContact O-N 2.95Å; L171-F224 HydrophobicContact CB-CD1 3.79Å; L171-F224 HydrophobicContact CB-CE1 3.51Å; L171-F224 HydrophobicContact CB-CG 4.45Å; L171-F224 HydrophobicContact CB-CZ 3.95Å; L171-F224 HydrophobicContact CD1-CB 4.4Å; L171-F224 HydrophobicContact CD1-CD1 4.06Å; L171-F224 HydrophobicContact CD1-CD2 3.95Å; L171-F224 HydrophobicContact CD1-CE1 4.3Å; L171-F224 HydrophobicContact CD1-CE2 4.18Å; L171-F224 HydrophobicContact CD1-CG 3.87Å; L171-F224 HydrophobicContact CD1-CZ 4.33Å; L171-L227 HydrophobicContact CB-CD1 4.34Å; L171-L227 HydrophobicContact CD1-CD1 4.33Å; L171-L227 HydrophobicContact CD2-CD1 3.58Å; L171-L227 HydrophobicContact CG-CD1 4.28Å; L171-I240 HydrophobicContact CD2-CD1 4.29Å; L171-R251 VanDerWaalsContact CA-O 3.32Å; L171-R251 WeakPolarHBondContact CA-O 3.22Å; L171-I252 HydrophobicContact CD1-CG1 4.13Å; L171-I252 HydrophobicContact CG-CG1 4.49Å
172	D	96	Very high	94.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	165.9	165.9	92.6	-14.7	0	0	0	110.9	I204 P250 R251 H253	D172-I204 HydrophobicContact CB-CG2 4.1Å; D172-P250 WeakPolarHBondContact O-CA 3.3Å; D172-R251 VanDerWaalsContact CG-NH2 3.34Å; D172-R251 PolarHBondContact N-O 3.01Å; D172-R251 PolarHBondContact O-N 2.67Å; D172-R251 WeakPolarHBondContact OD1-CB 3.46Å; D172-R251 IonicContact OD1-CZ 3.78Å; D172-R251 IonicContact OD1-NE 3.13Å; D172-R251 PolarHBondContact OD1-NE 2.84Å; D172-R251 IonicContact OD1-NH2 3.32Å; D172-R251 PolarHBondContact OD1-NH2 2.88Å; D172-R251 IonicContact OD2-CZ 3.7Å; D172-R251 IonicContact OD2-NE 3.35Å; D172-R251 IonicContact OD2-NH2 2.87Å; D172-R251 PolarHBondContact OD2-NH2 2.69Å; D172-H253 VanDerWaalsContact CG-NE2 3.3Å; D172-H253 IonicContact OD1-NE2 3.67Å; D172-H253 PolarHBondContact OD1-NE2 3.49Å; D172-H253 VanDerWaalsContact OD1-NE2 3.13Å; D172-H253 IonicContact OD2-NE2 2.87Å
173	I	97.1	Very high	95.2	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.8	177.4	-60	-176.2	0	0	0	107.6	M150 L171 L229 I240 L242 Y248 F284	M150-I173 HydrophobicContact SD-CD1 4.38Å; L171-I173 HydrophobicContact CD2-CD1 4.27Å; L171-I173 HydrophobicContact CD2-CG1 3.69Å; I173-L229 HydrophobicContact CD1-CD2 3.58Å; I173-I240 HydrophobicContact CB-CG2 4.24Å; I173-I240 HydrophobicContact CD1-CD1 3.84Å; I173-I240 HydrophobicContact CD1-CG2 4.17Å; I173-I240 HydrophobicContact CG1-CD1 3.91Å; I173-I240 HydrophobicContact CG1-CG2 4.42Å; I173-L242 HydrophobicContact CB-CD2 4.35Å; I173-L242 HydrophobicContact CG2-CD1 4.48Å; I173-L242 HydrophobicContact CG2-CD2 3.9Å; I173-Y248 HydrophobicContact CG2-CD1 3.78Å; I173-Y248 HydrophobicContact CG2-CG 3.86Å; I173-F284 HydrophobicContact CD1-CE1 4.32Å; I173-F284 HydrophobicContact CD1-CZ 4.17Å; I173-F284 HydrophobicContact CG2-CE1 4.24Å; I173-F284 HydrophobicContact CG2-CZ 4.1Å
174	V	95.5	Very high	95.4	Very high	22 Å²	22	50.4 Å²	50.4	13%	0.133	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	146.2	-178.4	-60.6	0	0	0	0	111.3	L176 Y248 Q249 R251	V174-L176 PolarHBondContact O-N 2.96Å; V174-Y248 CarbonylContact O-C 3.48Å; V174-Y248 WeakPolarHBondContact O-CA 3.29Å; V174-Q249 HydrophobicContact CG2-CB 4.06Å; V174-Q249 WeakPolarHBondContact CG2-O 3.46Å; V174-Q249 PolarHBondContact N-O 3.41Å; V174-Q249 PolarHBondContact O-N 3.07Å; V174-R251 HydrophobicContact CG2-CG 4.29Å
175	P	96.6	Very high	95.7	Very high	65 Å²	65	47 Å²	47	42%	0.422	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	136.7	173.1	27	-33.6	0	0	0	110	Y248	P175-Y248 HydrophobicContact CB-CD1 4.49Å; P175-Y248 HydrophobicContact CB-CE1 4.29Å
176	L	95.9	Very high	95.8	Very high	71 Å²	71	52.1 Å²	52.1	37%	0.372	25%	0.247	S	C	.	.	S	Bend	trans	-76.4	-34.9	179.3	-172	67.8	0	0	0	111.6	V174 K247 Q249 Q283	V174-L176 PolarHBondContact O-N 2.96Å; L176-K247 HydrophobicContact CB-CB 3.85Å; L176-K247 HydrophobicContact CD2-CB 4.02Å; L176-K247 HydrophobicContact CD2-CD 4.13Å; L176-K247 PolarHBondContact N-O 2.9Å; L176-Q249 HydrophobicContact CD1-CB 4.36Å; L176-Q283 HydrophobicContact CD1-CG 4.34Å
177	D	96.1	Very high	95.6	Very high	41 Å²	41	54.8 Å²	54.8	22%	0.219	25%	0.254	C	S	.	.	S	Bend	trans	-153.4	175.7	174.2	63.4	22.2	0	0	0	111.7	K179 Y181	D177-K179 VanDerWaalsContact C-N 3.31Å; D177-K179 PolarHBondContact O-N 3.36Å; D177-K179 WeakPolarHBondContact OD1-CB 3.48Å; D177-K179 PolarHBondContact OD1-N 3.27Å; D177-K179 IonicContact OD2-NZ 3.78Å; D177-Y181 PolarHBondContact OD2-OH 3.39Å
178	S	96.3	Very high	95.5	Very high	102 Å²	102	58.8 Å²	58.8	71%	0.713	28%	0.283	S	S	*	.	S	Bend	trans	-94.5	42.8	177.8	-48.9	0	0	0	0	112.1	A196	S178-A196 PolarHBondContact O-N 3.1Å
179	K	97.4	Very high	95.5	Very high	95 Å²	95	60.5 Å²	60.5	41%	0.413	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.3	-178.9	-61.7	171.2	-170.5	152.5	0	112.1	D177 Y181 V192 H246	D177-K179 VanDerWaalsContact C-N 3.31Å; D177-K179 PolarHBondContact O-N 3.36Å; D177-K179 WeakPolarHBondContact OD1-CB 3.48Å; D177-K179 PolarHBondContact OD1-N 3.27Å; D177-K179 IonicContact OD2-NZ 3.78Å; K179-Y181 HydrophobicContact CB-CE2 4.05Å; K179-V192 HydrophobicContact CB-CG1 4.32Å; K179-V192 HydrophobicContact CD-CG1 4.29Å; K179-V192 HydrophobicContact CD-CG2 3.98Å; K179-V192 HydrophobicContact CG-CG1 4.41Å; K179-H246 PolarHBondContact O-CD2 2.99Å
180	R	97.9	Very high	95.5	Very high	107 Å²	107	62.7 Å²	62.7	40%	0.404	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.1	167.7	-175.9	170.9	174.3	-179.3	-2.7	109.7	A193 G194 K195 D197 M245	R180-A193 PolarHBondContact O-N 3.11Å; R180-G194 PolarHBondContact N-O 2.88Å; R180-G194 PolarHBondContact O-N 3.36Å; R180-K195 WeakPolarHBondContact CB-O 3.34Å; R180-D197 WeakPolarHBondContact CD-OD1 3.23Å; R180-D197 IonicContact CZ-OD1 3.69Å; R180-D197 IonicContact CZ-OD2 2.94Å; R180-D197 IonicContact NE-OD1 3.81Å; R180-D197 IonicContact NE-OD2 3.4Å; R180-D197 IonicContact NH1-OD1 2.81Å; R180-D197 PolarHBondContact NH1-OD1 2.87Å; R180-D197 IonicContact NH1-OD2 3.94Å; R180-D197 PolarHBondContact NH1-OD2 2.9Å; R180-M245 HydrophobicContact CG-CB 4.46Å
181	Y	98.4	Very high	95.6	Very high	20 Å²	20	65.3 Å²	65.3	8%	0.078	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	161.4	-175.3	-70.5	-89.6	0	0	0	113.1	D177 K179 L191 V192 M245 K247	D177-Y181 PolarHBondContact OD2-OH 3.39Å; K179-Y181 HydrophobicContact CB-CE2 4.05Å; Y181-L191 CarbonylContact C-O 3.59Å; Y181-L191 WeakPolarHBondContact CA-O 3.48Å; Y181-L191 WeakPolarHBondContact CD1-O 3.38Å; Y181-V192 HydrophobicContact CD1-CG2 4.41Å; Y181-V192 HydrophobicContact CE1-CG2 3.92Å; Y181-M245 WeakPolarHBondContact CB-O 3.46Å; Y181-M245 PolarHBondContact N-O 2.68Å; Y181-M245 WeakPolarHBondContact O-CB 3.31Å; Y181-K247 HydrophobicContact CD2-CD 4.28Å; Y181-K247 HydrophobicContact CD2-CG 3.96Å; Y181-K247 HydrophobicContact CE1-CD 4.32Å; Y181-K247 HydrophobicContact CE2-CB 4.24Å; Y181-K247 HydrophobicContact CE2-CD 3.57Å; Y181-K247 HydrophobicContact CE2-CG 3.61Å; Y181-K247 WeakPolarHBondContact OH-CD 2.97Å; Y181-K247 PolarHBondContact OH-NZ 3.17Å
182	R	97.7	Very high	95.6	Very high	150 Å²	150	69 Å²	69	57%	0.566	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	148.3	166.1	65.7	-178.6	179.1	176.4	-0.7	109.7	L191 A193	R182-L191 HydrophobicContact CG-CB 4.23Å; R182-L191 PolarHBondContact N-O 3.5Å; R182-L191 PolarHBondContact O-N 3.33Å; R182-A193 HydrophobicContact CB-CB 4.06Å; R182-A193 HydrophobicContact CG-CB 3.99Å
183	Y	97.3	Very high	95.7	Very high	22 Å²	22	71.7 Å²	71.7	9%	0.086	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.1	175.4	-164.7	-102.3	0	0	0	110.6	Y185 S188 W190 Q291 N292	Y183-Y185 AromaticContact CD1-CD1 3.8Å; Y183-Y185 HydrophobicContact CD1-CD1 3.8Å; Y183-Y185 AromaticContact CD1-CE1 3.9Å; Y183-Y185 HydrophobicContact CD1-CE1 3.9Å; Y183-Y185 HydrophobicContact CD1-CG 4.2Å; Y183-Y185 HydrophobicContact CE1-CD1 4.01Å; Y183-Y185 HydrophobicContact CE1-CE1 4.36Å; Y183-S188 VanDerWaalsContact CZ-C 3.48Å; Y183-S188 VanDerWaalsContact OH-CA 3.25Å; Y183-S188 WeakPolarHBondContact OH-CA 3.44Å; Y183-S188 PolarHBondContact OH-O 3.21Å; Y183-W190 AromaticContact CD2-CD1 3.89Å; Y183-W190 AromaticContact CD2-CD2 3.77Å; Y183-W190 HydrophobicContact CD2-CD2 3.77Å; Y183-W190 AromaticContact CD2-CE2 3.67Å; Y183-W190 HydrophobicContact CD2-CE3 4.34Å; Y183-W190 AromaticContact CD2-CG 3.93Å; Y183-W190 HydrophobicContact CD2-CG 3.93Å; Y183-W190 HydrophobicContact CD2-CZ2 4.21Å; Y183-W190 AromaticContact CD2-NE1 3.72Å; Y183-W190 HydrophobicContact CE2-CG 4.46Å; Y183-W190 AromaticContact CE2-NE1 3.94Å; Y183-Q291 HydrophobicContact CD1-CB 3.96Å; Y183-Q291 HydrophobicContact CD2-CB 4.11Å; Y183-Q291 HydrophobicContact CG-CB 3.65Å; Y183-N292 HydrophobicContact CE2-CB 4.09Å
184	A	95.5	Very high	95.7	Very high	10 Å²	10	73 Å²	73	8%	0.083	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	95.6	176.9	0	0	0	0	0	110	H186 R187 S188 C189 L191	A184-H186 VanDerWaalsContact C-N 3.33Å; A184-H186 PolarHBondContact O-N 3.2Å; A184-R187 CarbonylContact O-C 3.53Å; A184-R187 PolarHBondContact O-N 2.8Å; A184-S188 PolarHBondContact O-N 3.3Å; A184-C189 PolarHBondContact N-O 2.73Å; A184-C189 PolarHBondContact O-N 2.97Å; A184-L191 HydrophobicContact CB-CD1 3.6Å; A184-L191 HydrophobicContact CB-CG 3.98Å
185	Y	93.7	Very high	95.7	Very high	105 Å²	105	81 Å²	81	41%	0.412	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-55.8	-40.6	-174.6	-65.7	-79.7	0	0	0	114.5	Y183 R187 S188 Q291	Y183-Y185 AromaticContact CD1-CD1 3.8Å; Y183-Y185 HydrophobicContact CD1-CD1 3.8Å; Y183-Y185 AromaticContact CD1-CE1 3.9Å; Y183-Y185 HydrophobicContact CD1-CE1 3.9Å; Y183-Y185 HydrophobicContact CD1-CG 4.2Å; Y183-Y185 HydrophobicContact CE1-CD1 4.01Å; Y183-Y185 HydrophobicContact CE1-CE1 4.36Å; Y185-R187 PolarHBondContact O-N 3.11Å; Y185-R187 VanDerWaalsContact O-N 3.17Å; Y185-S188 PolarHBondContact O-N 3.35Å; Y185-Q291 PolarHBondContact OH-OE1 3.24Å
186	H	91.5	Very high	95.7	Very high	148 Å²	148	79.7 Å²	79.7	69%	0.685	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-66.1	-16.7	-179.9	65.1	-80.9	0	0	0	113.7	A184	A184-H186 VanDerWaalsContact C-N 3.33Å; A184-H186 PolarHBondContact O-N 3.2Å
187	R	89.5	Confident	95.6	Very high	175 Å²	175	79.3 Å²	79.3	66%	0.66	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-116.4	-0.9	177.3	-75.6	171.6	-174.3	-153.6	-0.9	112.9	A184 Y185 C189	A184-R187 CarbonylContact O-C 3.53Å; A184-R187 PolarHBondContact O-N 2.8Å; Y185-R187 PolarHBondContact O-N 3.11Å; Y185-R187 VanDerWaalsContact O-N 3.17Å; R187-C189 VanDerWaalsContact CB-SG 3.53Å; R187-C189 PolarHBondContact O-N 3.42Å
188	S	91.6	Very high	95.3	Very high	86 Å²	86	85.6 Å²	85.6	60%	0.601	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	41.2	-174.2	-57.5	0	0	0	0	113.7	Y183 A184 Y185	Y183-S188 VanDerWaalsContact CZ-C 3.48Å; Y183-S188 VanDerWaalsContact OH-CA 3.25Å; Y183-S188 WeakPolarHBondContact OH-CA 3.44Å; Y183-S188 PolarHBondContact OH-O 3.21Å; A184-S188 PolarHBondContact O-N 3.3Å; Y185-S188 PolarHBondContact O-N 3.35Å
189	C	93.2	Very high	94.7	Very high	43 Å²	43	85.5 Å²	85.5	29%	0.291	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.9	-173.7	73.8	0	0	0	0	114.1	A184 R187	A184-C189 PolarHBondContact N-O 2.73Å; A184-C189 PolarHBondContact O-N 2.97Å; R187-C189 VanDerWaalsContact CB-SG 3.53Å; R187-C189 PolarHBondContact O-N 3.42Å
190	W	96.2	Very high	94	Very high	45 Å²	45	81.9 Å²	81.9	17%	0.17	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129	173.6	-73.5	99.4	0	0	0	111	E140 Y183 M245 T285 V287 Q291	E140-W190 HydrophobicContact CG-CZ2 4.01Å; Y183-W190 AromaticContact CD2-CD1 3.89Å; Y183-W190 AromaticContact CD2-CD2 3.77Å; Y183-W190 HydrophobicContact CD2-CD2 3.77Å; Y183-W190 AromaticContact CD2-CE2 3.67Å; Y183-W190 HydrophobicContact CD2-CE3 4.34Å; Y183-W190 AromaticContact CD2-CG 3.93Å; Y183-W190 HydrophobicContact CD2-CG 3.93Å; Y183-W190 HydrophobicContact CD2-CZ2 4.21Å; Y183-W190 AromaticContact CD2-NE1 3.72Å; Y183-W190 HydrophobicContact CE2-CG 4.46Å; Y183-W190 AromaticContact CE2-NE1 3.94Å; W190-M245 HydrophobicContact CH2-CE 3.84Å; W190-M245 HydrophobicContact CZ3-CE 3.58Å; W190-T285 HydrophobicContact CE3-CG2 4.47Å; W190-T285 HydrophobicContact CH2-CG2 3.6Å; W190-T285 HydrophobicContact CZ2-CG2 3.98Å; W190-T285 HydrophobicContact CZ3-CG2 3.88Å; W190-V287 HydrophobicContact CH2-CG1 3.79Å; W190-V287 HydrophobicContact CZ2-CG1 4.27Å; W190-Q291 HydrophobicContact CH2-CB 4.22Å; W190-Q291 HydrophobicContact CH2-CG 3.65Å; W190-Q291 HydrophobicContact CZ2-CB 4.08Å; W190-Q291 HydrophobicContact CZ2-CG 3.97Å
191	L	96.8	Very high	93.3	Very high	56 Å²	56	80.3 Å²	80.3	29%	0.293	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.8	176.4	-59.3	-178.7	0	0	0	110.5	Y181 R182 A184 A193	Y181-L191 CarbonylContact C-O 3.59Å; Y181-L191 WeakPolarHBondContact CA-O 3.48Å; Y181-L191 WeakPolarHBondContact CD1-O 3.38Å; R182-L191 HydrophobicContact CG-CB 4.23Å; R182-L191 PolarHBondContact N-O 3.5Å; R182-L191 PolarHBondContact O-N 3.33Å; A184-L191 HydrophobicContact CB-CD1 3.6Å; A184-L191 HydrophobicContact CB-CG 3.98Å; L191-A193 PolarHBondContact O-N 3.03Å
192	V	97.9	Very high	92.5	Very high	79 Å²	79	80.3 Å²	80.3	48%	0.479	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	127.5	169.6	179.9	0	0	0	0	108.6	K179 Y181	K179-V192 HydrophobicContact CB-CG1 4.32Å; K179-V192 HydrophobicContact CD-CG1 4.29Å; K179-V192 HydrophobicContact CD-CG2 3.98Å; K179-V192 HydrophobicContact CG-CG1 4.41Å; Y181-V192 HydrophobicContact CD1-CG2 4.41Å; Y181-V192 HydrophobicContact CE1-CG2 3.92Å
193	A	96.9	Very high	92.2	Very high	55 Å²	55	74.3 Å²	74.3	46%	0.455	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-29.4	177.7	0	0	0	0	0	112.3	R180 R182 L191	R180-A193 PolarHBondContact O-N 3.11Å; R182-A193 HydrophobicContact CB-CB 4.06Å; R182-A193 HydrophobicContact CG-CB 3.99Å; L191-A193 PolarHBondContact O-N 3.03Å
194	G	97.1	Very high	91.9	Very high	36 Å²	36	74.5 Å²	74.5	37%	0.371	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	-162.6	-178.7	0	0	0	0	0	113.1	R180	R180-G194 PolarHBondContact N-O 2.88Å; R180-G194 PolarHBondContact O-N 3.36Å
195	K	97.1	Very high	91.9	Very high	191 Å²	191	75.7 Å²	75.7	83%	0.83	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	152.5	170.8	-65.1	-177.2	178.7	-179	0	110	R180	R180-K195 WeakPolarHBondContact CB-O 3.34Å
196	A	96.4	Very high	92	Very high	36 Å²	36	72.6 Å²	72.6	30%	0.298	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-58.5	148.3	173.7	0	0	0	0	0	111.7	S178 H246	S178-A196 PolarHBondContact O-N 3.1Å; A196-H246 WeakPolarHBondContact CA-NE2 3.41Å
197	D	93.8	Very high	92.2	Very high	64 Å²	64	65.8 Å²	65.8	34%	0.342	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-67.2	168	169	-60.3	-25.8	0	0	0	109.7	R180 S199 H246	R180-D197 WeakPolarHBondContact CD-OD1 3.23Å; R180-D197 IonicContact CZ-OD1 3.69Å; R180-D197 IonicContact CZ-OD2 2.94Å; R180-D197 IonicContact NE-OD1 3.81Å; R180-D197 IonicContact NE-OD2 3.4Å; R180-D197 IonicContact NH1-OD1 2.81Å; R180-D197 PolarHBondContact NH1-OD1 2.87Å; R180-D197 IonicContact NH1-OD2 3.94Å; R180-D197 PolarHBondContact NH1-OD2 2.9Å; D197-S199 PolarHBondContact O-N 3.48Å; D197-H246 PolarHBondContact N-NE2 3.26Å; D197-H246 IonicContact OD2-CE1 3.96Å; D197-H246 PolarHBondContact OD2-CE1 3.27Å
198	Q	90	Very high	92.4	Very high	172 Å²	172	60.6 Å²	60.6	80%	0.804	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-55.1	135.3	-179.5	-175.4	173.6	8.4	0	0	111.2	T200 N243	Q198-T200 PolarHBondContact O-N 3.31Å; Q198-N243 PolarHBondContact O-ND2 3.39Å
199	S	82	Confident	92.5	Very high	101 Å²	101	60.9 Å²	60.9	71%	0.706	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-63.3	129.9	-177.8	55.8	0	0	0	0	111.3	D197	D197-S199 PolarHBondContact O-N 3.48Å
200	T	83.1	Confident	92.5	Very high	19 Å²	19	60 Å²	60	12%	0.117	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-72.7	149	171.6	52.3	0	0	0	0	110.4	Q198 T202 I241 N243	Q198-T200 PolarHBondContact O-N 3.31Å; T200-T202 PolarHBondContact O-N 3.15Å; T200-T202 VanDerWaalsContact O-N 3.15Å; T200-I241 HydrophobicContact CG2-CG2 3.66Å; T200-I241 PolarHBondContact OG1-O 2.88Å; T200-N243 VanDerWaalsContact CG2-OD1 3.22Å; T200-N243 WeakPolarHBondContact CG2-OD1 3.42Å
201	P	83.3	Confident	92.4	Very high	74 Å²	74	61 Å²	61	48%	0.481	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-54.2	123.5	172.9	-25.2	34.3	0	0	0	110.4	R203	P201-R203 PolarHBondContact O-N 3.26Å
202	T	81.9	Confident	92.2	Very high	19 Å²	19	58.3 Å²	58.3	12%	0.117	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-62.5	131.5	177.9	-52.3	0	0	0	0	109	Q107 H109 T200	Q107-T202 VanDerWaalsContact CB-O 3.31Å; Q107-T202 WeakPolarHBondContact CB-O 3.27Å; Q107-T202 PolarHBondContact OE1-O 2.83Å; H109-T202 PolarHBondContact CE1-OG1 3.38Å; H109-T202 PolarHBondContact ND1-OG1 2.82Å; H109-T202 PolarHBondContact NE2-OG1 2.87Å; T200-T202 PolarHBondContact O-N 3.15Å; T200-T202 VanDerWaalsContact O-N 3.15Å
203	R	90.7	Very high	92	Very high	25 Å²	25	56.3 Å²	56.3	9%	0.094	33%	0.332	C	S	.	.			trans	-119.4	137.9	173.8	-71.9	178.7	178.9	-166.8	-3.2	109.5	P201 D235 H239 I241	P201-R203 PolarHBondContact O-N 3.26Å; R203-D235 VanDerWaalsContact CZ-O 3.31Å; R203-D235 PolarHBondContact NH1-O 3.03Å; R203-D235 VanDerWaalsContact NH1-O 3.1Å; R203-D235 IonicContact NH1-OD2 3.29Å; R203-D235 PolarHBondContact NH1-OD2 3.13Å; R203-D235 PolarHBondContact NH2-O 2.97Å; R203-H239 WeakPolarHBondContact CD-O 3.43Å; R203-H239 PolarHBondContact NH1-O 2.89Å; R203-I241 VanDerWaalsContact NH2-CD1 3.35Å
204	I	92.6	Very high	91.8	Very high	25 Å²	25	53.7 Å²	53.7	13%	0.128	31%	0.311	C	S	.	.			trans	-95.8	144.1	170	56.1	160	0	0	0	110.2	L110 L170 D172 V206 I265 L269	L110-I204 HydrophobicContact CD1-CG2 3.78Å; L170-I204 HydrophobicContact CD1-CB 4.34Å; L170-I204 HydrophobicContact CD1-CG2 4.28Å; L170-I204 HydrophobicContact CD2-CD1 4.12Å; D172-I204 HydrophobicContact CB-CG2 4.1Å; I204-V206 HydrophobicContact CD1-CG2 4.03Å; I204-I265 HydrophobicContact CD1-CG2 3.77Å; I204-L269 HydrophobicContact CD1-CD1 3.72Å; I204-L269 HydrophobicContact CD1-CD2 4.25Å
205	F	95.3	Very high	91.6	Very high	36 Å²	36	55.4 Å²	55.4	16%	0.158	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	109.6	170.4	179	-88.4	0	0	0	108.9	L170 L171 F224 K226 L227 I240	L170-F205 CarbonylContact C-O 3.51Å; L170-F205 VanDerWaalsContact CA-O 3.26Å; L170-F205 WeakPolarHBondContact CA-O 3.37Å; L170-F205 WeakPolarHBondContact CB-O 3.39Å; L171-F205 PolarHBondContact N-O 2.97Å; L171-F205 PolarHBondContact O-N 2.95Å; F205-F224 AromaticContact CD1-CD1 3.68Å; F205-F224 HydrophobicContact CD1-CD1 3.68Å; F205-F224 HydrophobicContact CD1-CE1 4.19Å; F205-F224 AromaticContact CE1-CD1 3.8Å; F205-F224 HydrophobicContact CE1-CD1 3.8Å; F205-F224 HydrophobicContact CE1-CE1 4.49Å; F205-K226 HydrophobicContact CZ-CB 4.2Å; F205-L227 HydrophobicContact CB-CD1 3.8Å; F205-L227 HydrophobicContact CB-CG 4.37Å; F205-L227 HydrophobicContact CD1-CB 4.3Å; F205-L227 HydrophobicContact CD1-CD1 3.97Å; F205-L227 HydrophobicContact CD1-CG 4.47Å; F205-L227 HydrophobicContact CD2-CB 4.2Å; F205-L227 HydrophobicContact CD2-CD1 4.42Å; F205-L227 HydrophobicContact CD2-CG 4.21Å; F205-L227 HydrophobicContact CE1-CB 4.3Å; F205-L227 HydrophobicContact CE2-CB 4.2Å; F205-L227 HydrophobicContact CG-CB 4.24Å; F205-L227 HydrophobicContact CG-CD1 3.8Å; F205-L227 HydrophobicContact CG-CG 4.09Å; F205-L227 HydrophobicContact CZ-CB 4.25Å; F205-I240 HydrophobicContact CB-CD1 4.14Å
206	V	94.6	Very high	91.5	Very high	39 Å²	39	49.7 Å²	49.7	24%	0.236	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.5	175.8	178.7	0	0	0	0	108.6	V168 L170 I204 I265	V168-V206 HydrophobicContact CG1-CG1 4.16Å; L170-V206 HydrophobicContact CB-CB 4.3Å; L170-V206 HydrophobicContact CB-CG2 3.86Å; L170-V206 HydrophobicContact CD2-CG2 4.11Å; I204-V206 HydrophobicContact CD1-CG2 4.03Å; V206-I265 HydrophobicContact CB-CD1 4.1Å; V206-I265 HydrophobicContact CG1-CD1 3.99Å; V206-I265 HydrophobicContact CG2-CD1 3.61Å; V206-I265 HydrophobicContact CG2-CG1 4.5Å; V206-I265 HydrophobicContact CG2-CG2 4.17Å
207	H	96.1	Very high	91.5	Very high	6 Å²	6	48 Å²	48	3%	0.028	27%	0.274	C	S	.	.			trans	-60.3	131.1	-179.3	-171.3	-77.5	0	0	0	109.3	I169 D209 S210 F212 V222 T223 F224	I169-H207 HydrophobicContact CB-CB 4.47Å; I169-H207 VanDerWaalsContact O-CB 3.27Å; I169-H207 WeakPolarHBondContact O-CB 3.22Å; I169-H207 PolarHBondContact O-N 2.95Å; H207-D209 IonicContact CE1-OD2 3.26Å; H207-D209 PolarHBondContact CE1-OD2 3.03Å; H207-D209 PolarHBondContact ND1-N 2.85Å; H207-D209 VanDerWaalsContact ND1-N 3.12Å; H207-D209 PolarHBondContact O-N 3.49Å; H207-D209 VanDerWaalsContact O-N 3.12Å; H207-S210 VanDerWaalsContact O-CB 3.27Å; H207-S210 WeakPolarHBondContact O-CB 3.32Å; H207-S210 PolarHBondContact O-N 2.78Å; H207-S210 PolarHBondContact O-OG 3.21Å; H207-F212 HydrophobicContact CB-CE2 4.2Å; H207-F212 AromaticContact CE1-CZ 3.53Å; H207-F212 AromaticContact CG-CE2 3.95Å; H207-F212 AromaticContact CG-CZ 3.9Å; H207-F212 AromaticContact ND1-CE2 3.64Å; H207-F212 AromaticContact ND1-CZ 3.23Å; H207-F212 WeakPolarHBondContact ND1-CZ 3.45Å; H207-V222 VanDerWaalsContact CD2-CG1 3.42Å; H207-V222 WeakPolarHBondContact CD2-CG1 3.41Å; H207-T223 PolarHBondContact NE2-O 3.39Å; H207-T223 VanDerWaalsContact NE2-O 3.1Å; H207-F224 HydrophobicContact CB-CE1 4.26Å
208	P	94.1	Very high	91.3	Very high	65 Å²	65	47.9 Å²	47.9	42%	0.422	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.4	-172.9	23.4	-36.7	0	0	0	113.8	S210 K226	P208-S210 VanDerWaalsContact C-N 3.33Å; P208-K226 HydrophobicContact CG-CD 4.24Å
209	D	93.8	Very high	91.5	Very high	92 Å²	92	47 Å²	47	49%	0.492	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	6	180	-50.2	-18.4	0	0	0	112.9	H207 P211 F212	H207-D209 IonicContact CE1-OD2 3.26Å; H207-D209 PolarHBondContact CE1-OD2 3.03Å; H207-D209 PolarHBondContact ND1-N 2.85Å; H207-D209 VanDerWaalsContact ND1-N 3.12Å; H207-D209 PolarHBondContact O-N 3.49Å; H207-D209 VanDerWaalsContact O-N 3.12Å; D209-P211 CarbonylContact O-C 3.56Å; D209-F212 HydrophobicContact CB-CE1 3.56Å; D209-F212 HydrophobicContact CB-CZ 3.64Å
210	S	92.5	Very high	92.1	Very high	26 Å²	26	45.4 Å²	45.4	18%	0.182	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-70.9	143.1	171	-67.9	0	0	0	0	110.7	I169 H207 P208	I169-S210 PolarHBondContact N-OG 3.37Å; I169-S210 PolarHBondContact O-OG 2.86Å; I169-S210 VanDerWaalsContact O-OG 3.09Å; H207-S210 VanDerWaalsContact O-CB 3.27Å; H207-S210 WeakPolarHBondContact O-CB 3.32Å; H207-S210 PolarHBondContact O-N 2.78Å; H207-S210 PolarHBondContact O-OG 3.21Å; P208-S210 VanDerWaalsContact C-N 3.33Å
211	P	93.5	Very high	92.8	Very high	65 Å²	65	46.9 Å²	46.9	42%	0.422	26%	0.262	S	S	.	.	S	Bend	cis	-81.2	145.9	0.5	32.6	-34.8	0	0	0	113.3	K166 Y167 V168 D209 L257	K166-P211 HydrophobicContact CB-CB 4.37Å; Y167-P211 CarbonylContact O-C 3.59Å; Y167-P211 WeakPolarHBondContact O-CA 3.49Å; V168-P211 HydrophobicContact CG2-CB 4.07Å; D209-P211 CarbonylContact O-C 3.56Å; P211-L257 HydrophobicContact CB-CD2 4.48Å; P211-L257 HydrophobicContact CG-CD2 4.48Å
212	F	94.3	Very high	93.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	145.4	174.5	-63.4	-83.2	0	0	0	111.5	K166 Y167 I169 H207 D209 Q216 L217 V222	K166-F212 CarbonylContact C-O 3.53Å; K166-F212 VanDerWaalsContact CA-O 3.27Å; K166-F212 WeakPolarHBondContact CA-O 3.29Å; Y167-F212 PolarHBondContact N-O 2.89Å; Y167-F212 PolarHBondContact O-N 3.2Å; I169-F212 HydrophobicContact CB-CD2 4.33Å; I169-F212 HydrophobicContact CB-CE2 4.16Å; I169-F212 HydrophobicContact CG1-CD2 3.79Å; I169-F212 HydrophobicContact CG1-CE2 4.05Å; H207-F212 HydrophobicContact CB-CE2 4.2Å; H207-F212 AromaticContact CE1-CZ 3.53Å; H207-F212 AromaticContact CG-CE2 3.95Å; H207-F212 AromaticContact CG-CZ 3.9Å; H207-F212 AromaticContact ND1-CE2 3.64Å; H207-F212 AromaticContact ND1-CZ 3.23Å; H207-F212 WeakPolarHBondContact ND1-CZ 3.45Å; D209-F212 HydrophobicContact CB-CE1 3.56Å; D209-F212 HydrophobicContact CB-CZ 3.64Å; F212-Q216 HydrophobicContact CD1-CG 4.26Å; F212-L217 HydrophobicContact CB-CD1 4.24Å; F212-L217 HydrophobicContact CB-CD2 3.63Å; F212-L217 HydrophobicContact CB-CG 3.6Å; F212-L217 HydrophobicContact CD1-CD2 4.23Å; F212-L217 HydrophobicContact CD2-CD2 3.79Å; F212-L217 HydrophobicContact CE2-CD2 4.41Å; F212-L217 HydrophobicContact CG-CD2 3.63Å; F212-L217 HydrophobicContact CG-CG 4.19Å; F212-V222 HydrophobicContact CE2-CG1 4.36Å; F212-V222 HydrophobicContact CE2-CG2 4.5Å; F212-V222 HydrophobicContact CZ-CG1 4.23Å; F212-V222 HydrophobicContact CZ-CG2 4.25Å
213	A	93.1	Very high	94.3	Very high	36 Å²	36	44.8 Å²	44.8	30%	0.298	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	148.5	163.9	0	0	0	0	0	110.6	D215 Q216 L217	A213-D215 PolarHBondContact O-N 3.36Å; A213-Q216 HydrophobicContact CB-CB 4.16Å; A213-Q216 WeakPolarHBondContact O-CA 3.4Å; A213-Q216 VanDerWaalsContact O-CB 3.3Å; A213-Q216 WeakPolarHBondContact O-CB 3.27Å; A213-Q216 PolarHBondContact O-N 3.06Å; A213-L217 PolarHBondContact O-N 3.42Å
214	G	92.8	Very high	94.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-33.6	177.8	0	0	0	0	0	113.9	N162 I165 Q216 L217 S218	N162-G214 WeakPolarHBondContact O-CA 3.32Å; I165-G214 PolarHBondContact O-N 3.04Å; G214-Q216 VanDerWaalsContact C-N 3.34Å; G214-L217 PolarHBondContact O-N 3.27Å; G214-S218 PolarHBondContact O-N 3.18Å; G214-S218 VanDerWaalsContact O-N 3.15Å; G214-S218 PolarHBondContact O-OG 2.91Å
215	D	93	Very high	94.7	Very high	72 Å²	72	46.8 Å²	46.8	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-65.2	-38.9	172.3	-178	51.5	0	0	0	111.6	P163 A213 S218 K219	P163-D215 HydrophobicContact CB-CB 4.06Å; A213-D215 PolarHBondContact O-N 3.36Å; D215-S218 PolarHBondContact O-N 2.9Å; D215-K219 WeakPolarHBondContact O-CG 3.5Å; D215-K219 PolarHBondContact O-N 2.85Å; D215-K219 WeakPolarHBondContact OD1-CE 3.44Å; D215-K219 IonicContact OD1-NZ 3.68Å; D215-K219 PolarHBondContact OD1-NZ 2.89Å; D215-K219 IonicContact OD2-NZ 3.77Å; D215-K219 PolarHBondContact OD2-NZ 2.82Å
216	Q	94.7	Very high	94.8	Very high	71 Å²	71	51.4 Å²	51.4	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-45.9	175.8	-173.7	-177.3	8.2	0	0	111.2	F212 A213 G214 S218 K219 Q220	F212-Q216 HydrophobicContact CD1-CG 4.26Å; A213-Q216 HydrophobicContact CB-CB 4.16Å; A213-Q216 WeakPolarHBondContact O-CA 3.4Å; A213-Q216 VanDerWaalsContact O-CB 3.3Å; A213-Q216 WeakPolarHBondContact O-CB 3.27Å; A213-Q216 PolarHBondContact O-N 3.06Å; G214-Q216 VanDerWaalsContact C-N 3.34Å; Q216-S218 PolarHBondContact O-N 3.08Å; Q216-K219 PolarHBondContact O-N 3.49Å; Q216-K219 VanDerWaalsContact O-N 3.15Å; Q216-Q220 HydrophobicContact CG-CG 4.46Å; Q216-Q220 VanDerWaalsContact CG-OE1 3.32Å; Q216-Q220 WeakPolarHBondContact O-CG 3.31Å; Q216-Q220 PolarHBondContact O-N 2.96Å
217	L	95.4	Very high	94.9	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-34.5	178	-75.1	-178.6	0	0	0	113.2	F158 Y167 I169 F212 A213 G214 K219 V222 M254	F158-L217 HydrophobicContact CB-CB 4.31Å; F158-L217 HydrophobicContact CD2-CD2 3.95Å; F158-L217 HydrophobicContact CE2-CD2 4.28Å; Y167-L217 HydrophobicContact CD2-CD1 3.84Å; Y167-L217 HydrophobicContact CG-CD1 3.89Å; I169-L217 HydrophobicContact CD1-CD1 4.19Å; I169-L217 HydrophobicContact CG1-CD1 4.46Å; I169-L217 HydrophobicContact CG1-CD2 4.09Å; F212-L217 HydrophobicContact CB-CD1 4.24Å; F212-L217 HydrophobicContact CB-CD2 3.63Å; F212-L217 HydrophobicContact CB-CG 3.6Å; F212-L217 HydrophobicContact CD1-CD2 4.23Å; F212-L217 HydrophobicContact CD2-CD2 3.79Å; F212-L217 HydrophobicContact CE2-CD2 4.41Å; F212-L217 HydrophobicContact CG-CD2 3.63Å; F212-L217 HydrophobicContact CG-CG 4.19Å; A213-L217 PolarHBondContact O-N 3.42Å; G214-L217 PolarHBondContact O-N 3.27Å; L217-K219 VanDerWaalsContact C-N 3.29Å; L217-K219 PolarHBondContact O-N 3.39Å; L217-V222 HydrophobicContact CD2-CG2 3.7Å; L217-M254 HydrophobicContact CD1-CE 3.77Å
218	S	91.5	Very high	95	Very high	61 Å²	61	52.8 Å²	52.8	43%	0.427	28%	0.28	S	S	.	.	H	α-helix	trans	-74.8	-19.7	-179.6	-55.8	0	0	0	0	113	G214 D215 Q216	G214-S218 PolarHBondContact O-N 3.18Å; G214-S218 VanDerWaalsContact O-N 3.15Å; G214-S218 PolarHBondContact O-OG 2.91Å; D215-S218 PolarHBondContact O-N 2.9Å; Q216-S218 PolarHBondContact O-N 3.08Å
219	K	93.5	Very high	95.1	Very high	155 Å²	155	49.7 Å²	49.7	67%	0.674	26%	0.26	S	S	*	.	H	α-helix	trans	-102.4	-16.4	-173.9	-73.2	172.8	177.9	166.4	0	114.6	D215 Q216 L217	D215-K219 WeakPolarHBondContact O-CG 3.5Å; D215-K219 PolarHBondContact O-N 2.85Å; D215-K219 WeakPolarHBondContact OD1-CE 3.44Å; D215-K219 IonicContact OD1-NZ 3.68Å; D215-K219 PolarHBondContact OD1-NZ 2.89Å; D215-K219 IonicContact OD2-NZ 3.77Å; D215-K219 PolarHBondContact OD2-NZ 2.82Å; Q216-K219 PolarHBondContact O-N 3.49Å; Q216-K219 VanDerWaalsContact O-N 3.15Å; L217-K219 VanDerWaalsContact C-N 3.29Å; L217-K219 PolarHBondContact O-N 3.39Å
220	Q	95.1	Very high	95.3	Very high	66 Å²	66	45.3 Å²	45.3	31%	0.308	24%	0.237	S	C	.	.	S	Bend	trans	-131.8	157.8	-171.3	81.3	-175.1	27.3	0	0	113.3	Q216	Q216-Q220 HydrophobicContact CG-CG 4.46Å; Q216-Q220 VanDerWaalsContact CG-OE1 3.32Å; Q216-Q220 WeakPolarHBondContact O-CG 3.31Å; Q216-Q220 PolarHBondContact O-N 2.96Å
221	V	97.5	Very high	95.4	Very high	51 Å²	51	47.4 Å²	47.4	31%	0.309	25%	0.246	S	C	.	.			trans	-83	124.1	169.5	-179.1	0	0	0	0	109.3	E126 R155 T157	E126-V221 HydrophobicContact CG-CG1 3.82Å; E126-V221 HydrophobicContact CG-CG2 4.24Å; R155-V221 HydrophobicContact CB-CG1 3.92Å; T157-V221 HydrophobicContact CG2-CB 4.27Å; T157-V221 HydrophobicContact CG2-CG2 3.68Å
222	V	97.9	Very high	95.5	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.8	171.2	-179.2	0	0	0	0	109.1	R155 V156 F158 I169 H207 F212 L217 F224	R155-V222 CarbonylContact C-O 2.85Å; R155-V222 WeakPolarHBondContact CA-O 3.36Å; V156-V222 HydrophobicContact CG2-CB 4.11Å; V156-V222 PolarHBondContact N-O 2.89Å; V156-V222 PolarHBondContact O-N 3.3Å; F158-V222 HydrophobicContact CD2-CG2 4.18Å; F158-V222 HydrophobicContact CE2-CB 4.27Å; F158-V222 HydrophobicContact CE2-CG2 3.96Å; I169-V222 HydrophobicContact CG2-CG1 4.39Å; H207-V222 VanDerWaalsContact CD2-CG1 3.42Å; H207-V222 WeakPolarHBondContact CD2-CG1 3.41Å; F212-V222 HydrophobicContact CE2-CG1 4.36Å; F212-V222 HydrophobicContact CE2-CG2 4.5Å; F212-V222 HydrophobicContact CZ-CG1 4.23Å; F212-V222 HydrophobicContact CZ-CG2 4.25Å; L217-V222 HydrophobicContact CD2-CG2 3.7Å; V222-F224 HydrophobicContact CG1-CE2 4.41Å
223	T	97.6	Very high	95.4	Very high	47 Å²	47	52.4 Å²	52.4	29%	0.288	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.5	-172.4	-177	0	0	0	0	112.6	H207 E225	H207-T223 PolarHBondContact NE2-O 3.39Å; H207-T223 VanDerWaalsContact NE2-O 3.1Å; T223-E225 PolarHBondContact O-N 3.32Å; T223-E225 VanDerWaalsContact O-N 3.08Å
224	F	97.7	Very high	95.2	Very high	7 Å²	7	55.2 Å²	55.2	3%	0.031	28%	0.282	C	S	.	.			trans	-86.8	42	177.6	-64.8	-87.7	0	0	0	112.3	I154 V156 I169 L171 F205 H207 V222 K226 L227 I252	I154-F224 HydrophobicContact CB-CB 4.44Å; I154-F224 HydrophobicContact CB-CD2 4.27Å; I154-F224 HydrophobicContact CG2-CD2 3.94Å; I154-F224 HydrophobicContact CG2-CE2 4.48Å; I154-F224 PolarHBondContact O-N 2.8Å; V156-F224 HydrophobicContact CG2-CE2 4.39Å; I169-F224 HydrophobicContact CG2-CZ 3.87Å; L171-F224 HydrophobicContact CB-CD1 3.79Å; L171-F224 HydrophobicContact CB-CE1 3.51Å; L171-F224 HydrophobicContact CB-CG 4.45Å; L171-F224 HydrophobicContact CB-CZ 3.95Å; L171-F224 HydrophobicContact CD1-CB 4.4Å; L171-F224 HydrophobicContact CD1-CD1 4.06Å; L171-F224 HydrophobicContact CD1-CD2 3.95Å; L171-F224 HydrophobicContact CD1-CE1 4.3Å; L171-F224 HydrophobicContact CD1-CE2 4.18Å; L171-F224 HydrophobicContact CD1-CG 3.87Å; L171-F224 HydrophobicContact CD1-CZ 4.33Å; F205-F224 AromaticContact CD1-CD1 3.68Å; F205-F224 HydrophobicContact CD1-CD1 3.68Å; F205-F224 HydrophobicContact CD1-CE1 4.19Å; F205-F224 AromaticContact CE1-CD1 3.8Å; F205-F224 HydrophobicContact CE1-CD1 3.8Å; F205-F224 HydrophobicContact CE1-CE1 4.49Å; H207-F224 HydrophobicContact CB-CE1 4.26Å; V222-F224 HydrophobicContact CG1-CE2 4.41Å; F224-K226 VanDerWaalsContact C-N 3.33Å; F224-K226 PolarHBondContact O-N 3.4Å; F224-L227 HydrophobicContact CB-CB 4.37Å; F224-L227 VanDerWaalsContact O-CB 3.3Å; F224-L227 WeakPolarHBondContact O-CB 3.46Å; F224-L227 PolarHBondContact O-N 2.9Å; F224-I252 HydrophobicContact CE2-CD1 3.98Å; F224-I252 HydrophobicContact CE2-CG1 4.12Å; F224-I252 HydrophobicContact CZ-CG1 4.37Å; F224-I252 HydrophobicContact CZ-CG2 4.38Å
225	E	95.7	Very high	95.2	Very high	86 Å²	86	55.4 Å²	55.4	40%	0.402	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-33	-173.7	-166	-166.6	149.9	0	0	113.5	R149 T153 T223 L227	R149-E225 WeakPolarHBondContact CD-O 3.38Å; R149-E225 IonicContact CZ-OE1 3.85Å; R149-E225 IonicContact NH1-OE1 2.97Å; R149-E225 PolarHBondContact NH1-OE1 2.91Å; T153-E225 HydrophobicContact CG2-CB 4.12Å; T223-E225 PolarHBondContact O-N 3.32Å; T223-E225 VanDerWaalsContact O-N 3.08Å; E225-L227 PolarHBondContact O-N 2.98Å
226	K	95.6	Very high	95.2	Very high	132 Å²	132	60.5 Å²	60.5	57%	0.574	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.2	-179	-61.5	-174.5	-171.5	167.7	0	113	F205 P208 F224 K228	F205-K226 HydrophobicContact CZ-CB 4.2Å; P208-K226 HydrophobicContact CG-CD 4.24Å; F224-K226 VanDerWaalsContact C-N 3.33Å; F224-K226 PolarHBondContact O-N 3.4Å; K226-K228 PolarHBondContact O-N 2.88Å
227	L	97.1	Very high	95.1	Very high	1 Å²	1	63 Å²	63	1%	0.005	32%	0.316	C	S	.	.			trans	-67.5	131.4	178.9	-172.8	153.8	0	0	0	110.4	M150 L171 F205 F224 E225 L229 I240	M150-L227 HydrophobicContact CG-CD2 3.99Å; M150-L227 HydrophobicContact SD-CD2 3.71Å; L171-L227 HydrophobicContact CB-CD1 4.34Å; L171-L227 HydrophobicContact CD1-CD1 4.33Å; L171-L227 HydrophobicContact CD2-CD1 3.58Å; L171-L227 HydrophobicContact CG-CD1 4.28Å; F205-L227 HydrophobicContact CB-CD1 3.8Å; F205-L227 HydrophobicContact CB-CG 4.37Å; F205-L227 HydrophobicContact CD1-CB 4.3Å; F205-L227 HydrophobicContact CD1-CD1 3.97Å; F205-L227 HydrophobicContact CD1-CG 4.47Å; F205-L227 HydrophobicContact CD2-CB 4.2Å; F205-L227 HydrophobicContact CD2-CD1 4.42Å; F205-L227 HydrophobicContact CD2-CG 4.21Å; F205-L227 HydrophobicContact CE1-CB 4.3Å; F205-L227 HydrophobicContact CE2-CB 4.2Å; F205-L227 HydrophobicContact CG-CB 4.24Å; F205-L227 HydrophobicContact CG-CD1 3.8Å; F205-L227 HydrophobicContact CG-CG 4.09Å; F205-L227 HydrophobicContact CZ-CB 4.25Å; F224-L227 HydrophobicContact CB-CB 4.37Å; F224-L227 VanDerWaalsContact O-CB 3.3Å; F224-L227 WeakPolarHBondContact O-CB 3.46Å; F224-L227 PolarHBondContact O-N 2.9Å; E225-L227 PolarHBondContact O-N 2.98Å; L227-L229 HydrophobicContact CD2-CD2 3.59Å; L227-L229 HydrophobicContact CD2-CG 4.32Å; L227-I240 HydrophobicContact CD1-CD1 3.76Å; L227-I240 HydrophobicContact CD2-CD1 4.21Å; L227-I240 HydrophobicContact CG-CD1 4.09Å
228	K	97.5	Very high	94.9	Very high	74 Å²	74	64.3 Å²	64.3	32%	0.322	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.1	178.8	-74.1	175.3	173.3	-176.5	0	111.2	R148 R149 K226 H239 I240	R148-K228 CarbonylContact O-C 3.53Å; R148-K228 VanDerWaalsContact O-CA 3.31Å; R148-K228 WeakPolarHBondContact O-CA 3.31Å; R149-K228 HydrophobicContact CG-CG 4.18Å; K226-K228 PolarHBondContact O-N 2.88Å; K228-H239 HydrophobicContact CB-CB 4.43Å; K228-H239 VanDerWaalsContact CD-NE2 3.29Å; K228-H239 WeakPolarHBondContact CD-NE2 3.36Å; K228-I240 PolarHBondContact O-N 2.91Å
229	L	97.8	Very high	95.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.5	177.6	-51	-177.5	0	0	0	110.3	M141 I143 G147 R148 M150 I173 L227 I240 L242 F284	M141-L229 HydrophobicContact CB-CD1 3.85Å; M141-L229 HydrophobicContact CG-CD1 4.42Å; I143-L229 HydrophobicContact CG2-CB 3.8Å; I143-L229 HydrophobicContact CG2-CD1 4.45Å; G147-L229 CarbonylContact C-O 3.52Å; G147-L229 VanDerWaalsContact CA-O 3.31Å; G147-L229 WeakPolarHBondContact CA-O 3.36Å; R148-L229 PolarHBondContact N-O 2.82Å; R148-L229 PolarHBondContact O-N 2.84Å; M150-L229 HydrophobicContact CG-CD1 3.73Å; M150-L229 HydrophobicContact CG-CD2 4.28Å; M150-L229 HydrophobicContact CG-CG 3.9Å; M150-L229 HydrophobicContact SD-CD1 4.32Å; M150-L229 HydrophobicContact SD-CD2 4.31Å; I173-L229 HydrophobicContact CD1-CD2 3.58Å; L227-L229 HydrophobicContact CD2-CD2 3.59Å; L227-L229 HydrophobicContact CD2-CG 4.32Å; L229-I240 WeakPolarHBondContact CA-O 3.3Å; L229-I240 HydrophobicContact CD2-CB 4.16Å; L229-L242 HydrophobicContact CB-CD1 4.37Å; L229-L242 HydrophobicContact CD1-CD1 4.05Å; L229-L242 HydrophobicContact CD2-CD1 3.94Å; L229-L242 HydrophobicContact CG-CD1 4.35Å; L229-F284 HydrophobicContact CD1-CE2 4.12Å; L229-F284 HydrophobicContact CD1-CZ 4.06Å
230	T	97.3	Very high	95.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.7	-179.6	-173.6	0	0	0	0	111.5	T144 K145 N232 D235 H239 I240 I241 L242	T144-T230 VanDerWaalsContact O-CA 3.27Å; T144-T230 WeakPolarHBondContact O-CA 3.49Å; T144-T230 WeakPolarHBondContact O-CB 3.49Å; T144-T230 PolarHBondContact O-OG1 2.94Å; K145-T230 PolarHBondContact O-OG1 3.31Å; T230-N232 WeakPolarHBondContact OG1-CB 3.07Å; T230-N232 PolarHBondContact OG1-N 2.86Å; T230-D235 HydrophobicContact CG2-CB 3.88Å; T230-H239 HydrophobicContact CG2-CB 3.72Å; T230-I240 PolarHBondContact N-O 3.02Å; T230-I241 HydrophobicContact CG2-CB 4.36Å; T230-I241 HydrophobicContact CG2-CG1 3.79Å; T230-I241 WeakPolarHBondContact O-CA 3.41Å; T230-L242 PolarHBondContact O-N 2.7Å
231	N	95.3	Very high	95.3	Very high	70 Å²	70	52.7 Å²	52.7	37%	0.374	27%	0.272	S	S	.	.			trans	-103.4	7	167	69.7	-35.2	0	0	0	112.3	I143 T144 K145 E233	I143-N231 HydrophobicContact CD1-CB 3.67Å; I143-N231 HydrophobicContact CG1-CB 3.98Å; T144-N231 VanDerWaalsContact C-OD1 3.23Å; K145-N231 PolarHBondContact N-OD1 3.4Å; N231-E233 PolarHBondContact O-N 2.87Å
232	N	94.6	Very high	95.3	Very high	43 Å²	43	50.4 Å²	50.4	23%	0.23	26%	0.258	C	S	.	.			trans	-83.9	105	176.7	-178.6	19.8	0	0	0	109.8	K145 T230 S234 D235 I241	K145-N232 HydrophobicContact CG-CB 4.28Å; T230-N232 WeakPolarHBondContact OG1-CB 3.07Å; T230-N232 PolarHBondContact OG1-N 2.86Å; N232-S234 PolarHBondContact O-N 3.11Å; N232-S234 PolarHBondContact OD1-N 2.65Å; N232-D235 HydrophobicContact CB-CB 4.28Å; N232-D235 WeakPolarHBondContact O-CB 3.42Å; N232-D235 PolarHBondContact O-N 3.35Å; N232-D235 VanDerWaalsContact O-N 3.11Å; N232-I241 WeakPolarHBondContact O-CD1 3.39Å
233	E	91.7	Very high	95.2	Very high	127 Å²	127	51.3 Å²	51.3	59%	0.593	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.6	178.5	-63.4	-176.2	169.6	0	0	113	N231 I241	N231-E233 PolarHBondContact O-N 2.87Å; E233-I241 HydrophobicContact CG-CG2 4.48Å; E233-I241 WeakPolarHBondContact O-CD1 3.41Å
234	S	90.9	Very high	95.2	Very high	94 Å²	94	50.4 Å²	50.4	66%	0.657	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	26.7	178.2	-43.7	0	0	0	0	112.6	N232 E236	N232-S234 PolarHBondContact O-N 3.11Å; N232-S234 PolarHBondContact OD1-N 2.65Å; S234-E236 PolarHBondContact O-N 3.19Å
235	D	92.4	Very high	95.2	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.021	26%	0.264	C	S	.	.			trans	-64.3	122.9	-179.7	175.1	82.2	0	0	0	112.2	R203 T230 N232 H237 G238 H239 I241	R203-D235 VanDerWaalsContact CZ-O 3.31Å; R203-D235 PolarHBondContact NH1-O 3.03Å; R203-D235 VanDerWaalsContact NH1-O 3.1Å; R203-D235 IonicContact NH1-OD2 3.29Å; R203-D235 PolarHBondContact NH1-OD2 3.13Å; R203-D235 PolarHBondContact NH2-O 2.97Å; T230-D235 HydrophobicContact CG2-CB 3.88Å; N232-D235 HydrophobicContact CB-CB 4.28Å; N232-D235 WeakPolarHBondContact O-CB 3.42Å; N232-D235 PolarHBondContact O-N 3.35Å; N232-D235 VanDerWaalsContact O-N 3.11Å; D235-H237 IonicContact OD1-CG 3.65Å; D235-H237 IonicContact OD1-ND1 3.79Å; D235-H237 PolarHBondContact OD1-ND1 3.01Å; D235-H237 VanDerWaalsContact OD1-ND1 3.11Å; D235-H237 PolarHBondContact OD2-N 3.39Å; D235-G238 PolarHBondContact OD2-N 3.21Å; D235-G238 VanDerWaalsContact OD2-N 3.12Å; D235-H239 IonicContact OD1-CE1 2.73Å; D235-H239 IonicContact OD1-CG 3.5Å; D235-H239 IonicContact OD1-ND1 2.86Å; D235-H239 PolarHBondContact OD1-ND1 3.4Å; D235-H239 WeakPolarHBondContact OD2-CB 3.17Å; D235-H239 IonicContact OD2-CG 2.67Å; D235-H239 PolarHBondContact OD2-N 2.79Å; D235-H239 IonicContact OD2-ND1 2.69Å; D235-I241 HydrophobicContact CB-CD1 4.44Å; D235-I241 HydrophobicContact CB-CG1 4.4Å
236	E	92.2	Very high	95.3	Very high	179 Å²	179	47.8 Å²	47.8	84%	0.836	25%	0.247	S	C	*	.	S	Bend	trans	-92.1	-8.6	-179.8	-63.3	176.3	172.4	0	0	113.2	S234 G238	S234-E236 PolarHBondContact O-N 3.19Å; E236-G238 VanDerWaalsContact C-N 3.34Å; E236-G238 PolarHBondContact O-N 3.4Å
237	H	92.2	Very high	95.4	Very high	123 Å²	123	44.2 Å²	44.2	57%	0.569	23%	0.231	S	C	*	.	S	Bend	trans	-86.1	-3.2	-173.5	-52.7	98.3	0	0	0	114	D235 H239	D235-H237 IonicContact OD1-CG 3.65Å; D235-H237 IonicContact OD1-ND1 3.79Å; D235-H237 PolarHBondContact OD1-ND1 3.01Å; D235-H237 VanDerWaalsContact OD1-ND1 3.11Å; D235-H237 PolarHBondContact OD2-N 3.39Å; H237-H239 VanDerWaalsContact CB-CE1 3.48Å; H237-H239 WeakPolarHBondContact CB-CE1 3.33Å; H237-H239 AromaticContact CG-CE1 3.87Å
238	G	91.3	Very high	95.5	Very high	30 Å²	30	44.7 Å²	44.7	31%	0.309	23%	0.233	S	C	.	.			trans	75.8	20.5	-176.1	0	0	0	0	0	114	D235 E236	D235-G238 PolarHBondContact OD2-N 3.21Å; D235-G238 VanDerWaalsContact OD2-N 3.12Å; E236-G238 VanDerWaalsContact C-N 3.34Å; E236-G238 PolarHBondContact O-N 3.4Å
239	H	95.4	Very high	95.5	Very high	27 Å²	27	41.8 Å²	41.8	13%	0.125	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-69.1	154.1	172.9	-58.7	141.9	0	0	0	111.1	S146 R203 K228 T230 D235 H237 I241	S146-H239 PolarHBondContact O-CE1 2.81Å; S146-H239 VanDerWaalsContact O-CE1 3.3Å; R203-H239 WeakPolarHBondContact CD-O 3.43Å; R203-H239 PolarHBondContact NH1-O 2.89Å; K228-H239 HydrophobicContact CB-CB 4.43Å; K228-H239 VanDerWaalsContact CD-NE2 3.29Å; K228-H239 WeakPolarHBondContact CD-NE2 3.36Å; T230-H239 HydrophobicContact CG2-CB 3.72Å; D235-H239 IonicContact OD1-CE1 2.73Å; D235-H239 IonicContact OD1-CG 3.5Å; D235-H239 IonicContact OD1-ND1 2.86Å; D235-H239 PolarHBondContact OD1-ND1 3.4Å; D235-H239 WeakPolarHBondContact OD2-CB 3.17Å; D235-H239 IonicContact OD2-CG 2.67Å; D235-H239 PolarHBondContact OD2-N 2.79Å; D235-H239 IonicContact OD2-ND1 2.69Å; H237-H239 VanDerWaalsContact CB-CE1 3.48Å; H237-H239 WeakPolarHBondContact CB-CE1 3.33Å; H237-H239 AromaticContact CG-CE1 3.87Å; H239-I241 PolarHBondContact O-N 3.43Å
240	I	96.3	Very high	95.5	Very high	6 Å²	6	42 Å²	42	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.6	176.4	-58.9	-175.9	0	0	0	109.1	L171 I173 F205 L227 K228 L229 T230 L242	L171-I240 HydrophobicContact CD2-CD1 4.29Å; I173-I240 HydrophobicContact CB-CG2 4.24Å; I173-I240 HydrophobicContact CD1-CD1 3.84Å; I173-I240 HydrophobicContact CD1-CG2 4.17Å; I173-I240 HydrophobicContact CG1-CD1 3.91Å; I173-I240 HydrophobicContact CG1-CG2 4.42Å; F205-I240 HydrophobicContact CB-CD1 4.14Å; L227-I240 HydrophobicContact CD1-CD1 3.76Å; L227-I240 HydrophobicContact CD2-CD1 4.21Å; L227-I240 HydrophobicContact CG-CD1 4.09Å; K228-I240 PolarHBondContact O-N 2.91Å; L229-I240 WeakPolarHBondContact CA-O 3.3Å; L229-I240 HydrophobicContact CD2-CB 4.16Å; T230-I240 PolarHBondContact N-O 3.02Å; I240-L242 HydrophobicContact CG2-CD2 3.86Å; I240-L242 HydrophobicContact CG2-CG 4.19Å
241	I	96.8	Very high	95.5	Very high	4 Å²	4	43 Å²	43	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.6	-178.1	-54.9	170.9	0	0	0	109.7	T200 R203 T230 N232 E233 D235 H239	T200-I241 HydrophobicContact CG2-CG2 3.66Å; T200-I241 PolarHBondContact OG1-O 2.88Å; R203-I241 VanDerWaalsContact NH2-CD1 3.35Å; T230-I241 HydrophobicContact CG2-CB 4.36Å; T230-I241 HydrophobicContact CG2-CG1 3.79Å; T230-I241 WeakPolarHBondContact O-CA 3.41Å; N232-I241 WeakPolarHBondContact O-CD1 3.39Å; E233-I241 HydrophobicContact CG-CG2 4.48Å; E233-I241 WeakPolarHBondContact O-CD1 3.41Å; D235-I241 HydrophobicContact CB-CD1 4.44Å; D235-I241 HydrophobicContact CB-CG1 4.4Å; H239-I241 PolarHBondContact O-N 3.43Å
242	L	97.2	Very high	95.6	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.208	C	C	.	.			trans	-129.7	150.3	179.7	-55.5	178.1	0	0	0	111.1	I143 I173 L229 T230 I240 Y248 F284 A286	I143-L242 HydrophobicContact CG2-CD1 4.45Å; I173-L242 HydrophobicContact CB-CD2 4.35Å; I173-L242 HydrophobicContact CG2-CD1 4.48Å; I173-L242 HydrophobicContact CG2-CD2 3.9Å; L229-L242 HydrophobicContact CB-CD1 4.37Å; L229-L242 HydrophobicContact CD1-CD1 4.05Å; L229-L242 HydrophobicContact CD2-CD1 3.94Å; L229-L242 HydrophobicContact CG-CD1 4.35Å; T230-L242 PolarHBondContact O-N 2.7Å; I240-L242 HydrophobicContact CG2-CD2 3.86Å; I240-L242 HydrophobicContact CG2-CG 4.19Å; L242-Y248 HydrophobicContact CB-CE2 3.85Å; L242-Y248 HydrophobicContact CD1-CD2 4.18Å; L242-Y248 HydrophobicContact CD1-CE2 4.27Å; L242-Y248 HydrophobicContact CD2-CD1 3.83Å; L242-Y248 HydrophobicContact CD2-CD2 4.34Å; L242-Y248 HydrophobicContact CD2-CE1 3.59Å; L242-Y248 HydrophobicContact CD2-CE2 4.12Å; L242-Y248 HydrophobicContact CD2-CG 4.2Å; L242-Y248 HydrophobicContact CG-CE2 4.31Å; L242-F284 HydrophobicContact CD1-CE2 3.87Å; L242-F284 HydrophobicContact CD1-CZ 3.73Å; L242-A286 HydrophobicContact CB-CB 4.29Å; L242-A286 HydrophobicContact CD1-CB 4.32Å
243	N	96.9	Very high	95.7	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.102	20%	0.198	C	C	.	.			trans	-83.2	134.3	170.3	-69.9	-23.5	0	0	0	110.1	Q198 T200 H246 Y248	Q198-N243 PolarHBondContact O-ND2 3.39Å; T200-N243 VanDerWaalsContact CG2-OD1 3.22Å; T200-N243 WeakPolarHBondContact CG2-OD1 3.42Å; N243-H246 WeakPolarHBondContact CB-ND1 3.36Å; N243-Y248 PolarHBondContact N-OH 3.13Å
244	S	97.4	Very high	95.8	Very high	28 Å²	28	31.8 Å²	31.8	20%	0.196	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	150.2	173.5	-166.5	0	0	0	0	110.5	H246 A286 T288	S244-H246 VanDerWaalsContact C-N 3.27Å; S244-H246 PolarHBondContact O-CE1 2.95Å; S244-H246 PolarHBondContact O-N 2.8Å; S244-H246 PolarHBondContact O-ND1 3.47Å; S244-A286 CarbonylContact C-O 3.51Å; S244-T288 PolarHBondContact OG-N 3.25Å
245	M	97.7	Very high	95.9	Very high	30 Å²	30	27.4 Å²	27.4	15%	0.148	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	25.3	177.9	-41.7	-53.3	-77	0	0	114.8	R180 Y181 W190 A286 V287 Q291	R180-M245 HydrophobicContact CG-CB 4.46Å; Y181-M245 WeakPolarHBondContact CB-O 3.46Å; Y181-M245 PolarHBondContact N-O 2.68Å; Y181-M245 WeakPolarHBondContact O-CB 3.31Å; W190-M245 HydrophobicContact CH2-CE 3.84Å; W190-M245 HydrophobicContact CZ3-CE 3.58Å; M245-A286 WeakPolarHBondContact CA-O 3.44Å; M245-A286 PolarHBondContact N-O 2.79Å; M245-V287 HydrophobicContact SD-CG1 4.05Å; M245-Q291 HydrophobicContact CE-CG 4.27Å
246	H	98.1	Very high	95.8	Very high	9 Å²	9	28.4 Å²	28.4	4%	0.042	14%	0.143	C	C	.	.			trans	-117	152.3	174.6	-66.3	73.5	0	0	0	110.5	K179 A196 D197 N243 S244 Y248 T285 A286	K179-H246 PolarHBondContact O-CD2 2.99Å; A196-H246 WeakPolarHBondContact CA-NE2 3.41Å; D197-H246 PolarHBondContact N-NE2 3.26Å; D197-H246 IonicContact OD2-CE1 3.96Å; D197-H246 PolarHBondContact OD2-CE1 3.27Å; N243-H246 WeakPolarHBondContact CB-ND1 3.36Å; S244-H246 VanDerWaalsContact C-N 3.27Å; S244-H246 PolarHBondContact O-CE1 2.95Å; S244-H246 PolarHBondContact O-N 2.8Å; S244-H246 PolarHBondContact O-ND1 3.47Å; H246-Y248 HydrophobicContact CB-CE2 3.68Å; H246-Y248 WeakPolarHBondContact O-CD2 3.4Å; H246-T285 WeakPolarHBondContact O-CA 3.35Å; H246-A286 PolarHBondContact O-N 3.34Å
247	K	98.2	Very high	95.5	Very high	57 Å²	57	21.1 Å²	21.1	25%	0.248	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.4	178.3	-69.9	-176	-177.2	178.2	0	111.2	L176 Y181 F284	L176-K247 HydrophobicContact CB-CB 3.85Å; L176-K247 HydrophobicContact CD2-CB 4.02Å; L176-K247 HydrophobicContact CD2-CD 4.13Å; L176-K247 PolarHBondContact N-O 2.9Å; Y181-K247 HydrophobicContact CD2-CD 4.28Å; Y181-K247 HydrophobicContact CD2-CG 3.96Å; Y181-K247 HydrophobicContact CE1-CD 4.32Å; Y181-K247 HydrophobicContact CE2-CB 4.24Å; Y181-K247 HydrophobicContact CE2-CD 3.57Å; Y181-K247 HydrophobicContact CE2-CG 3.61Å; Y181-K247 WeakPolarHBondContact OH-CD 2.97Å; Y181-K247 PolarHBondContact OH-NZ 3.17Å; K247-F284 CarbonylContact C-O 3.57Å; K247-F284 WeakPolarHBondContact CA-O 3.3Å
248	Y	98.3	Very high	94.8	Very high	11 Å²	11	18.1 Å²	18.1	4%	0.043	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.8	-173.8	-69.1	-76.5	0	0	0	112.4	I173 V174 P175 L242 N243 H246 Q283 F284 A286	I173-Y248 HydrophobicContact CG2-CD1 3.78Å; I173-Y248 HydrophobicContact CG2-CG 3.86Å; V174-Y248 CarbonylContact O-C 3.48Å; V174-Y248 WeakPolarHBondContact O-CA 3.29Å; P175-Y248 HydrophobicContact CB-CD1 4.49Å; P175-Y248 HydrophobicContact CB-CE1 4.29Å; L242-Y248 HydrophobicContact CB-CE2 3.85Å; L242-Y248 HydrophobicContact CD1-CD2 4.18Å; L242-Y248 HydrophobicContact CD1-CE2 4.27Å; L242-Y248 HydrophobicContact CD2-CD1 3.83Å; L242-Y248 HydrophobicContact CD2-CD2 4.34Å; L242-Y248 HydrophobicContact CD2-CE1 3.59Å; L242-Y248 HydrophobicContact CD2-CE2 4.12Å; L242-Y248 HydrophobicContact CD2-CG 4.2Å; L242-Y248 HydrophobicContact CG-CE2 4.31Å; N243-Y248 PolarHBondContact N-OH 3.13Å; H246-Y248 HydrophobicContact CB-CE2 3.68Å; H246-Y248 WeakPolarHBondContact O-CD2 3.4Å; Y248-Q283 VanDerWaalsContact O-CA 3.31Å; Y248-Q283 WeakPolarHBondContact O-CA 3.46Å; Y248-F284 HydrophobicContact CD2-CE2 4.08Å; Y248-F284 HydrophobicContact CD2-CZ 4.36Å; Y248-F284 HydrophobicContact CG-CE2 4.47Å; Y248-F284 HydrophobicContact CG-CZ 4.32Å; Y248-F284 PolarHBondContact N-O 3.41Å; Y248-F284 PolarHBondContact O-N 3.11Å; Y248-F284 VanDerWaalsContact O-N 3.11Å; Y248-A286 HydrophobicContact CD2-CB 3.91Å; Y248-A286 HydrophobicContact CE2-CB 3.72Å
249	Q	98.1	Very high	94	Very high	13 Å²	13	25.2 Å²	25.2	6%	0.061	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	112.6	172.9	174.4	66.1	73.9	0	0	109.1	V174 L176 R251 V278 F279 T282 Q283	V174-Q249 HydrophobicContact CG2-CB 4.06Å; V174-Q249 WeakPolarHBondContact CG2-O 3.46Å; V174-Q249 PolarHBondContact N-O 3.41Å; V174-Q249 PolarHBondContact O-N 3.07Å; L176-Q249 HydrophobicContact CD1-CB 4.36Å; Q249-R251 HydrophobicContact CG-CG 4.19Å; Q249-V278 VanDerWaalsContact CD-CG1 3.47Å; Q249-V278 HydrophobicContact CG-CG1 3.74Å; Q249-F279 PolarHBondContact NE2-O 3.45Å; Q249-T282 PolarHBondContact NE2-OG1 3.03Å; Q249-Q283 HydrophobicContact CB-CG 4.39Å
250	P	98	Very high	92.8	Very high	4 Å²	4	28 Å²	28	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	141.2	164.7	-20.3	32.1	0	0	0	111.5	M150 I154 D172 T282 F284	M150-P250 HydrophobicContact CE-CG 4.36Å; I154-P250 HydrophobicContact CD1-CB 3.57Å; I154-P250 HydrophobicContact CD1-CG 3.83Å; D172-P250 WeakPolarHBondContact O-CA 3.3Å; P250-T282 WeakPolarHBondContact CD-O 3.33Å; P250-F284 HydrophobicContact CG-CD1 4.13Å; P250-F284 HydrophobicContact CG-CE1 3.86Å
251	R	97.5	Very high	91.3	Very high	22 Å²	22	29.3 Å²	29.3	8%	0.083	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.9	172.4	-48.4	-176.6	-61.2	171.3	-0.5	110.2	L110 L171 D172 V174 Q249 T276 V278	L110-R251 VanDerWaalsContact O-CZ 3.28Å; L110-R251 PolarHBondContact O-NH1 2.69Å; L110-R251 PolarHBondContact O-NH2 2.97Å; L171-R251 VanDerWaalsContact CA-O 3.32Å; L171-R251 WeakPolarHBondContact CA-O 3.22Å; D172-R251 VanDerWaalsContact CG-NH2 3.34Å; D172-R251 PolarHBondContact N-O 3.01Å; D172-R251 PolarHBondContact O-N 2.67Å; D172-R251 WeakPolarHBondContact OD1-CB 3.46Å; D172-R251 IonicContact OD1-CZ 3.78Å; D172-R251 IonicContact OD1-NE 3.13Å; D172-R251 PolarHBondContact OD1-NE 2.84Å; D172-R251 IonicContact OD1-NH2 3.32Å; D172-R251 PolarHBondContact OD1-NH2 2.88Å; D172-R251 IonicContact OD2-CZ 3.7Å; D172-R251 IonicContact OD2-NE 3.35Å; D172-R251 IonicContact OD2-NH2 2.87Å; D172-R251 PolarHBondContact OD2-NH2 2.69Å; V174-R251 HydrophobicContact CG2-CG 4.29Å; Q249-R251 HydrophobicContact CG-CG 4.19Å; R251-T276 HydrophobicContact CB-CG2 4.07Å; R251-V278 HydrophobicContact CB-CG2 4.34Å; R251-V278 HydrophobicContact CG-CG2 3.99Å
252	I	97.2	Very high	89.9	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.015	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133	178.7	-63.4	169	0	0	0	107.9	I154 V156 F158 I169 L170 L171 F224 T276 F277 F279	I154-I252 HydrophobicContact CG2-CD1 3.91Å; V156-I252 HydrophobicContact CB-CD1 4.31Å; V156-I252 HydrophobicContact CG1-CD1 3.38Å; V156-I252 HydrophobicContact CG2-CD1 4Å; F158-I252 HydrophobicContact CZ-CG2 4.15Å; I169-I252 HydrophobicContact CG2-CG2 4.09Å; L170-I252 WeakPolarHBondContact O-CA 3.15Å; L171-I252 HydrophobicContact CD1-CG1 4.13Å; L171-I252 HydrophobicContact CG-CG1 4.49Å; F224-I252 HydrophobicContact CE2-CD1 3.98Å; F224-I252 HydrophobicContact CE2-CG1 4.12Å; F224-I252 HydrophobicContact CZ-CG1 4.37Å; F224-I252 HydrophobicContact CZ-CG2 4.38Å; I252-T276 CarbonylContact O-C 3.59Å; I252-T276 WeakPolarHBondContact O-CA 3.37Å; I252-F277 HydrophobicContact CB-CB 4.42Å; I252-F277 HydrophobicContact CG2-CD2 4.49Å; I252-F277 PolarHBondContact N-O 3.3Å; I252-F277 PolarHBondContact O-N 3.15Å; I252-F279 HydrophobicContact CD1-CE2 4.19Å
253	H	95.3	Very high	88.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.9	-179.2	-53.5	-88.7	0	0	0	109.9	I169 L170 D172 F255 Y274 K275 T276	I169-H253 WeakPolarHBondContact CA-O 3.43Å; L170-H253 HydrophobicContact CD1-CB 3.7Å; L170-H253 HydrophobicContact CG-CB 4.03Å; L170-H253 PolarHBondContact N-O 3.13Å; L170-H253 PolarHBondContact O-N 3.41Å; D172-H253 VanDerWaalsContact CG-NE2 3.3Å; D172-H253 IonicContact OD1-NE2 3.67Å; D172-H253 PolarHBondContact OD1-NE2 3.49Å; D172-H253 VanDerWaalsContact OD1-NE2 3.13Å; D172-H253 IonicContact OD2-NE2 2.87Å; H253-F255 HydrophobicContact CB-CE2 3.77Å; H253-Y274 HydrophobicContact CB-CD2 4.34Å; H253-Y274 AromaticContact ND1-CD2 3.66Å; H253-Y274 AromaticContact ND1-CE2 3.59Å; H253-K275 WeakPolarHBondContact CA-O 3.13Å; H253-T276 VanDerWaalsContact CE1-CG2 3.45Å; H253-T276 WeakPolarHBondContact CE1-CG2 3.39Å; H253-T276 PolarHBondContact ND1-OG1 2.94Å; H253-T276 VanDerWaalsContact ND1-OG1 3.07Å
254	M	94.4	Very high	87.9	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.8	176.2	173.9	-176.2	-83.5	0	0	109.5	M118 I121 F158 Y167 V168 I169 L217 Y274 K275 F277	M118-M254 WeakPolarHBondContact CE-O 3.33Å; M118-M254 HydrophobicContact SD-CG 3.84Å; M118-M254 HydrophobicContact SD-SD 3.86Å; I121-M254 HydrophobicContact CD1-SD 3.66Å; I121-M254 HydrophobicContact CG2-CE 4.01Å; I121-M254 HydrophobicContact CG2-SD 3.88Å; F158-M254 HydrophobicContact CB-CE 4.47Å; F158-M254 HydrophobicContact CD1-CE 3.39Å; F158-M254 HydrophobicContact CD2-CE 4.49Å; F158-M254 HydrophobicContact CE1-CE 3.58Å; F158-M254 HydrophobicContact CG-CE 3.88Å; F158-M254 HydrophobicContact CZ-CE 4.22Å; Y167-M254 HydrophobicContact CD1-CE 4.4Å; Y167-M254 HydrophobicContact CD1-CG 3.69Å; Y167-M254 HydrophobicContact CD1-SD 3.7Å; Y167-M254 HydrophobicContact CE1-CG 4.45Å; Y167-M254 HydrophobicContact CE1-SD 4Å; Y167-M254 HydrophobicContact CG-CG 4.39Å; Y167-M254 HydrophobicContact CG-SD 4.43Å; V168-M254 WeakPolarHBondContact O-CA 3.4Å; I169-M254 HydrophobicContact CD1-CB 3.81Å; I169-M254 HydrophobicContact CD1-CE 3.61Å; I169-M254 HydrophobicContact CD1-CG 3.77Å; L217-M254 HydrophobicContact CD1-CE 3.77Å; M254-Y274 CarbonylContact O-C 3.56Å; M254-Y274 WeakPolarHBondContact O-CA 3.37Å; M254-Y274 WeakPolarHBondContact O-CB 3.45Å; M254-K275 PolarHBondContact N-O 2.78Å; M254-K275 PolarHBondContact O-N 3.44Å; M254-F277 HydrophobicContact CB-CE2 3.97Å
255	F	92.5	Very high	87.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.2	175.2	-62.5	-107.5	0	0	0	108.9	L110 Y167 V168 L170 H253 L268 L269 Y274	L110-F255 HydrophobicContact CD2-CZ 4.3Å; Y167-F255 CarbonylContact C-O 3.58Å; Y167-F255 WeakPolarHBondContact CA-O 3.37Å; V168-F255 HydrophobicContact CB-CB 4.3Å; V168-F255 PolarHBondContact N-O 3.15Å; V168-F255 PolarHBondContact O-N 3.33Å; L170-F255 HydrophobicContact CD1-CE2 4.43Å; L170-F255 HydrophobicContact CD2-CD2 4.13Å; L170-F255 HydrophobicContact CD2-CE2 3.52Å; L170-F255 HydrophobicContact CD2-CZ 4.24Å; L170-F255 HydrophobicContact CG-CD2 4.49Å; L170-F255 HydrophobicContact CG-CE2 3.91Å; H253-F255 HydrophobicContact CB-CE2 3.77Å; F255-L268 HydrophobicContact CB-CD1 4.37Å; F255-L268 HydrophobicContact CD1-CB 3.8Å; F255-L268 HydrophobicContact CE1-CB 4.23Å; F255-L268 WeakPolarHBondContact CE1-O 3.37Å; F255-L268 HydrophobicContact CG-CB 4.39Å; F255-L269 HydrophobicContact CE1-CD2 4.41Å; F255-L269 HydrophobicContact CZ-CD2 3.85Å; F255-Y274 HydrophobicContact CD1-CD1 4.15Å; F255-Y274 HydrophobicContact CD1-CG 4.32Å; F255-Y274 AromaticContact CE1-CD1 3.29Å; F255-Y274 HydrophobicContact CE1-CD1 3.29Å; F255-Y274 HydrophobicContact CE1-CE1 4.2Å; F255-Y274 AromaticContact CE1-CG 3.7Å; F255-Y274 HydrophobicContact CE1-CG 3.7Å; F255-Y274 HydrophobicContact CE2-CD1 4.43Å; F255-Y274 HydrophobicContact CE2-CG 4.13Å; F255-Y274 AromaticContact CZ-CD1 3.44Å; F255-Y274 HydrophobicContact CZ-CD1 3.44Å; F255-Y274 VanDerWaalsContact CZ-CD1 3.44Å; F255-Y274 HydrophobicContact CZ-CD2 4.37Å; F255-Y274 HydrophobicContact CZ-CE1 4.18Å; F255-Y274 AromaticContact CZ-CG 3.56Å; F255-Y274 HydrophobicContact CZ-CG 3.56Å
256	E	90.9	Very high	86.4	Confident	25 Å²	25	40.2 Å²	40.2	12%	0.117	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.1	166.7	-75	174.5	170.2	0	0	108.9	K115 T117 M118 I165 Y167	K115-E256 WeakPolarHBondContact CE-OE2 3.37Å; K115-E256 IonicContact NZ-OE2 3.83Å; K115-E256 PolarHBondContact NZ-OE2 3.29Å; T117-E256 PolarHBondContact OG1-OE2 3.18Å; M118-E256 HydrophobicContact CE-CG 4.3Å; M118-E256 HydrophobicContact CG-CG 4.06Å; M118-E256 WeakPolarHBondContact CG-OE1 3.33Å; M118-E256 HydrophobicContact SD-CG 3.81Å; I165-E256 HydrophobicContact CG2-CB 4.15Å; I165-E256 HydrophobicContact CG2-CG 3.97Å; Y167-E256 HydrophobicContact CD1-CG 3.84Å; Y167-E256 HydrophobicContact CE1-CG 3.4Å; Y167-E256 VanDerWaalsContact CE1-CG 3.4Å
257	L	86.8	Confident	85.5	Confident	27 Å²	27	42.5 Å²	42.5	14%	0.141	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-81.9	123.6	174.1	-171.4	67.3	0	0	0	109.1	K166 P211 L268	K166-L257 HydrophobicContact CB-CB 4.15Å; K166-L257 HydrophobicContact CB-CD2 4.3Å; K166-L257 WeakPolarHBondContact O-CB 3.36Å; K166-L257 PolarHBondContact O-N 3.31Å; P211-L257 HydrophobicContact CB-CD2 4.48Å; P211-L257 HydrophobicContact CG-CD2 4.48Å; L257-L268 HydrophobicContact CD1-CD1 4.44Å; L257-L268 HydrophobicContact CD1-CD2 4.5Å
258	P	77.3	Confident	84.8	Confident	59 Å²	59	40 Å²	40	38%	0.383	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-59.6	143.6	176.9	-21.7	32.2	0	0	0	111.6	G260 G261	P258-G260 PolarHBondContact O-N 3.09Å; P258-G260 VanDerWaalsContact O-N 3.17Å; P258-G261 PolarHBondContact O-N 2.72Å
259	I	73.4	Confident	84	Confident	179 Å²	179	40.9 Å²	40.9	92%	0.918	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	118.8	174.8	-58.5	172.4	0	0	0	108.2	G261	I259-G261 PolarHBondContact O-N 3.33Å
260	G	70.7	Confident	83	Confident	87 Å²	87	49.7 Å²	49.7	90%	0.897	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	0.7	-174.5	0	0	0	0	0	115.2	P258	P258-G260 PolarHBondContact O-N 3.09Å; P258-G260 VanDerWaalsContact O-N 3.17Å
261	G	65.1	Low	82.1	Confident	32 Å²	32	54 Å²	54	33%	0.33	31%	0.314	S	S	.	.			trans	-75.8	152.7	177.5	0	0	0	0	0	112.9	P258 I259	P258-G261 PolarHBondContact O-N 2.72Å; I259-G261 PolarHBondContact O-N 3.33Å
262	T	67.4	Low	81.2	Confident	97 Å²	97	60 Å²	60	60%	0.595	34%	0.341	S	S	*	.			trans	-68.5	134.3	170.3	53.4	0	0	0	0	109.7	D264	T262-D264 PolarHBondContact O-N 3.45Å
263	G	69.8	Low	80.6	Confident	49 Å²	49	64.6 Å²	64.6	51%	0.505	36%	0.362	S	S	.	.			trans	-70.1	26.6	167.5	0	0	0	0	0	113.8	I265	G263-I265 PolarHBondContact O-N 2.85Å
264	D	82.2	Confident	80.3	Confident	65 Å²	65	64.9 Å²	64.9	35%	0.348	36%	0.364	S	S	.	.			trans	-70.6	114.5	178.8	-169.4	-13.2	0	0	0	109	T262 D266 V267 L268	T262-D264 PolarHBondContact O-N 3.45Å; D264-D266 PolarHBondContact O-N 3.43Å; D264-D266 PolarHBondContact OD1-N 2.78Å; D264-D266 VanDerWaalsContact OD1-N 3.1Å; D264-V267 HydrophobicContact CB-CB 4.23Å; D264-V267 HydrophobicContact CB-CG2 3.86Å; D264-V267 PolarHBondContact O-N 2.84Å; D264-L268 WeakPolarHBondContact O-CG 3.32Å; D264-L268 PolarHBondContact O-N 3.21Å; D264-L268 VanDerWaalsContact O-N 3.11Å
265	I	82	Confident	80.3	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.185	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-36.6	-174.4	-58.7	172.4	0	0	0	109.6	I204 V206 G263 V267 L268 L269	I204-I265 HydrophobicContact CD1-CG2 3.77Å; V206-I265 HydrophobicContact CB-CD1 4.1Å; V206-I265 HydrophobicContact CG1-CD1 3.99Å; V206-I265 HydrophobicContact CG2-CD1 3.61Å; V206-I265 HydrophobicContact CG2-CG1 4.5Å; V206-I265 HydrophobicContact CG2-CG2 4.17Å; G263-I265 PolarHBondContact O-N 2.85Å; I265-V267 VanDerWaalsContact C-N 3.34Å; I265-V267 PolarHBondContact O-N 3.41Å; I265-L268 PolarHBondContact O-N 3.04Å; I265-L269 HydrophobicContact CG2-CD1 3.9Å; I265-L269 HydrophobicContact CG2-CG 4.15Å; I265-L269 WeakPolarHBondContact O-CG 3.49Å; I265-L269 PolarHBondContact O-N 2.61Å
266	D	80.9	Confident	80.4	Confident	68 Å²	68	67.1 Å²	67.1	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-47.3	179.1	-70.8	-28	0	0	0	109.7	D264 L268 L269 W270	D264-D266 PolarHBondContact O-N 3.43Å; D264-D266 PolarHBondContact OD1-N 2.78Å; D264-D266 VanDerWaalsContact OD1-N 3.1Å; D266-L268 VanDerWaalsContact C-N 3.33Å; D266-L268 PolarHBondContact O-N 3.34Å; D266-L269 PolarHBondContact O-N 2.84Å; D266-W270 PolarHBondContact O-N 3.28Å
267	V	80.7	Confident	80.7	Confident	56 Å²	56	66.9 Å²	66.9	34%	0.339	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-44.8	177	180	0	0	0	0	111.5	D264 I265 L269 W270 Q271	D264-V267 HydrophobicContact CB-CB 4.23Å; D264-V267 HydrophobicContact CB-CG2 3.86Å; D264-V267 PolarHBondContact O-N 2.84Å; I265-V267 VanDerWaalsContact C-N 3.34Å; I265-V267 PolarHBondContact O-N 3.41Å; V267-L269 PolarHBondContact O-N 3.11Å; V267-W270 PolarHBondContact O-N 3.35Å; V267-Q271 WeakPolarHBondContact O-CG 3.32Å; V267-Q271 PolarHBondContact O-N 3.49Å
268	L	81.9	Confident	81.2	Confident	6 Å²	6	68.7 Å²	68.7	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-43.7	177.4	-68.4	175.2	0	0	0	112.2	V168 F255 L257 D264 I265 D266 W270 Q271 K272	V168-L268 HydrophobicContact CB-CD1 4.2Å; V168-L268 HydrophobicContact CG2-CD1 3.85Å; F255-L268 HydrophobicContact CB-CD1 4.37Å; F255-L268 HydrophobicContact CD1-CB 3.8Å; F255-L268 HydrophobicContact CE1-CB 4.23Å; F255-L268 WeakPolarHBondContact CE1-O 3.37Å; F255-L268 HydrophobicContact CG-CB 4.39Å; L257-L268 HydrophobicContact CD1-CD1 4.44Å; L257-L268 HydrophobicContact CD1-CD2 4.5Å; D264-L268 WeakPolarHBondContact O-CG 3.32Å; D264-L268 PolarHBondContact O-N 3.21Å; D264-L268 VanDerWaalsContact O-N 3.11Å; I265-L268 PolarHBondContact O-N 3.04Å; D266-L268 VanDerWaalsContact C-N 3.33Å; D266-L268 PolarHBondContact O-N 3.34Å; L268-W270 VanDerWaalsContact C-N 3.31Å; L268-W270 PolarHBondContact O-N 3.28Å; L268-Q271 PolarHBondContact O-N 2.97Å; L268-K272 PolarHBondContact O-N 3.2Å
269	L	81.2	Confident	82.2	Confident	29 Å²	29	67.4 Å²	67.4	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-36.8	177.2	-64.8	168.6	0	0	0	111.6	L110 L170 I204 F255 I265 D266 V267 K272	L110-L269 HydrophobicContact CD1-CD2 3.93Å; L110-L269 HydrophobicContact CD2-CD2 3.57Å; L110-L269 HydrophobicContact CG-CD2 4.15Å; L170-L269 HydrophobicContact CD2-CD2 4.32Å; I204-L269 HydrophobicContact CD1-CD1 3.72Å; I204-L269 HydrophobicContact CD1-CD2 4.25Å; F255-L269 HydrophobicContact CE1-CD2 4.41Å; F255-L269 HydrophobicContact CZ-CD2 3.85Å; I265-L269 HydrophobicContact CG2-CD1 3.9Å; I265-L269 HydrophobicContact CG2-CG 4.15Å; I265-L269 WeakPolarHBondContact O-CG 3.49Å; I265-L269 PolarHBondContact O-N 2.61Å; D266-L269 PolarHBondContact O-N 2.84Å; V267-L269 PolarHBondContact O-N 3.11Å; L269-K272 PolarHBondContact O-N 2.82Å
270	W	78.3	Confident	83.3	Confident	197 Å²	197	62.1 Å²	62.1	75%	0.746	35%	0.352	S	S	*	.	H	α-helix	trans	-65.9	-39.3	176.9	-83.3	109.1	0	0	0	112.8	D266 V267 L268 K272	D266-W270 PolarHBondContact O-N 3.28Å; V267-W270 PolarHBondContact O-N 3.35Å; L268-W270 VanDerWaalsContact C-N 3.31Å; L268-W270 PolarHBondContact O-N 3.28Å; W270-K272 PolarHBondContact O-N 3.09Å
271	Q	78.6	Confident	84.6	Confident	95 Å²	95	58.8 Å²	58.8	44%	0.444	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-25.4	178.4	-73.4	174.5	-11.9	0	0	113	V267 L268 E273	V267-Q271 WeakPolarHBondContact O-CG 3.32Å; V267-Q271 PolarHBondContact O-N 3.49Å; L268-Q271 PolarHBondContact O-N 2.97Å; Q271-E273 HydrophobicContact CB-CG 4.48Å; Q271-E273 PolarHBondContact O-N 3.23Å; Q271-E273 VanDerWaalsContact O-N 3.08Å
272	K	78.4	Confident	86.2	Confident	147 Å²	147	57.4 Å²	57.4	64%	0.639	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	20	-177.3	-59.8	-178.8	-178.4	177.6	0	115.1	L268 L269 W270 Y274	L268-K272 PolarHBondContact O-N 3.2Å; L269-K272 PolarHBondContact O-N 2.82Å; W270-K272 PolarHBondContact O-N 3.09Å; K272-Y274 HydrophobicContact CB-CE1 4.18Å; K272-Y274 PolarHBondContact O-N 2.84Å
273	E	84.9	Confident	87.7	Confident	100 Å²	100	55.3 Å²	55.3	47%	0.467	28%	0.281	S	S	.	.			trans	-92.5	73.2	176.9	-64.8	-162.8	167	0	0	111.2	K115 Q271	K115-E273 HydrophobicContact CD-CB 4.08Å; K115-E273 WeakPolarHBondContact CE-OE2 3.14Å; K115-E273 HydrophobicContact CG-CB 4.39Å; K115-E273 IonicContact NZ-OE2 3.11Å; K115-E273 PolarHBondContact NZ-OE2 3.1Å; Q271-E273 HydrophobicContact CB-CG 4.48Å; Q271-E273 PolarHBondContact O-N 3.23Å; Q271-E273 VanDerWaalsContact O-N 3.08Å
274	Y	89.6	Confident	89.1	Confident	6 Å²	6	53.2 Å²	53.2	2%	0.024	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	167	176.5	52.9	-86.3	0	0	0	112	L110 G111 G113 N114 K115 H253 M254 F255 K272 T276	L110-Y274 HydrophobicContact CB-CE2 4.39Å; L110-Y274 HydrophobicContact CD2-CD1 4.35Å; L110-Y274 HydrophobicContact CD2-CE1 3.55Å; L110-Y274 HydrophobicContact CD2-CE2 4.14Å; L110-Y274 VanDerWaalsContact CD2-CZ 3.45Å; L110-Y274 WeakPolarHBondContact CD2-OH 3.17Å; G111-Y274 WeakPolarHBondContact CA-OH 3.38Å; G111-Y274 PolarHBondContact N-OH 3.47Å; G111-Y274 WeakPolarHBondContact O-CE2 3.49Å; G111-Y274 PolarHBondContact O-OH 2.89Å; G111-Y274 VanDerWaalsContact O-OH 3.14Å; G113-Y274 CarbonylContact C-O 3.54Å; G113-Y274 VanDerWaalsContact CA-O 3.3Å; G113-Y274 WeakPolarHBondContact CA-O 3.36Å; N114-Y274 PolarHBondContact N-O 3.17Å; K115-Y274 PolarHBondContact N-O 3.44Å; K115-Y274 VanDerWaalsContact N-O 3.14Å; H253-Y274 HydrophobicContact CB-CD2 4.34Å; H253-Y274 AromaticContact ND1-CD2 3.66Å; H253-Y274 AromaticContact ND1-CE2 3.59Å; M254-Y274 CarbonylContact O-C 3.56Å; M254-Y274 WeakPolarHBondContact O-CA 3.37Å; M254-Y274 WeakPolarHBondContact O-CB 3.45Å; F255-Y274 HydrophobicContact CD1-CD1 4.15Å; F255-Y274 HydrophobicContact CD1-CG 4.32Å; F255-Y274 AromaticContact CE1-CD1 3.29Å; F255-Y274 HydrophobicContact CE1-CD1 3.29Å; F255-Y274 HydrophobicContact CE1-CE1 4.2Å; F255-Y274 AromaticContact CE1-CG 3.7Å; F255-Y274 HydrophobicContact CE1-CG 3.7Å; F255-Y274 HydrophobicContact CE2-CD1 4.43Å; F255-Y274 HydrophobicContact CE2-CG 4.13Å; F255-Y274 AromaticContact CZ-CD1 3.44Å; F255-Y274 HydrophobicContact CZ-CD1 3.44Å; F255-Y274 VanDerWaalsContact CZ-CD1 3.44Å; F255-Y274 HydrophobicContact CZ-CD2 4.37Å; F255-Y274 HydrophobicContact CZ-CE1 4.18Å; F255-Y274 AromaticContact CZ-CG 3.56Å; F255-Y274 HydrophobicContact CZ-CG 3.56Å; K272-Y274 HydrophobicContact CB-CE1 4.18Å; K272-Y274 PolarHBondContact O-N 2.84Å; Y274-T276 WeakPolarHBondContact CD2-OG1 3.49Å; Y274-T276 WeakPolarHBondContact CE2-OG1 3.29Å
275	K	93.5	Very high	89.9	Confident	31 Å²	31	50.3 Å²	50.3	14%	0.135	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.4	166.3	-173.6	167	-173.6	178.8	0	109.4	G113 M118 K119 I121 H253 M254 F277	G113-K275 WeakPolarHBondContact O-CA 3.42Å; M118-K275 HydrophobicContact CB-CB 4.13Å; M118-K275 HydrophobicContact CB-CD 3.95Å; M118-K275 HydrophobicContact CE-CB 4.06Å; M118-K275 WeakPolarHBondContact O-CD 3.4Å; M118-K275 WeakPolarHBondContact O-CE 3.34Å; M118-K275 PolarHBondContact O-NZ 3.29Å; M118-K275 HydrophobicContact SD-CB 4.17Å; K119-K275 PolarHBondContact O-NZ 2.93Å; I121-K275 PolarHBondContact O-NZ 3.32Å; H253-K275 WeakPolarHBondContact CA-O 3.13Å; M254-K275 PolarHBondContact N-O 2.78Å; M254-K275 PolarHBondContact O-N 3.44Å; K275-F277 HydrophobicContact CB-CE2 4.4Å; K275-F277 HydrophobicContact CB-CZ 4.43Å; K275-F277 HydrophobicContact CD-CE1 3.93Å; K275-F277 HydrophobicContact CD-CE2 4.39Å; K275-F277 HydrophobicContact CD-CZ 3.64Å; K275-F277 HydrophobicContact CG-CE1 4.19Å; K275-F277 HydrophobicContact CG-CE2 4.13Å; K275-F277 HydrophobicContact CG-CZ 3.83Å
276	T	95	Very high	90.7	Very high	19 Å²	19	48.6 Å²	48.6	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	131	179.7	-52.1	0	0	0	0	110.9	G113 R251 I252 H253 Y274 V278	G113-T276 PolarHBondContact N-OG1 2.84Å; G113-T276 PolarHBondContact O-N 3.5Å; R251-T276 HydrophobicContact CB-CG2 4.07Å; I252-T276 CarbonylContact O-C 3.59Å; I252-T276 WeakPolarHBondContact O-CA 3.37Å; H253-T276 VanDerWaalsContact CE1-CG2 3.45Å; H253-T276 WeakPolarHBondContact CE1-CG2 3.39Å; H253-T276 PolarHBondContact ND1-OG1 2.94Å; H253-T276 VanDerWaalsContact ND1-OG1 3.07Å; Y274-T276 WeakPolarHBondContact CD2-OG1 3.49Å; Y274-T276 WeakPolarHBondContact CE2-OG1 3.29Å; T276-V278 HydrophobicContact CG2-CG2 4.01Å
277	F	96.4	Very high	91.5	Very high	20 Å²	20	45.4 Å²	45.4	9%	0.088	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.9	175.2	-53.3	-84.5	0	0	0	109.2	I121 C123 F158 I252 M254 K275 F279	I121-F277 HydrophobicContact CG2-CZ 4.12Å; C123-F277 HydrophobicContact CB-CB 3.99Å; C123-F277 HydrophobicContact CB-CD1 3.26Å; C123-F277 HydrophobicContact CB-CD2 3.94Å; C123-F277 HydrophobicContact CB-CE1 3.55Å; C123-F277 HydrophobicContact CB-CE2 4.19Å; C123-F277 HydrophobicContact CB-CG 3.45Å; C123-F277 VanDerWaalsContact CB-CG 3.45Å; C123-F277 HydrophobicContact CB-CZ 4Å; F158-F277 HydrophobicContact CD1-CE2 4.35Å; F158-F277 HydrophobicContact CD1-CZ 4.46Å; F158-F277 HydrophobicContact CE1-CD2 4.08Å; F158-F277 AromaticContact CE1-CE2 3.76Å; F158-F277 HydrophobicContact CE1-CE2 3.76Å; F158-F277 HydrophobicContact CE1-CZ 4.29Å; I252-F277 HydrophobicContact CB-CB 4.42Å; I252-F277 HydrophobicContact CG2-CD2 4.49Å; I252-F277 PolarHBondContact N-O 3.3Å; I252-F277 PolarHBondContact O-N 3.15Å; M254-F277 HydrophobicContact CB-CE2 3.97Å; K275-F277 HydrophobicContact CB-CE2 4.4Å; K275-F277 HydrophobicContact CB-CZ 4.43Å; K275-F277 HydrophobicContact CD-CE1 3.93Å; K275-F277 HydrophobicContact CD-CE2 4.39Å; K275-F277 HydrophobicContact CD-CZ 3.64Å; K275-F277 HydrophobicContact CG-CE1 4.19Å; K275-F277 HydrophobicContact CG-CE2 4.13Å; K275-F277 HydrophobicContact CG-CZ 3.83Å; F277-F279 HydrophobicContact CB-CE2 4.28Å
278	V	97.4	Very high	92.3	Very high	65 Å²	65	45.4 Å²	45.4	39%	0.394	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.3	-177.3	-174	0	0	0	0	109	Q249 R251 T276	Q249-V278 VanDerWaalsContact CD-CG1 3.47Å; Q249-V278 HydrophobicContact CG-CG1 3.74Å; R251-V278 HydrophobicContact CB-CG2 4.34Å; R251-V278 HydrophobicContact CG-CG2 3.99Å; T276-V278 HydrophobicContact CG2-CG2 4.01Å
279	F	98.1	Very high	92.9	Very high	31 Å²	31	46.2 Å²	46.2	14%	0.136	22%	0.224	C	C	.	.			trans	-114.2	100.5	176.9	-61	-77	0	0	0	109	C123 L125 V156 Q249 I252 F277 E281 T282	C123-F279 HydrophobicContact CB-CZ 4.2Å; C123-F279 WeakPolarHBondContact O-CZ 3.19Å; L125-F279 HydrophobicContact CB-CD1 3.75Å; L125-F279 HydrophobicContact CB-CD2 4.43Å; L125-F279 HydrophobicContact CB-CE1 3.78Å; L125-F279 HydrophobicContact CB-CE2 4.46Å; L125-F279 HydrophobicContact CB-CG 4.08Å; L125-F279 HydrophobicContact CB-CZ 4.14Å; L125-F279 HydrophobicContact CD2-CB 4.14Å; L125-F279 HydrophobicContact CD2-CD1 4.41Å; L125-F279 HydrophobicContact CD2-CG 4.26Å; V156-F279 HydrophobicContact CG1-CE2 4.04Å; Q249-F279 PolarHBondContact NE2-O 3.45Å; I252-F279 HydrophobicContact CD1-CE2 4.19Å; F277-F279 HydrophobicContact CB-CE2 4.28Å; F279-E281 VanDerWaalsContact C-OE2 3.29Å; F279-E281 PolarHBondContact O-N 3.02Å; F279-T282 HydrophobicContact CB-CG2 3.77Å; F279-T282 WeakPolarHBondContact O-CB 3.43Å; F279-T282 PolarHBondContact O-N 3.44Å; F279-T282 PolarHBondContact O-OG1 3.29Å
280	P	98.2	Very high	93.6	Very high	69 Å²	69	47.9 Å²	47.9	45%	0.448	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-55.6	-31.9	-177.4	-27.7	36	0	0	0	114.5	H135 T282 Q283	H135-P280 PolarHBondContact CE1-O 2.85Å; P280-T282 PolarHBondContact O-N 3.22Å; P280-T282 VanDerWaalsContact O-N 3.13Å; P280-Q283 WeakPolarHBondContact O-CB 3.26Å; P280-Q283 WeakPolarHBondContact O-CG 3.27Å; P280-Q283 PolarHBondContact O-N 2.9Å; P280-Q283 VanDerWaalsContact O-N 3.11Å
281	E	98.1	Very high	94.4	Very high	17 Å²	17	39.8 Å²	39.8	8%	0.079	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-64.1	-15.2	176.5	59.6	-92.7	-115.1	0	0	113.5	L125 R128 W131 L132 H135 F279 Q283	L125-E281 HydrophobicContact CD2-CG 3.71Å; R128-E281 IonicContact CZ-OE1 3.27Å; R128-E281 VanDerWaalsContact CZ-OE1 3.27Å; R128-E281 IonicContact NE-OE1 2.69Å; R128-E281 PolarHBondContact NE-OE1 3.3Å; R128-E281 IonicContact NH2-OE1 3.01Å; R128-E281 PolarHBondContact NH2-OE1 3.04Å; W131-E281 HydrophobicContact CB-CG 4.27Å; L132-E281 HydrophobicContact CD2-CB 3.89Å; H135-E281 HydrophobicContact CB-CB 4.46Å; F279-E281 VanDerWaalsContact C-OE2 3.29Å; F279-E281 PolarHBondContact O-N 3.02Å; E281-Q283 VanDerWaalsContact C-N 3.35Å
282	T	98.6	Very high	95.1	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-88.1	-0.3	176.5	68.2	0	0	0	0	113.8	L125 W131 Q249 P250 F279 P280	L125-T282 HydrophobicContact CD1-CG2 4.16Å; L125-T282 HydrophobicContact CD2-CG2 3.74Å; W131-T282 HydrophobicContact CD2-CG2 3.97Å; W131-T282 HydrophobicContact CE3-CG2 4.01Å; W131-T282 HydrophobicContact CG-CG2 4.47Å; W131-T282 HydrophobicContact CH2-CG2 4.44Å; W131-T282 HydrophobicContact CZ2-CG2 4.4Å; W131-T282 HydrophobicContact CZ3-CG2 4.25Å; Q249-T282 PolarHBondContact NE2-OG1 3.03Å; P250-T282 WeakPolarHBondContact CD-O 3.33Å; F279-T282 HydrophobicContact CB-CG2 3.77Å; F279-T282 WeakPolarHBondContact O-CB 3.43Å; F279-T282 PolarHBondContact O-N 3.44Å; F279-T282 PolarHBondContact O-OG1 3.29Å; P280-T282 PolarHBondContact O-N 3.22Å; P280-T282 VanDerWaalsContact O-N 3.13Å
283	Q	98.6	Very high	95.8	Very high	52 Å²	52	33.7 Å²	33.7	24%	0.243	17%	0.174	C	C	.	.			trans	-57.7	142.3	173.7	-71.6	170.4	15.1	0	0	111.3	T139 L176 Y248 Q249 P280 E281	T139-Q283 VanDerWaalsContact CB-O 3.3Å; T139-Q283 WeakPolarHBondContact CB-O 3.2Å; T139-Q283 PolarHBondContact OG1-O 3.12Å; L176-Q283 HydrophobicContact CD1-CG 4.34Å; Y248-Q283 VanDerWaalsContact O-CA 3.31Å; Y248-Q283 WeakPolarHBondContact O-CA 3.46Å; Q249-Q283 HydrophobicContact CB-CG 4.39Å; P280-Q283 WeakPolarHBondContact O-CB 3.26Å; P280-Q283 WeakPolarHBondContact O-CG 3.27Å; P280-Q283 PolarHBondContact O-N 2.9Å; P280-Q283 VanDerWaalsContact O-N 3.11Å; E281-Q283 VanDerWaalsContact C-N 3.35Å
284	F	98.7	Very high	96.2	Very high	5 Å²	5	33.2 Å²	33.2	2%	0.022	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161.1	-179.9	68.9	-89.1	0	0	0	112.6	T139 M141 M150 I173 L229 L242 K247 Y248 P250 A286	T139-F284 HydrophobicContact CG2-CB 3.77Å; T139-F284 CarbonylContact O-C 3.6Å; T139-F284 VanDerWaalsContact O-CA 3.27Å; T139-F284 WeakPolarHBondContact O-CA 3.4Å; M141-F284 HydrophobicContact CB-CD2 3.46Å; M141-F284 VanDerWaalsContact CB-CD2 3.46Å; M141-F284 HydrophobicContact CB-CE2 3.73Å; M141-F284 HydrophobicContact CB-CG 4.11Å; M141-F284 HydrophobicContact CG-CB 3.79Å; M141-F284 HydrophobicContact CG-CD1 4.07Å; M141-F284 HydrophobicContact CG-CD2 3.37Å; M141-F284 HydrophobicContact CG-CE2 3.9Å; M141-F284 HydrophobicContact CG-CG 3.46Å; M141-F284 VanDerWaalsContact CG-CG 3.46Å; M141-F284 HydrophobicContact CG-CZ 4.44Å; M150-F284 HydrophobicContact CE-CD1 4.03Å; M150-F284 HydrophobicContact CE-CE1 3.72Å; M150-F284 HydrophobicContact CE-CZ 4.31Å; I173-F284 HydrophobicContact CD1-CE1 4.32Å; I173-F284 HydrophobicContact CD1-CZ 4.17Å; I173-F284 HydrophobicContact CG2-CE1 4.24Å; I173-F284 HydrophobicContact CG2-CZ 4.1Å; L229-F284 HydrophobicContact CD1-CE2 4.12Å; L229-F284 HydrophobicContact CD1-CZ 4.06Å; L242-F284 HydrophobicContact CD1-CE2 3.87Å; L242-F284 HydrophobicContact CD1-CZ 3.73Å; K247-F284 CarbonylContact C-O 3.57Å; K247-F284 WeakPolarHBondContact CA-O 3.3Å; Y248-F284 HydrophobicContact CD2-CE2 4.08Å; Y248-F284 HydrophobicContact CD2-CZ 4.36Å; Y248-F284 HydrophobicContact CG-CE2 4.47Å; Y248-F284 HydrophobicContact CG-CZ 4.32Å; Y248-F284 PolarHBondContact N-O 3.41Å; Y248-F284 PolarHBondContact O-N 3.11Å; Y248-F284 VanDerWaalsContact O-N 3.11Å; P250-F284 HydrophobicContact CG-CD1 4.13Å; P250-F284 HydrophobicContact CG-CE1 3.86Å; F284-A286 HydrophobicContact CE2-CB 4.13Å
285	T	98.5	Very high	96.4	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.2	166.7	-50.6	0	0	0	0	109.2	T139 E140 M141 W190 H246 V287	T139-T285 PolarHBondContact O-N 3.2Å; E140-T285 WeakPolarHBondContact CA-O 3.37Å; M141-T285 PolarHBondContact N-O 2.9Å; W190-T285 HydrophobicContact CE3-CG2 4.47Å; W190-T285 HydrophobicContact CH2-CG2 3.6Å; W190-T285 HydrophobicContact CZ2-CG2 3.98Å; W190-T285 HydrophobicContact CZ3-CG2 3.88Å; H246-T285 WeakPolarHBondContact O-CA 3.35Å; T285-V287 HydrophobicContact CG2-CG1 4.21Å
286	A	98.5	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.2	174.7	0	0	0	0	0	109.3	I143 L242 S244 M245 H246 Y248 F284	I143-A286 HydrophobicContact CD1-CB 4.19Å; I143-A286 HydrophobicContact CG2-CB 4.03Å; L242-A286 HydrophobicContact CB-CB 4.29Å; L242-A286 HydrophobicContact CD1-CB 4.32Å; S244-A286 CarbonylContact C-O 3.51Å; M245-A286 WeakPolarHBondContact CA-O 3.44Å; M245-A286 PolarHBondContact N-O 2.79Å; H246-A286 PolarHBondContact O-N 3.34Å; Y248-A286 HydrophobicContact CD2-CB 3.91Å; Y248-A286 HydrophobicContact CE2-CB 3.72Å; F284-A286 HydrophobicContact CE2-CB 4.13Å
287	V	98.2	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150	-176.8	-62.2	0	0	0	0	111	E140 M141 I142 I143 W190 M245 T285 A289 Y290 Q291	E140-V287 HydrophobicContact CB-CG2 3.95Å; M141-V287 PolarHBondContact O-N 2.86Å; I142-V287 CarbonylContact C-O 3.55Å; I142-V287 VanDerWaalsContact CA-O 3.22Å; I142-V287 WeakPolarHBondContact CA-O 3.46Å; I142-V287 HydrophobicContact CD1-CG2 4.04Å; I143-V287 PolarHBondContact N-O 2.83Å; W190-V287 HydrophobicContact CH2-CG1 3.79Å; W190-V287 HydrophobicContact CZ2-CG1 4.27Å; M245-V287 HydrophobicContact SD-CG1 4.05Å; T285-V287 HydrophobicContact CG2-CG1 4.21Å; V287-A289 WeakPolarHBondContact CB-O 3.37Å; V287-A289 WeakPolarHBondContact CG2-O 3.46Å; V287-Y290 HydrophobicContact CG2-CD1 4.37Å; V287-Q291 HydrophobicContact CG1-CG 4.22Å
288	T	96.9	Very high	96	Very high	57 Å²	57	36.8 Å²	36.8	35%	0.35	19%	0.192	S	C	.	.	S	Bend	trans	-83.6	-24	172.4	51.3	0	0	0	0	112.6	I143 S244	I143-T288 HydrophobicContact CG1-CG2 4.26Å; S244-T288 PolarHBondContact OG-N 3.25Å
289	A	94.6	Very high	95.8	Very high	22 Å²	22	34.1 Å²	34.1	18%	0.182	18%	0.175	C	C	.	.	S	Bend	trans	-145.6	147.5	172.3	0	0	0	0	0	109.1	V287 Q291	V287-A289 WeakPolarHBondContact CB-O 3.37Å; V287-A289 WeakPolarHBondContact CG2-O 3.46Å; A289-Q291 PolarHBondContact O-NE2 3.32Å
290	Y	96.1	Very high	95.4	Very high	64 Å²	64	34.5 Å²	34.5	25%	0.251	18%	0.178	S	C	.	.			trans	-61.2	139.9	178.3	-65	-57.1	0	0	0	111.4	E140 I142 V287 I295 T296 K299	E140-Y290 HydrophobicContact CB-CD1 3.96Å; E140-Y290 HydrophobicContact CB-CE1 4.28Å; E140-Y290 VanDerWaalsContact OE2-CA 3.23Å; E140-Y290 WeakPolarHBondContact OE2-CA 3.43Å; I142-Y290 HydrophobicContact CD1-CD1 4.07Å; I142-Y290 HydrophobicContact CD1-CD2 4.27Å; I142-Y290 HydrophobicContact CD1-CE1 4.04Å; I142-Y290 HydrophobicContact CD1-CE2 4.25Å; I142-Y290 HydrophobicContact CD1-CG 4.18Å; I142-Y290 HydrophobicContact CG1-CD1 4.22Å; I142-Y290 HydrophobicContact CG1-CD2 4.48Å; I142-Y290 HydrophobicContact CG1-CE1 3.66Å; I142-Y290 HydrophobicContact CG1-CE2 3.96Å; V287-Y290 HydrophobicContact CG2-CD1 4.37Å; Y290-I295 HydrophobicContact CD1-CG2 4.04Å; Y290-I295 HydrophobicContact CE1-CG2 4.18Å; Y290-T296 VanDerWaalsContact CB-OG1 3.27Å; Y290-T296 WeakPolarHBondContact CB-OG1 3.23Å; Y290-T296 HydrophobicContact CD2-CG2 4.34Å; Y290-K299 HydrophobicContact CE1-CD 4.4Å; Y290-K299 HydrophobicContact CE1-CG 4.24Å; Y290-K299 HydrophobicContact CE2-CG 4.24Å; Y290-K299 WeakPolarHBondContact OH-CD 3.36Å; Y290-K299 WeakPolarHBondContact OH-CE 3.4Å
291	Q	96.7	Very high	95.1	Very high	27 Å²	27	35.1 Å²	35.1	13%	0.126	18%	0.178	C	C	.	.			trans	-101.3	-51.4	-179.6	-54.1	-62.8	-61.1	0	0	110.4	E140 Y183 Y185 W190 M245 V287 A289	E140-Q291 PolarHBondContact OE2-N 3.27Å; Y183-Q291 HydrophobicContact CD1-CB 3.96Å; Y183-Q291 HydrophobicContact CD2-CB 4.11Å; Y183-Q291 HydrophobicContact CG-CB 3.65Å; Y185-Q291 PolarHBondContact OH-OE1 3.24Å; W190-Q291 HydrophobicContact CH2-CB 4.22Å; W190-Q291 HydrophobicContact CH2-CG 3.65Å; W190-Q291 HydrophobicContact CZ2-CB 4.08Å; W190-Q291 HydrophobicContact CZ2-CG 3.97Å; M245-Q291 HydrophobicContact CE-CG 4.27Å; V287-Q291 HydrophobicContact CG1-CG 4.22Å; A289-Q291 PolarHBondContact O-NE2 3.32Å
292	N	93.2	Very high	94.8	Very high	14 Å²	14	36 Å²	36	8%	0.075	19%	0.185	C	C	.	.			trans	-82.8	116	177.3	-174.4	-6	0	0	0	111.2	L137 E140 Y183 L294 I295 T296	L137-N292 PolarHBondContact O-ND2 2.58Å; L137-N292 VanDerWaalsContact O-ND2 3.16Å; E140-N292 VanDerWaalsContact OE1-CB 3.26Å; E140-N292 WeakPolarHBondContact OE1-CB 3.03Å; E140-N292 PolarHBondContact OE1-N 3.25Å; Y183-N292 HydrophobicContact CE2-CB 4.09Å; N292-L294 PolarHBondContact O-N 3.15Å; N292-L294 WeakPolarHBondContact OD1-CB 3.26Å; N292-L294 PolarHBondContact OD1-N 3Å; N292-I295 HydrophobicContact CB-CB 4.3Å; N292-I295 HydrophobicContact CB-CG1 3.88Å; N292-I295 WeakPolarHBondContact O-CB 3.39Å; N292-I295 PolarHBondContact O-N 3.35Å; N292-T296 PolarHBondContact O-N 3.02Å
293	Q	92	Very high	94.3	Very high	101 Å²	101	36.9 Å²	36.9	47%	0.472	19%	0.19	S	C	.	.	H	α-helix	trans	-62.4	-26.9	179	-62.7	-60.1	-21	0	0	113.1	I295 T296 K297	Q293-I295 VanDerWaalsContact C-N 3.31Å; Q293-T296 WeakPolarHBondContact O-CB 3.27Å; Q293-T296 PolarHBondContact O-N 2.77Å; Q293-K297 PolarHBondContact O-N 3.21Å
294	L	94	Very high	93.8	Very high	89 Å²	89	39 Å²	39	47%	0.466	21%	0.208	S	C	.	.	H	α-helix	trans	-67.5	-34.4	174.9	-59.4	179.5	0	0	0	111.7	L137 N292 L298	L137-L294 HydrophobicContact CD1-CB 3.99Å; L137-L294 HydrophobicContact CD2-CB 4.17Å; L137-L294 HydrophobicContact CD2-CD1 3.98Å; N292-L294 PolarHBondContact O-N 3.15Å; N292-L294 WeakPolarHBondContact OD1-CB 3.26Å; N292-L294 PolarHBondContact OD1-N 3Å; L294-L298 WeakPolarHBondContact O-CB 3.2Å; L294-L298 PolarHBondContact O-N 3.02Å
295	I	93.8	Very high	92.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-48.3	171.4	-65.4	-71.6	0	0	0	109.3	F134 L137 E140 Y290 N292 Q293 K297 L298 K299	F134-I295 HydrophobicContact CD1-CD1 3.96Å; F134-I295 HydrophobicContact CD1-CG2 4.47Å; F134-I295 HydrophobicContact CE1-CG2 4.3Å; L137-I295 HydrophobicContact CB-CD1 3.47Å; L137-I295 VanDerWaalsContact CB-CD1 3.47Å; L137-I295 HydrophobicContact CB-CG1 4.14Å; L137-I295 HydrophobicContact CD1-CD1 4.28Å; E140-I295 HydrophobicContact CB-CG2 4.12Å; E140-I295 HydrophobicContact CG-CG1 4.35Å; E140-I295 HydrophobicContact CG-CG2 4.41Å; Y290-I295 HydrophobicContact CD1-CG2 4.04Å; Y290-I295 HydrophobicContact CE1-CG2 4.18Å; N292-I295 HydrophobicContact CB-CB 4.3Å; N292-I295 HydrophobicContact CB-CG1 3.88Å; N292-I295 WeakPolarHBondContact O-CB 3.39Å; N292-I295 PolarHBondContact O-N 3.35Å; Q293-I295 VanDerWaalsContact C-N 3.31Å; I295-K297 VanDerWaalsContact C-N 3.32Å; I295-K297 PolarHBondContact O-N 3.5Å; I295-L298 PolarHBondContact O-N 2.95Å; I295-L298 VanDerWaalsContact O-N 3.15Å; I295-K299 HydrophobicContact CG2-CG 4.11Å; I295-K299 WeakPolarHBondContact O-CG 3.36Å; I295-K299 PolarHBondContact O-N 2.81Å
296	T	91.2	Very high	91.8	Very high	31 Å²	31	45.1 Å²	45.1	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-54.8	-47.7	177.4	-53.9	0	0	0	0	111.7	Y290 N292 Q293 K299 I300	Y290-T296 VanDerWaalsContact CB-OG1 3.27Å; Y290-T296 WeakPolarHBondContact CB-OG1 3.23Å; Y290-T296 HydrophobicContact CD2-CG2 4.34Å; N292-T296 PolarHBondContact O-N 3.02Å; Q293-T296 WeakPolarHBondContact O-CB 3.27Å; Q293-T296 PolarHBondContact O-N 2.77Å; T296-K299 WeakPolarHBondContact O-CB 3.35Å; T296-K299 PolarHBondContact O-N 3.16Å; T296-I300 HydrophobicContact CG2-CD1 3.99Å; T296-I300 WeakPolarHBondContact O-CG1 3.35Å; T296-I300 PolarHBondContact O-N 3.35Å
297	K	91.2	Very high	90.8	Very high	93 Å²	93	51.8 Å²	51.8	40%	0.404	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-50.4	176.2	-176.1	177	-179.1	179.5	0	111.2	Q293 I295 K299 I300 D301	Q293-K297 PolarHBondContact O-N 3.21Å; I295-K297 VanDerWaalsContact C-N 3.32Å; I295-K297 PolarHBondContact O-N 3.5Å; K297-K299 VanDerWaalsContact C-N 3.3Å; K297-K299 PolarHBondContact O-N 3.22Å; K297-I300 PolarHBondContact O-N 3.19Å; K297-I300 VanDerWaalsContact O-N 3.11Å; K297-D301 WeakPolarHBondContact O-CB 3.4Å; K297-D301 VanDerWaalsContact O-CG 3.27Å; K297-D301 PolarHBondContact O-N 3.5Å
298	L	93.8	Very high	89.7	Confident	28 Å²	28	54.8 Å²	54.8	15%	0.147	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-38	179	-174.1	59.5	0	0	0	112.1	R133 F134 L137 L294 I295 D301 S302	R133-L298 HydrophobicContact CB-CD2 4Å; F134-L298 HydrophobicContact CB-CD2 4.49Å; F134-L298 HydrophobicContact CD1-CD2 3.71Å; F134-L298 HydrophobicContact CD1-CG 4.29Å; F134-L298 HydrophobicContact CD2-CD2 3.88Å; F134-L298 HydrophobicContact CD2-CG 4.38Å; F134-L298 HydrophobicContact CE1-CB 4.02Å; F134-L298 HydrophobicContact CE1-CD2 3.72Å; F134-L298 HydrophobicContact CE1-CG 3.77Å; F134-L298 HydrophobicContact CE2-CD2 3.92Å; F134-L298 HydrophobicContact CE2-CG 3.89Å; F134-L298 HydrophobicContact CG-CD2 3.78Å; F134-L298 HydrophobicContact CZ-CB 4.13Å; F134-L298 HydrophobicContact CZ-CD2 3.83Å; F134-L298 HydrophobicContact CZ-CG 3.56Å; L137-L298 HydrophobicContact CD1-CD2 4.06Å; L294-L298 WeakPolarHBondContact O-CB 3.2Å; L294-L298 PolarHBondContact O-N 3.02Å; I295-L298 PolarHBondContact O-N 2.95Å; I295-L298 VanDerWaalsContact O-N 3.15Å; L298-D301 PolarHBondContact O-N 2.9Å; L298-S302 WeakPolarHBondContact O-CB 3.46Å; L298-S302 PolarHBondContact O-N 3.46Å; L298-S302 PolarHBondContact O-OG 3.17Å
299	K	93.6	Very high	88.7	Confident	9 Å²	9	56.1 Å²	56.1	4%	0.039	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-45.9	173.6	-62.7	-78.4	-175.8	163.9	0	111.3	F134 E140 F151 Y290 I295 T296 K297 N303	F134-K299 HydrophobicContact CE1-CD 3.56Å; F134-K299 VanDerWaalsContact CE1-CE 3.48Å; F134-K299 HydrophobicContact CE1-CG 3.83Å; F134-K299 HydrophobicContact CZ-CD 3.7Å; F134-K299 HydrophobicContact CZ-CG 4.13Å; E140-K299 WeakPolarHBondContact O-CE 3.26Å; E140-K299 PolarHBondContact O-NZ 3.23Å; F151-K299 HydrophobicContact CD1-CD 3.69Å; F151-K299 HydrophobicContact CE1-CD 4.39Å; F151-K299 PolarHBondContact O-NZ 2.9Å; Y290-K299 HydrophobicContact CE1-CD 4.4Å; Y290-K299 HydrophobicContact CE1-CG 4.24Å; Y290-K299 HydrophobicContact CE2-CG 4.24Å; Y290-K299 WeakPolarHBondContact OH-CD 3.36Å; Y290-K299 WeakPolarHBondContact OH-CE 3.4Å; I295-K299 HydrophobicContact CG2-CG 4.11Å; I295-K299 WeakPolarHBondContact O-CG 3.36Å; I295-K299 PolarHBondContact O-N 2.81Å; T296-K299 WeakPolarHBondContact O-CB 3.35Å; T296-K299 PolarHBondContact O-N 3.16Å; K297-K299 VanDerWaalsContact C-N 3.3Å; K297-K299 PolarHBondContact O-N 3.22Å; K299-N303 WeakPolarHBondContact O-CB 3.2Å; K299-N303 PolarHBondContact O-N 3.38Å
300	I	88.8	Confident	88	Confident	39 Å²	39	59 Å²	59	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-46.6	178.8	-70.7	166.7	0	0	0	110.6	T296 K297 S302 A306 F309 R310	T296-I300 HydrophobicContact CG2-CD1 3.99Å; T296-I300 WeakPolarHBondContact O-CG1 3.35Å; T296-I300 PolarHBondContact O-N 3.35Å; K297-I300 PolarHBondContact O-N 3.19Å; K297-I300 VanDerWaalsContact O-N 3.11Å; I300-S302 PolarHBondContact O-N 2.93Å; I300-A306 HydrophobicContact CG1-CB 4.5Å; I300-F309 HydrophobicContact CD1-CB 3.95Å; I300-F309 HydrophobicContact CG1-CB 4.01Å; I300-F309 HydrophobicContact CG2-CB 3.79Å; I300-R310 HydrophobicContact CG2-CB 4.46Å; I300-R310 HydrophobicContact CG2-CG 3.69Å; I300-R310 PolarHBondContact O-NE 2.84Å; I300-R310 PolarHBondContact O-NH2 3.12Å
301	D	91.3	Very high	86.2	Confident	82 Å²	82	60.8 Å²	60.8	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-70	-34.2	-175.3	-67.7	-15.7	0	0	0	112.7	K297 L298 R310	K297-D301 WeakPolarHBondContact O-CB 3.4Å; K297-D301 VanDerWaalsContact O-CG 3.27Å; K297-D301 PolarHBondContact O-N 3.5Å; L298-D301 PolarHBondContact O-N 2.9Å; D301-R310 PolarHBondContact O-NE 3.49Å; D301-R310 PolarHBondContact O-NH2 3.49Å
302	S	91.8	Very high	84.1	Confident	34 Å²	34	64 Å²	64	24%	0.238	34%	0.342	C	S	.	.	H	α-helix	trans	-102.1	-25.9	-173.6	61.7	0	0	0	0	114.7	F151 L298 I300 P304	F151-S302 WeakPolarHBondContact CE1-OG 3.21Å; F151-S302 WeakPolarHBondContact CZ-OG 3.2Å; L298-S302 WeakPolarHBondContact O-CB 3.46Å; L298-S302 PolarHBondContact O-N 3.46Å; L298-S302 PolarHBondContact O-OG 3.17Å; I300-S302 PolarHBondContact O-N 2.93Å; S302-P304 WeakPolarHBondContact O-CD 3.45Å
303	N	88.6	Confident	81.8	Confident	22 Å²	22	67.1 Å²	67.1	12%	0.118	37%	0.365	C	S	.	.			trans	-84.7	119.6	-179.7	-171.6	-10.5	0	0	0	111.1	F151 K299 F305 A306 R310	F151-N303 HydrophobicContact CD1-CB 4.08Å; F151-N303 HydrophobicContact CD2-CB 3.91Å; F151-N303 HydrophobicContact CE1-CB 3.8Å; F151-N303 HydrophobicContact CE2-CB 3.61Å; F151-N303 HydrophobicContact CG-CB 4.14Å; F151-N303 HydrophobicContact CZ-CB 3.56Å; K299-N303 WeakPolarHBondContact O-CB 3.2Å; K299-N303 PolarHBondContact O-N 3.38Å; N303-F305 PolarHBondContact O-N 3.13Å; N303-F305 VanDerWaalsContact OD1-CD2 3.29Å; N303-F305 WeakPolarHBondContact OD1-CD2 3.47Å; N303-F305 PolarHBondContact OD1-N 3.05Å; N303-A306 HydrophobicContact CB-CB 4.14Å; N303-A306 PolarHBondContact O-N 3.43Å; N303-R310 PolarHBondContact O-NH2 3.08Å; N303-R310 VanDerWaalsContact O-NH2 3.12Å
304	P	87.3	Confident	79.2	Confident	96 Å²	96	71.8 Å²	71.8	62%	0.623	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-57.2	-33.2	176.8	-25.3	35.4	0	0	0	113.6	S302 A306 K307	S302-P304 WeakPolarHBondContact O-CD 3.45Å; P304-A306 PolarHBondContact O-N 2.82Å; P304-K307 WeakPolarHBondContact O-CB 3.38Å; P304-K307 PolarHBondContact O-N 3.07Å
305	F	79.4	Confident	76.2	Confident	136 Å²	136	74 Å²	74	60%	0.596	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-71	-16.8	179.5	-61.5	-73.1	0	0	0	113.3	N303	N303-F305 PolarHBondContact O-N 3.13Å; N303-F305 VanDerWaalsContact OD1-CD2 3.29Å; N303-F305 WeakPolarHBondContact OD1-CD2 3.47Å; N303-F305 PolarHBondContact OD1-N 3.05Å
306	A	77.1	Confident	73.3	Confident	4 Å²	4	77.6 Å²	77.6	3%	0.033	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-99.6	10.7	178.3	0	0	0	0	0	113	I36 I300 N303 P304 G308 F309	I36-A306 HydrophobicContact CG2-CB 4.44Å; I300-A306 HydrophobicContact CG1-CB 4.5Å; N303-A306 HydrophobicContact CB-CB 4.14Å; N303-A306 PolarHBondContact O-N 3.43Å; P304-A306 PolarHBondContact O-N 2.82Å; A306-G308 PolarHBondContact O-N 2.83Å; A306-G308 VanDerWaalsContact O-N 3.13Å; A306-F309 PolarHBondContact O-N 2.79Å
307	K	77.5	Confident	70.5	Confident	139 Å²	139	84.5 Å²	84.5	60%	0.604	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-53.5	-36.2	-176.7	-174.3	-178.3	177.2	-174.2	0	113.2	P304 F309 R310	P304-K307 WeakPolarHBondContact O-CB 3.38Å; P304-K307 PolarHBondContact O-N 3.07Å; K307-F309 PolarHBondContact O-N 3.28Å; K307-F309 VanDerWaalsContact O-N 3.08Å; K307-R310 WeakPolarHBondContact O-CB 3.37Å; K307-R310 WeakPolarHBondContact O-CG 3.46Å; K307-R310 PolarHBondContact O-N 3.47Å
308	G	74.5	Confident	67.7	Low	63 Å²	63	86.3 Å²	86.3	65%	0.649	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-61.1	-16.7	-179.6	0	0	0	0	0	115.2	A306	A306-G308 PolarHBondContact O-N 2.83Å; A306-G308 VanDerWaalsContact O-N 3.13Å
309	F	75.4	Confident	64.8	Low	85 Å²	85	86.8 Å²	86.8	37%	0.373	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-95.1	-6.1	178	-60.5	-81.5	0	0	0	113.4	I36 I300 A306 K307 D311	I36-F309 HydrophobicContact CB-CE2 4.02Å; I36-F309 HydrophobicContact CB-CZ 4.39Å; I36-F309 HydrophobicContact CD1-CE2 4.46Å; I36-F309 HydrophobicContact CD1-CZ 4.31Å; I36-F309 HydrophobicContact CG1-CD2 4.46Å; I36-F309 HydrophobicContact CG1-CE1 4.35Å; I36-F309 HydrophobicContact CG1-CE2 3.57Å; I36-F309 HydrophobicContact CG1-CZ 3.5Å; I36-F309 HydrophobicContact CG2-CD2 4.4Å; I36-F309 HydrophobicContact CG2-CE2 3.98Å; I300-F309 HydrophobicContact CD1-CB 3.95Å; I300-F309 HydrophobicContact CG1-CB 4.01Å; I300-F309 HydrophobicContact CG2-CB 3.79Å; A306-F309 PolarHBondContact O-N 2.79Å; K307-F309 PolarHBondContact O-N 3.28Å; K307-F309 VanDerWaalsContact O-N 3.08Å; F309-D311 VanDerWaalsContact C-N 3.34Å
310	R	81.7	Confident	61.8	Low	82 Å²	82	91.6 Å²	91.6	31%	0.309	49%	0.487	S	S	.	.	S	Bend	trans	-70.5	-31.9	-178.2	-65.1	178.5	-172.3	-179.4	2.5	112.4	I300 D301 N303 K307	I300-R310 HydrophobicContact CG2-CB 4.46Å; I300-R310 HydrophobicContact CG2-CG 3.69Å; I300-R310 PolarHBondContact O-NE 2.84Å; I300-R310 PolarHBondContact O-NH2 3.12Å; D301-R310 PolarHBondContact O-NE 3.49Å; D301-R310 PolarHBondContact O-NH2 3.49Å; N303-R310 PolarHBondContact O-NH2 3.08Å; N303-R310 VanDerWaalsContact O-NH2 3.12Å; K307-R310 WeakPolarHBondContact O-CB 3.37Å; K307-R310 WeakPolarHBondContact O-CG 3.46Å; K307-R310 PolarHBondContact O-N 3.47Å
311	D	58.2	Low	59	Low	102 Å²	102	92.7 Å²	92.7	55%	0.545	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-90.3	-13.3	-173	-62.4	-42.5	0	0	0	113.5	F309 S313 R314	F309-D311 VanDerWaalsContact C-N 3.34Å; D311-S313 PolarHBondContact O-N 3.35Å; D311-S313 VanDerWaalsContact O-N 3.11Å; D311-R314 PolarHBondContact O-N 2.9Å; D311-R314 VanDerWaalsContact O-N 3.16Å
312	S	51.4	Low	56.1	Low	94 Å²	94	91.2 Å²	91.2	66%	0.657	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-67.5	-10.9	-180	-54.3	0	0	0	0	114.2
313	S	46.1	Very low	53.1	Low	80 Å²	80	94.3 Å²	94.3	56%	0.559	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-86.7	-5.1	175.7	67.3	0	0	0	0	113.9	D311	D311-S313 PolarHBondContact O-N 3.35Å; D311-S313 VanDerWaalsContact O-N 3.11Å
314	R	37.6	Very low	50.5	Low	199 Å²	199	98.7 Å²	98.7	75%	0.751	53%	0.525	S	S	*	.			trans	-100.5	82	175.9	-70	-179.5	176.6	166.8	-1.8	109.8	D311	D311-R314 PolarHBondContact O-N 2.9Å; D311-R314 VanDerWaalsContact O-N 3.16Å
315	M	30.8	Very low	48	Very low	136 Å²	136	100.9 Å²	100.9	67%	0.67	53%	0.527	S	S	*	.			trans	-62.6	127.2	163.6	-71.5	-66.6	-70.4	0	0	108.3	E317 F323	M315-E317 PolarHBondContact O-N 2.81Å; M315-F323 HydrophobicContact CE-CE2 4.46Å
316	P	31.8	Very low	45.8	Very low	76 Å²	76	99.1 Å²	99.1	49%	0.494	52%	0.524	S	S	.	.			trans	-61.4	130.1	173.2	-17.1	29.4	0	0	0	109.4	D318 S319	P316-D318 PolarHBondContact O-N 2.95Å; P316-S319 WeakPolarHBondContact O-CB 3.21Å; P316-S319 PolarHBondContact O-N 2.97Å
317	E	33.5	Very low	43.7	Very low	176 Å²	176	101.5 Å²	101.5	82%	0.822	54%	0.544	S	S	*	.	H	α-helix	trans	-51.2	-30.5	175	-90	-174.3	143.1	0	0	112.3	M315 S319 L320	M315-E317 PolarHBondContact O-N 2.81Å; E317-S319 VanDerWaalsContact C-N 3.25Å; E317-S319 PolarHBondContact O-N 2.93Å; E317-L320 VanDerWaalsContact O-CB 3.26Å; E317-L320 WeakPolarHBondContact O-CB 3.24Å; E317-L320 PolarHBondContact O-N 3.21Å
318	D	32.5	Very low	41.6	Very low	131 Å²	131	95.8 Å²	95.8	70%	0.701	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-21.1	178.4	-64.1	-28.9	0	0	0	114.4	P316 L320 S321	P316-D318 PolarHBondContact O-N 2.95Å; D318-L320 VanDerWaalsContact C-N 3.32Å; D318-S321 PolarHBondContact O-OG 3.11Å
319	S	31.9	Very low	39.9	Very low	38 Å²	38	97 Å²	97	27%	0.266	52%	0.515	S	S	.	.	H	α-helix	trans	-72.7	-33.4	172.4	-60.2	0	0	0	0	110.4	P316 E317 S321 S322 F323	P316-S319 WeakPolarHBondContact O-CB 3.21Å; P316-S319 PolarHBondContact O-N 2.97Å; E317-S319 VanDerWaalsContact C-N 3.25Å; E317-S319 PolarHBondContact O-N 2.93Å; S319-S321 PolarHBondContact O-N 2.91Å; S319-S322 PolarHBondContact O-N 2.99Å; S319-S322 PolarHBondContact O-OG 3.02Å; S319-F323 VanDerWaalsContact C-CD2 3.44Å; S319-F323 WeakPolarHBondContact O-CD2 3.41Å; S319-F323 WeakPolarHBondContact O-CE2 3.37Å; S319-F323 WeakPolarHBondContact O-CG 3.48Å; S319-F323 PolarHBondContact O-N 3.26Å
320	L	30	Very low	37.8	Very low	110 Å²	110	98.8 Å²	98.8	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-68.4	-34	-177.2	-141.3	144.5	0	0	0	112.2	E317 D318 F323 I324	E317-L320 VanDerWaalsContact O-CB 3.26Å; E317-L320 WeakPolarHBondContact O-CB 3.24Å; E317-L320 PolarHBondContact O-N 3.21Å; D318-L320 VanDerWaalsContact C-N 3.32Å; L320-F323 PolarHBondContact O-N 3.15Å; L320-I324 HydrophobicContact CD2-CD1 3.79Å; L320-I324 HydrophobicContact CD2-CG1 4.36Å; L320-I324 WeakPolarHBondContact O-CD1 3.43Å; L320-I324 WeakPolarHBondContact O-CG1 3.26Å; L320-I324 PolarHBondContact O-N 2.81Å
321	S	30.4	Very low	35.6	Very low	61 Å²	61	102.5 Å²	102.5	43%	0.427	54%	0.537	S	S	.	.	H	α-helix	trans	-67.4	-42.7	172.4	41.5	0	0	0	0	112.4	D318 S319 F323 I324 E325	D318-S321 PolarHBondContact O-OG 3.11Å; S319-S321 PolarHBondContact O-N 2.91Å; S321-F323 VanDerWaalsContact C-N 3.31Å; S321-F323 PolarHBondContact O-N 3.19Å; S321-I324 PolarHBondContact O-N 3.26Å; S321-E325 PolarHBondContact O-N 3.44Å
322	S	31.2	Very low	34.6	Very low	52 Å²	52	105.8 Å²	105.8	36%	0.364	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-37.8	173.5	75.7	0	0	0	0	112.3	S319 I324 E325 D326	S319-S322 PolarHBondContact O-N 2.99Å; S319-S322 PolarHBondContact O-OG 3.02Å; S322-I324 PolarHBondContact O-N 3.17Å; S322-E325 PolarHBondContact O-N 3.42Å; S322-D326 PolarHBondContact O-N 2.95Å
323	F	29.3	Very low	33.9	Very low	99 Å²	99	107.2 Å²	107.2	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-68	-33.9	174.8	-69.6	-58.2	0	0	0	112.9	M315 S319 L320 S321 A327	M315-F323 HydrophobicContact CE-CE2 4.46Å; S319-F323 VanDerWaalsContact C-CD2 3.44Å; S319-F323 WeakPolarHBondContact O-CD2 3.41Å; S319-F323 WeakPolarHBondContact O-CE2 3.37Å; S319-F323 WeakPolarHBondContact O-CG 3.48Å; S319-F323 PolarHBondContact O-N 3.26Å; L320-F323 PolarHBondContact O-N 3.15Å; S321-F323 VanDerWaalsContact C-N 3.31Å; S321-F323 PolarHBondContact O-N 3.19Å; F323-A327 WeakPolarHBondContact O-CB 3.46Å; F323-A327 PolarHBondContact O-N 2.99Å
324	I	34.2	Very low	33.2	Very low	113 Å²	113	107.3 Å²	107.3	58%	0.579	53%	0.53	S	S	*	.	H	α-helix	trans	-69.9	-37.6	174.9	-71.7	165.4	0	0	0	110.8	L320 S321 S322 G328	L320-I324 HydrophobicContact CD2-CD1 3.79Å; L320-I324 HydrophobicContact CD2-CG1 4.36Å; L320-I324 WeakPolarHBondContact O-CD1 3.43Å; L320-I324 WeakPolarHBondContact O-CG1 3.26Å; L320-I324 PolarHBondContact O-N 2.81Å; S321-I324 PolarHBondContact O-N 3.26Å; S322-I324 PolarHBondContact O-N 3.17Å; I324-G328 PolarHBondContact O-N 2.88Å
325	E	34.9	Very low	33.2	Very low	142 Å²	142	100.9 Å²	100.9	66%	0.664	52%	0.52	S	S	*	.	H	α-helix	trans	-66.7	-45.9	174.1	-79.1	-175.1	152.4	0	0	111.9	S321 S322 A327 G328 I329	S321-E325 PolarHBondContact O-N 3.44Å; S322-E325 PolarHBondContact O-N 3.42Å; E325-A327 PolarHBondContact O-N 3.31Å; E325-G328 CarbonylContact O-C 3.49Å; E325-G328 VanDerWaalsContact O-CA 3.31Å; E325-G328 WeakPolarHBondContact O-CA 3.49Å; E325-G328 PolarHBondContact O-N 3.4Å; E325-I329 WeakPolarHBondContact O-CG1 3.25Å; E325-I329 PolarHBondContact O-N 3.16Å
326	D	33.1	Very low	33.6	Very low	100 Å²	100	102.5 Å²	102.5	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-64.6	-39.1	176.7	-83	-15	0	0	0	112.3	S322 G328 I329 F330	S322-D326 PolarHBondContact O-N 2.95Å; D326-G328 VanDerWaalsContact C-N 3.26Å; D326-G328 PolarHBondContact O-N 3.39Å; D326-I329 PolarHBondContact O-N 3.43Å; D326-F330 WeakPolarHBondContact O-CB 3.5Å; D326-F330 PolarHBondContact O-N 2.97Å
327	A	32.1	Very low	33.8	Very low	53 Å²	53	108.9 Å²	108.9	44%	0.438	54%	0.54	S	S	.	.	H	α-helix	trans	-65.4	-31.1	170.8	0	0	0	0	0	112.1	F323 E325 R331	F323-A327 WeakPolarHBondContact O-CB 3.46Å; F323-A327 PolarHBondContact O-N 2.99Å; E325-A327 PolarHBondContact O-N 3.31Å; A327-R331 WeakPolarHBondContact O-CB 3.34Å; A327-R331 PolarHBondContact O-N 2.88Å
328	G	34.2	Very low	33.9	Very low	20 Å²	20	103.2 Å²	103.2	21%	0.206	52%	0.517	C	S	.	.	H	α-helix	trans	-68.1	-38.9	171.9	0	0	0	0	0	112.8	I324 E325 D326 R331 R332	I324-G328 PolarHBondContact O-N 2.88Å; E325-G328 CarbonylContact O-C 3.49Å; E325-G328 VanDerWaalsContact O-CA 3.31Å; E325-G328 WeakPolarHBondContact O-CA 3.49Å; E325-G328 PolarHBondContact O-N 3.4Å; D326-G328 VanDerWaalsContact C-N 3.26Å; D326-G328 PolarHBondContact O-N 3.39Å; G328-R331 PolarHBondContact O-N 2.82Å; G328-R332 WeakPolarHBondContact O-CG 3.36Å; G328-R332 PolarHBondContact O-N 2.83Å
329	I	37.3	Very low	34.1	Very low	88 Å²	88	105 Å²	105	45%	0.451	53%	0.527	S	S	.	.	H	α-helix	trans	-67.5	-45.7	174.9	-66	165.7	0	0	0	110.2	E325 D326 R331 R332 H333	E325-I329 WeakPolarHBondContact O-CG1 3.25Å; E325-I329 PolarHBondContact O-N 3.16Å; D326-I329 PolarHBondContact O-N 3.43Å; I329-R331 VanDerWaalsContact C-N 3.33Å; I329-R331 PolarHBondContact O-N 2.91Å; I329-R332 PolarHBondContact O-N 3.31Å; I329-H333 PolarHBondContact O-N 3.48Å
330	F	32.6	Very low	34.5	Very low	123 Å²	123	112.5 Å²	112.5	54%	0.539	56%	0.558	S	S	.	*	H	α-helix	trans	-62.6	-39.5	175.6	-166.6	-97	0	0	0	112	D326 H333 M334	D326-F330 WeakPolarHBondContact O-CB 3.5Å; D326-F330 PolarHBondContact O-N 2.97Å; F330-H333 WeakPolarHBondContact O-CB 3.19Å; F330-H333 PolarHBondContact O-N 3.43Å; F330-M334 HydrophobicContact CD1-CG 4.19Å; F330-M334 HydrophobicContact CE1-CE 3.63Å; F330-M334 HydrophobicContact CE1-CG 3.89Å; F330-M334 HydrophobicContact CZ-CE 3.5Å; F330-M334 VanDerWaalsContact CZ-CE 3.5Å; F330-M334 HydrophobicContact CZ-CG 4.41Å; F330-M334 PolarHBondContact O-N 2.83Å
331	R	35.5	Very low	34.7	Very low	160 Å²	160	110 Å²	110	60%	0.604	55%	0.549	S	S	*	.	H	α-helix	trans	-61.2	-44	173.3	-173.3	-171.3	-61.5	-178.2	2	112	A327 G328 I329 H333 M334 A335	A327-R331 WeakPolarHBondContact O-CB 3.34Å; A327-R331 PolarHBondContact O-N 2.88Å; G328-R331 PolarHBondContact O-N 2.82Å; I329-R331 VanDerWaalsContact C-N 3.33Å; I329-R331 PolarHBondContact O-N 2.91Å; R331-H333 VanDerWaalsContact C-N 3.31Å; R331-M334 PolarHBondContact O-N 3.24Å; R331-A335 VanDerWaalsContact O-CB 3.26Å; R331-A335 WeakPolarHBondContact O-CB 3.26Å; R331-A335 PolarHBondContact O-N 3.33Å
332	R	37.4	Very low	35.1	Very low	171 Å²	171	111.5 Å²	111.5	65%	0.645	56%	0.56	S	S	*	*	H	α-helix	trans	-63.2	-38.9	173.8	-74.7	-174.4	-162.1	114.1	-0.2	111.4	G328 I329 A335 H336	G328-R332 WeakPolarHBondContact O-CG 3.36Å; G328-R332 PolarHBondContact O-N 2.83Å; I329-R332 PolarHBondContact O-N 3.31Å; R332-A335 PolarHBondContact O-N 3.48Å; R332-H336 PolarHBondContact O-CD2 2.92Å; R332-H336 PolarHBondContact O-N 3.16Å; R332-H336 VanDerWaalsContact O-N 3.14Å
333	H	35.3	Very low	35.5	Very low	124 Å²	124	113 Å²	113	57%	0.574	57%	0.57	S	S	*	*	H	α-helix	trans	-66.3	-39.2	179.5	-128.3	80.9	0	0	0	112.9	I329 F330 R331	I329-H333 PolarHBondContact O-N 3.48Å; F330-H333 WeakPolarHBondContact O-CB 3.19Å; F330-H333 PolarHBondContact O-N 3.43Å; R331-H333 VanDerWaalsContact C-N 3.31Å
334	M	33	Very low	35.8	Very low	81 Å²	81	114.6 Å²	114.6	40%	0.399	58%	0.583	S	S	.	*	H	α-helix	trans	-72.2	-40.8	174.3	-77.4	-78.6	-173.9	0	0	112.1	F330 R331 H336 R337 T338 A394	F330-M334 HydrophobicContact CD1-CG 4.19Å; F330-M334 HydrophobicContact CE1-CE 3.63Å; F330-M334 HydrophobicContact CE1-CG 3.89Å; F330-M334 HydrophobicContact CZ-CE 3.5Å; F330-M334 VanDerWaalsContact CZ-CE 3.5Å; F330-M334 HydrophobicContact CZ-CG 4.41Å; F330-M334 PolarHBondContact O-N 2.83Å; R331-M334 PolarHBondContact O-N 3.24Å; M334-H336 VanDerWaalsContact C-N 3.27Å; M334-H336 PolarHBondContact O-N 3.11Å; M334-R337 PolarHBondContact O-N 3.41Å; M334-R337 VanDerWaalsContact O-N 3.11Å; M334-T338 PolarHBondContact O-OG1 3.06Å; M334-A394 HydrophobicContact CE-CB 4.1Å
335	A	37	Very low	35.7	Very low	65 Å²	65	114 Å²	114	54%	0.537	58%	0.58	S	S	.	*	H	α-helix	trans	-64	-30.2	179.6	0	0	0	0	0	113.2	R331 R332 R337	R331-A335 VanDerWaalsContact O-CB 3.26Å; R331-A335 WeakPolarHBondContact O-CB 3.26Å; R331-A335 PolarHBondContact O-N 3.33Å; R332-A335 PolarHBondContact O-N 3.48Å; A335-R337 VanDerWaalsContact C-N 3.32Å; A335-R337 PolarHBondContact O-N 3.5Å
336	H	38.8	Very low	35.7	Very low	169 Å²	169	110.6 Å²	110.6	78%	0.782	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-11.5	175.9	-89	-70.6	0	0	0	114.5	R332 M334	R332-H336 PolarHBondContact O-CD2 2.92Å; R332-H336 PolarHBondContact O-N 3.16Å; R332-H336 VanDerWaalsContact O-N 3.14Å; M334-H336 VanDerWaalsContact C-N 3.27Å; M334-H336 PolarHBondContact O-N 3.11Å
337	R	35.9	Very low	35.7	Very low	210 Å²	210	109.4 Å²	109.4	79%	0.792	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-2.3	-178.1	-77	-166.5	177.7	-160.2	1.3	114.9	M334 A335	M334-R337 PolarHBondContact O-N 3.41Å; M334-R337 VanDerWaalsContact O-N 3.11Å; A335-R337 VanDerWaalsContact C-N 3.32Å; A335-R337 PolarHBondContact O-N 3.5Å
338	T	34.9	Very low	35.7	Very low	57 Å²	57	110.9 Å²	110.9	35%	0.35	58%	0.577	S	S	.	*			trans	-130.3	81.6	-177	61.1	0	0	0	0	111.7	M334 Q340	M334-T338 PolarHBondContact O-OG1 3.06Å; T338-Q340 PolarHBondContact O-N 3.31Å
339	N	37.5	Very low	35.7	Very low	170 Å²	170	113.8 Å²	113.8	91%	0.909	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	14.5	177.2	-117.4	-0.1	0	0	0	114
340	Q	39.5	Very low	35.6	Very low	194 Å²	194	115.5 Å²	115.5	91%	0.907	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.9	12.5	-173.9	-73	-171.1	3.2	0	0	116.4	T338	T338-Q340 PolarHBondContact O-N 3.31Å
341	S	35.4	Very low	35.6	Very low	57 Å²	57	112.5 Å²	112.5	40%	0.399	60%	0.595	S	S	.	*			trans	-151.6	31.1	-174.8	50.8	0	0	0	0	115.3
342	S	38.5	Very low	35.5	Very low	93 Å²	93	106.8 Å²	106.8	65%	0.65	59%	0.586	S	S	*	*	H	α-helix	trans	-80	-19.3	-168.6	56.8	0	0	0	0	116.2
343	S	39.3	Very low	35.2	Very low	83 Å²	83	106.9 Å²	106.9	58%	0.58	59%	0.586	S	S	*	*	H	α-helix	trans	-82.5	-34.1	-173.7	61.3	0	0	0	0	114.3	S347	S343-S347 PolarHBondContact O-N 3.01Å; S343-S347 PolarHBondContact O-OG 3.35Å
344	L	35	Very low	35	Very low	133 Å²	133	106.3 Å²	106.3	70%	0.696	59%	0.588	S	S	*	*	H	α-helix	trans	-78.3	-38.3	-176.7	-65.6	173.1	0	0	0	112.1	S347 C348	L344-S347 PolarHBondContact O-N 3.42Å; L344-C348 PolarHBondContact O-N 2.94Å; L344-C348 PolarHBondContact O-SG 2.89Å
345	I	33.6	Very low	34.9	Very low	102 Å²	102	104.3 Å²	104.3	52%	0.523	59%	0.587	S	S	.	*	H	α-helix	trans	-70.2	-38.1	-179.5	-58.8	172.8	0	0	0	110.6	V349	I345-V349 VanDerWaalsContact O-CG2 3.25Å; I345-V349 WeakPolarHBondContact O-CG2 3.33Å; I345-V349 PolarHBondContact O-N 3.27Å
346	S	33.9	Very low	34.6	Very low	69 Å²	69	107.1 Å²	107.1	48%	0.483	59%	0.588	S	S	.	*	H	α-helix	trans	-66.8	-39.3	177.3	-166.9	0	0	0	0	112.4	V349 Q350	S346-V349 PolarHBondContact O-N 3.37Å; S346-Q350 PolarHBondContact O-N 2.96Å
347	S	33.4	Very low	34.1	Very low	75 Å²	75	107.5 Å²	107.5	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-69.4	-40.1	176.8	-73	0	0	0	0	112.7	S343 L344 V349 Q350 A351	S343-S347 PolarHBondContact O-N 3.01Å; S343-S347 PolarHBondContact O-OG 3.35Å; L344-S347 PolarHBondContact O-N 3.42Å; S347-V349 VanDerWaalsContact C-N 3.31Å; S347-V349 PolarHBondContact O-N 2.97Å; S347-Q350 PolarHBondContact O-N 2.99Å; S347-A351 WeakPolarHBondContact O-CB 3.49Å; S347-A351 PolarHBondContact O-N 3.43Å
348	C	32.6	Very low	33.8	Very low	85 Å²	85	104.8 Å²	104.8	57%	0.574	58%	0.576	S	S	*	*	H	α-helix	trans	-61.3	-38.9	174.7	-78.1	0	0	0	0	112.4	L344 G352	L344-C348 PolarHBondContact O-N 2.94Å; L344-C348 PolarHBondContact O-SG 2.89Å; C348-G352 PolarHBondContact O-N 3.49Å
349	V	34.4	Very low	33.6	Very low	81 Å²	81	107.5 Å²	107.5	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-70.7	-34.4	179.1	172.6	0	0	0	0	112.1	I345 S346 S347 R353	I345-V349 VanDerWaalsContact O-CG2 3.25Å; I345-V349 WeakPolarHBondContact O-CG2 3.33Å; I345-V349 PolarHBondContact O-N 3.27Å; S346-V349 PolarHBondContact O-N 3.37Å; S347-V349 VanDerWaalsContact C-N 3.31Å; S347-V349 PolarHBondContact O-N 2.97Å; V349-R353 PolarHBondContact O-N 3.37Å
350	Q	34.8	Very low	33.2	Very low	124 Å²	124	103.5 Å²	103.5	58%	0.579	57%	0.567	S	S	*	*	H	α-helix	trans	-75.7	-37.3	174.9	-92.7	170	-38.8	0	0	113.1	S346 S347 R353	S346-Q350 PolarHBondContact O-N 2.96Å; S347-Q350 PolarHBondContact O-N 2.99Å; Q350-R353 WeakPolarHBondContact O-CB 3.28Å; Q350-R353 PolarHBondContact O-N 3.18Å
351	A	33	Very low	32.7	Very low	59 Å²	59	100.5 Å²	100.5	49%	0.488	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-41.5	175.7	0	0	0	0	0	111.8	S347 R353 N354 G355	S347-A351 WeakPolarHBondContact O-CB 3.49Å; S347-A351 PolarHBondContact O-N 3.43Å; A351-R353 PolarHBondContact O-N 3.15Å; A351-N354 PolarHBondContact O-N 3.47Å; A351-G355 PolarHBondContact O-N 3.41Å; A351-G355 VanDerWaalsContact O-N 3.15Å
352	G	33.3	Very low	32.4	Very low	41 Å²	41	104.6 Å²	104.6	42%	0.423	57%	0.57	S	S	.	*	H	α-helix	trans	-58.6	-35.9	172.2	0	0	0	0	0	112.4	C348 N354 F356	C348-G352 PolarHBondContact O-N 3.49Å; G352-N354 VanDerWaalsContact C-N 3.32Å; G352-N354 PolarHBondContact O-N 3.01Å; G352-F356 WeakPolarHBondContact O-CB 3.41Å; G352-F356 PolarHBondContact O-N 3.37Å
353	R	30.6	Very low	32.1	Very low	172 Å²	172	104.4 Å²	104.4	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-65.6	-29.2	179.8	-134.4	175.5	160.6	114.9	-1.8	114.5	V349 Q350 A351	V349-R353 PolarHBondContact O-N 3.37Å; Q350-R353 WeakPolarHBondContact O-CB 3.28Å; Q350-R353 PolarHBondContact O-N 3.18Å; A351-R353 PolarHBondContact O-N 3.15Å
354	N	30.4	Very low	31.6	Very low	113 Å²	113	106.6 Å²	106.6	60%	0.604	57%	0.566	S	S	*	*	H	α-helix	trans	-97.6	-30.7	-176.5	-71.4	-16.4	0	0	0	113.2	A351 G352	A351-N354 PolarHBondContact O-N 3.47Å; G352-N354 VanDerWaalsContact C-N 3.32Å; G352-N354 PolarHBondContact O-N 3.01Å
355	G	31.7	Very low	31.3	Very low	38 Å²	38	111.9 Å²	111.9	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-72.9	-44.4	172.7	0	0	0	0	0	112.1	A351 R357 K358 D359	A351-G355 PolarHBondContact O-N 3.41Å; A351-G355 VanDerWaalsContact O-N 3.15Å; G355-R357 VanDerWaalsContact C-N 3.27Å; G355-R357 PolarHBondContact O-N 3.38Å; G355-K358 PolarHBondContact O-N 2.8Å; G355-K358 VanDerWaalsContact O-N 3.16Å; G355-D359 PolarHBondContact O-N 3.25Å
356	F	29.9	Very low	31.2	Very low	125 Å²	125	113 Å²	113	55%	0.548	58%	0.583	S	S	.	*	H	α-helix	trans	-66.3	-28.4	-178.6	-149.8	-102.9	0	0	0	112.6	G352 L360	G352-F356 WeakPolarHBondContact O-CB 3.41Å; G352-F356 PolarHBondContact O-N 3.37Å; F356-L360 HydrophobicContact CD1-CD1 3.32Å; F356-L360 HydrophobicContact CE1-CD1 3.41Å; F356-L360 VanDerWaalsContact CE1-CD1 3.41Å; F356-L360 HydrophobicContact CG-CD1 4.11Å; F356-L360 HydrophobicContact CZ-CD1 4.27Å; F356-L360 WeakPolarHBondContact O-CB 3.46Å; F356-L360 WeakPolarHBondContact O-CD1 3.43Å; F356-L360 PolarHBondContact O-N 2.67Å
357	R	29.1	Very low	31	Very low	176 Å²	176	114.9 Å²	114.9	66%	0.664	59%	0.588	S	S	*	*	H	α-helix	trans	-74	-26.8	177	-147.4	178.4	-162.3	165.5	2.6	113.2	G355 Q361	G355-R357 VanDerWaalsContact C-N 3.27Å; G355-R357 PolarHBondContact O-N 3.38Å; R357-Q361 VanDerWaalsContact O-CG 3.25Å; R357-Q361 WeakPolarHBondContact O-CG 3.41Å; R357-Q361 PolarHBondContact O-N 2.91Å
358	K	29.9	Very low	30.7	Very low	154 Å²	154	116.3 Å²	116.3	67%	0.67	60%	0.604	S	S	*	*	H	α-helix	trans	-83.3	-34.1	176.8	-78.7	-177.2	176.2	179	0	112.2	G355	G355-K358 PolarHBondContact O-N 2.8Å; G355-K358 VanDerWaalsContact O-N 3.16Å
359	D	29.5	Very low	30.8	Very low	113 Å²	113	118.8 Å²	118.8	60%	0.604	61%	0.607	S	S	*	*	H	α-helix	trans	-78.6	-25.3	175.6	-69.6	-23.9	0	0	0	112.9	G355	G355-D359 PolarHBondContact O-N 3.25Å
360	L	28.8	Very low	30.7	Very low	86 Å²	86	119.5 Å²	119.5	45%	0.45	61%	0.608	S	S	.	*	H	α-helix	trans	-70.8	-37.1	168.2	-102.2	94.6	0	0	0	112.9	F356 L362 N363 D364	F356-L360 HydrophobicContact CD1-CD1 3.32Å; F356-L360 HydrophobicContact CE1-CD1 3.41Å; F356-L360 VanDerWaalsContact CE1-CD1 3.41Å; F356-L360 HydrophobicContact CG-CD1 4.11Å; F356-L360 HydrophobicContact CZ-CD1 4.27Å; F356-L360 WeakPolarHBondContact O-CB 3.46Å; F356-L360 WeakPolarHBondContact O-CD1 3.43Å; F356-L360 PolarHBondContact O-N 2.67Å; L360-L362 PolarHBondContact O-N 3.3Å; L360-N363 PolarHBondContact O-N 3.39Å; L360-D364 PolarHBondContact O-N 3.09Å
361	Q	28.5	Very low	30.9	Very low	131 Å²	131	117.7 Å²	117.7	61%	0.612	61%	0.607	S	S	*	*	H	α-helix	trans	-67.8	-18.8	-178.7	-80.9	177.4	-1.8	0	0	113.6	R357	R357-Q361 VanDerWaalsContact O-CG 3.25Å; R357-Q361 WeakPolarHBondContact O-CG 3.41Å; R357-Q361 PolarHBondContact O-N 2.91Å
362	L	30.8	Very low	30.8	Very low	144 Å²	144	120.3 Å²	120.3	75%	0.754	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-14.1	171	-90.9	147.3	0	0	0	113.1	L360	L360-L362 PolarHBondContact O-N 3.3Å
363	N	31.1	Very low	30.7	Very low	89 Å²	89	123.9 Å²	123.9	48%	0.476	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.6	-2.1	-177	-89.3	-30.9	0	0	0	114.7	L360 R365 L366	L360-N363 PolarHBondContact O-N 3.39Å; N363-R365 PolarHBondContact O-N 3.23Å; N363-L366 PolarHBondContact O-N 3.36Å
364	D	29.1	Very low	30.9	Very low	129 Å²	129	116.7 Å²	116.7	69%	0.69	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-0.4	175.5	-80.3	-27.8	0	0	0	114.4	L360	L360-D364 PolarHBondContact O-N 3.09Å
365	R	29.8	Very low	31	Very low	244 Å²	244	114 Å²	114	92%	0.921	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-0.8	171	-70.4	-166.5	167.6	-171.9	-2.7	114.9	N363	N363-R365 PolarHBondContact O-N 3.23Å
366	L	29.8	Very low	31.1	Very low	124 Å²	124	119.1 Å²	119.1	65%	0.649	58%	0.582	S	S	*	*	S	Bend	trans	-130.7	90.1	-179.2	-74.8	168.6	0	0	0	111.1	N363	N363-L366 PolarHBondContact O-N 3.36Å
367	N	30.5	Very low	31.3	Very low	110 Å²	110	121.1 Å²	121.1	59%	0.588	59%	0.588	S	S	*	*			trans	30.4	118.8	155.6	-77.3	-56.4	0	0	0	119.3	H369	N367-H369 VanDerWaalsContact C-N 3.26Å; N367-H369 PolarHBondContact O-N 3.35Å
368	A	28.1	Very low	31.6	Very low	104 Å²	104	113.6 Å²	113.6	86%	0.86	56%	0.561	S	S	*	*	S	Bend	trans	-62.2	48.2	174.7	0	0	0	0	0	117.6
369	H	34.3	Very low	31.8	Very low	137 Å²	137	111.9 Å²	111.9	63%	0.634	56%	0.556	S	S	*	*			trans	-144.7	84.1	177.2	-94.3	-71.3	0	0	0	112.9	N367	N367-H369 VanDerWaalsContact C-N 3.26Å; N367-H369 PolarHBondContact O-N 3.35Å
370	L	32.5	Very low	32.1	Very low	96 Å²	96	113.8 Å²	113.8	50%	0.503	56%	0.559	S	S	.	*			trans	-139.3	80.3	174.1	-85.8	159.4	0	0	0	113.2	Q373	L370-Q373 HydrophobicContact CD2-CB 4.05Å; L370-Q373 HydrophobicContact CD2-CG 3.78Å
371	P	37.6	Very low	32.6	Very low	86 Å²	86	111 Å²	111	56%	0.558	55%	0.548	S	S	*	.	S	Bend	trans	-85.8	-8	157.1	30	-26.7	0	0	0	113	S374 V375	P371-S374 PolarHBondContact O-OG 3.48Å; P371-V375 WeakPolarHBondContact O-CG2 3.36Å
372	Y	32	Very low	33.1	Very low	114 Å²	114	107.9 Å²	107.9	45%	0.447	53%	0.531	S	S	.	.	H	α-helix	trans	-87.5	-28.2	-173.8	-104.3	-91	0	0	0	114.7
373	Q	31.3	Very low	33.3	Very low	117 Å²	117	105.8 Å²	105.8	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-79.4	-34.4	174.8	-82.8	173.9	-19.2	0	0	111.9	L370 V375 Y376 Y377	L370-Q373 HydrophobicContact CD2-CB 4.05Å; L370-Q373 HydrophobicContact CD2-CG 3.78Å; Q373-V375 PolarHBondContact O-N 3.32Å; Q373-Y376 PolarHBondContact O-N 3.46Å; Q373-Y377 WeakPolarHBondContact O-CD2 3.36Å; Q373-Y377 PolarHBondContact O-N 3Å; Q373-Y377 VanDerWaalsContact O-N 3.15Å
374	S	33.7	Very low	33.6	Very low	21 Å²	21	105 Å²	105	15%	0.147	52%	0.524	C	S	.	.	H	α-helix	trans	-62.7	-42.6	178.5	43.1	0	0	0	0	112.9	P371 Y376 Y377 V378 L411	P371-S374 PolarHBondContact O-OG 3.48Å; S374-Y376 PolarHBondContact O-N 3.31Å; S374-Y377 PolarHBondContact O-N 2.99Å; S374-V378 VanDerWaalsContact O-CG2 3.24Å; S374-V378 WeakPolarHBondContact O-CG2 3.24Å; S374-V378 PolarHBondContact O-N 3.27Å; S374-L411 VanDerWaalsContact CB-CD2 3.47Å
375	V	33.2	Very low	34.1	Very low	57 Å²	57	101 Å²	101	35%	0.345	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-38.5	179.7	177.9	0	0	0	0	111.9	P371 Q373 Q379 W407	P371-V375 WeakPolarHBondContact O-CG2 3.36Å; Q373-V375 PolarHBondContact O-N 3.32Å; V375-Q379 PolarHBondContact O-N 2.97Å; V375-W407 HydrophobicContact CG1-CH2 4.29Å; V375-W407 HydrophobicContact CG1-CZ3 4.41Å; V375-W407 HydrophobicContact CG2-CE3 4.18Å; V375-W407 HydrophobicContact CG2-CH2 4.42Å; V375-W407 HydrophobicContact CG2-CZ3 4.13Å
376	Y	33.3	Very low	34.4	Very low	144 Å²	144	92.5 Å²	92.5	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-68.5	-36.9	177.7	-168.7	-97	0	0	0	112.7	Q373 S374 K380	Q373-Y376 PolarHBondContact O-N 3.46Å; S374-Y376 PolarHBondContact O-N 3.31Å; Y376-K380 PolarHBondContact O-N 3.11Å
377	Y	34	Very low	34.8	Very low	167 Å²	167	90 Å²	90	66%	0.655	49%	0.488	S	S	*	.	H	α-helix	trans	-71.8	-39.6	176	-91.6	-83.9	0	0	0	112.6	Q373 S374 Q379 K380 A381	Q373-Y377 WeakPolarHBondContact O-CD2 3.36Å; Q373-Y377 PolarHBondContact O-N 3Å; Q373-Y377 VanDerWaalsContact O-N 3.15Å; S374-Y377 PolarHBondContact O-N 2.99Å; Y377-Q379 VanDerWaalsContact C-N 3.32Å; Y377-Q379 PolarHBondContact O-N 3.33Å; Y377-K380 PolarHBondContact O-N 3.47Å; Y377-A381 WeakPolarHBondContact O-CB 3.4Å; Y377-A381 PolarHBondContact O-N 3.05Å
378	V	35.6	Very low	35.2	Very low	19 Å²	19	88.5 Å²	88.5	12%	0.115	48%	0.484	C	S	.	.	H	α-helix	trans	-61.3	-40.5	175.8	170.2	0	0	0	0	111.4	S374 K380 A381 W382 W407 L410	S374-V378 VanDerWaalsContact O-CG2 3.24Å; S374-V378 WeakPolarHBondContact O-CG2 3.24Å; S374-V378 PolarHBondContact O-N 3.27Å; V378-K380 VanDerWaalsContact C-N 3.32Å; V378-K380 PolarHBondContact O-N 3.16Å; V378-A381 PolarHBondContact O-N 3.48Å; V378-W382 PolarHBondContact O-N 3.04Å; V378-W407 HydrophobicContact CG1-CZ3 4.3Å; V378-L410 HydrophobicContact CG1-CD2 3.88Å
379	Q	34.5	Very low	35.7	Very low	118 Å²	118	92 Å²	92	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-67.7	-30.7	179.2	-160.5	173.8	3.1	0	0	113	V375 Y377	V375-Q379 PolarHBondContact O-N 2.97Å; Y377-Q379 VanDerWaalsContact C-N 3.32Å; Y377-Q379 PolarHBondContact O-N 3.33Å
380	K	35.8	Very low	36	Very low	153 Å²	153	89 Å²	89	67%	0.665	48%	0.479	S	S	*	.	H	α-helix	trans	-78.6	-30.9	174	-95.7	-164.7	172.5	-168.4	0	113.8	Y376 Y377 V378	Y376-K380 PolarHBondContact O-N 3.11Å; Y377-K380 PolarHBondContact O-N 3.47Å; V378-K380 VanDerWaalsContact C-N 3.32Å; V378-K380 PolarHBondContact O-N 3.16Å
381	A	38.7	Very low	36.1	Very low	27 Å²	27	88.6 Å²	88.6	22%	0.223	48%	0.482	C	S	.	.	H	α-helix	trans	-87.6	-16.4	-177.9	0	0	0	0	0	113.6	Y377 V378 T384 L385	Y377-A381 WeakPolarHBondContact O-CB 3.4Å; Y377-A381 PolarHBondContact O-N 3.05Å; V378-A381 PolarHBondContact O-N 3.48Å; A381-T384 WeakPolarHBondContact O-CB 3.38Å; A381-T384 PolarHBondContact O-N 3.14Å; A381-L385 HydrophobicContact CB-CD1 4.34Å; A381-L385 PolarHBondContact O-N 3.31Å
382	W	39.9	Very low	35.9	Very low	66 Å²	66	89.8 Å²	89.8	25%	0.25	48%	0.475	C	S	.	.	H	α-helix	trans	-57.2	-41.5	-177.6	-169.8	-98.7	0	0	0	114.8	V378 T384 L385 A386 L410 W467	V378-W382 PolarHBondContact O-N 3.04Å; W382-T384 PolarHBondContact O-N 3Å; W382-L385 WeakPolarHBondContact O-CB 3.39Å; W382-L385 PolarHBondContact O-N 3.04Å; W382-L385 VanDerWaalsContact O-N 3.14Å; W382-A386 PolarHBondContact O-N 3.32Å; W382-L410 HydrophobicContact CZ3-CD2 4.3Å; W382-W467 HydrophobicContact CH2-CZ2 4.41Å
383	P	34.2	Very low	36.1	Very low	99 Å²	99	91.3 Å²	91.3	64%	0.643	49%	0.491	S	S	*	.	H	α-helix	trans	-62.8	-29.3	174.9	-21.6	34.4	0	0	0	113.1
384	T	37.5	Very low	36.4	Very low	74 Å²	74	87.9 Å²	87.9	45%	0.454	48%	0.483	S	S	.	.	H	α-helix	trans	-79.6	-28.4	175.6	-31.7	0	0	0	0	112.3	A381 W382 E416	A381-T384 WeakPolarHBondContact O-CB 3.38Å; A381-T384 PolarHBondContact O-N 3.14Å; W382-T384 PolarHBondContact O-N 3Å; T384-E416 WeakPolarHBondContact CB-OE1 3.28Å; T384-E416 HydrophobicContact CG2-CG 3.94Å; T384-E416 WeakPolarHBondContact CG2-OE1 3.44Å; T384-E416 PolarHBondContact OG1-OE1 3.42Å
385	L	40	Very low	36.3	Very low	45 Å²	45	90.5 Å²	90.5	24%	0.236	50%	0.495	C	S	.	.	H	α-helix	trans	-75.6	-32.3	178.2	-96.5	154	0	0	0	114	A381 W382 G387 T388 C414	A381-L385 HydrophobicContact CB-CD1 4.34Å; A381-L385 PolarHBondContact O-N 3.31Å; W382-L385 WeakPolarHBondContact O-CB 3.39Å; W382-L385 PolarHBondContact O-N 3.04Å; W382-L385 VanDerWaalsContact O-N 3.14Å; L385-G387 PolarHBondContact O-N 3.01Å; L385-G387 VanDerWaalsContact O-N 3.08Å; L385-T388 PolarHBondContact O-N 2.93Å; L385-T388 VanDerWaalsContact O-N 3.14Å; L385-T388 PolarHBondContact O-OG1 2.83Å; L385-C414 HydrophobicContact CD1-CB 3.93Å; L385-C414 VanDerWaalsContact CD1-SG 3.57Å; L385-C414 HydrophobicContact CD2-CB 4.08Å; L385-C414 WeakPolarHBondContact CD2-SG 3.48Å; L385-C414 HydrophobicContact CG-CB 4.2Å
386	A	37.1	Very low	36.1	Very low	64 Å²	64	92 Å²	92	53%	0.529	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-9.1	179.3	0	0	0	0	0	114.3	W382 T388	W382-A386 PolarHBondContact O-N 3.32Å; A386-T388 VanDerWaalsContact C-N 3.32Å
387	G	36.3	Very low	36	Very low	72 Å²	72	87.9 Å²	87.9	74%	0.742	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	3	172.9	0	0	0	0	0	115	L385	L385-G387 PolarHBondContact O-N 3.01Å; L385-G387 VanDerWaalsContact O-N 3.08Å
388	T	39.9	Very low	35.7	Very low	79 Å²	79	85 Å²	85	49%	0.485	50%	0.495	S	S	.	.	S	Bend	trans	-107.3	129	-176.8	61.8	0	0	0	0	111.1	L385 A386 V390	L385-T388 PolarHBondContact O-N 2.93Å; L385-T388 VanDerWaalsContact O-N 3.14Å; L385-T388 PolarHBondContact O-OG1 2.83Å; A386-T388 VanDerWaalsContact C-N 3.32Å; T388-V390 PolarHBondContact O-N 2.9Å
389	N	38.5	Very low	35.3	Very low	176 Å²	176	89.6 Å²	89.6	94%	0.941	54%	0.535	S	S	*	.			trans	-66.2	63	175.9	-91.8	-29.6	0	0	0	111.9
390	V	39.7	Very low	35.1	Very low	75 Å²	75	90.1 Å²	90.1	46%	0.455	55%	0.546	S	S	.	.			trans	-89.5	119.7	174.8	-177.9	0	0	0	0	108.7	T388 W392 L395	T388-V390 PolarHBondContact O-N 2.9Å; V390-W392 PolarHBondContact O-N 3.2Å; V390-L395 HydrophobicContact CG1-CD1 4.06Å; V390-L395 HydrophobicContact CG1-CG 4.25Å
391	P	35.2	Very low	34.7	Very low	87 Å²	87	88.6 Å²	88.6	57%	0.565	54%	0.54	S	S	*	.			trans	-60.7	125.4	176.3	-19.1	30.2	0	0	0	110.5	N393 A394	P391-N393 PolarHBondContact O-N 2.87Å; P391-A394 VanDerWaalsContact O-CB 3.26Å; P391-A394 WeakPolarHBondContact O-CB 3.36Å; P391-A394 PolarHBondContact O-N 3.03Å
392	W	33.3	Very low	34.4	Very low	112 Å²	112	91.2 Å²	91.2	42%	0.424	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-50.2	-34.1	-178.5	-174.8	-112.3	0	0	0	113.5	V390 A394 L395 N463 W467	V390-W392 PolarHBondContact O-N 3.2Å; W392-A394 PolarHBondContact O-N 3.45Å; W392-A394 VanDerWaalsContact O-N 3.12Å; W392-L395 PolarHBondContact O-N 2.72Å; W392-N463 HydrophobicContact CZ2-CB 4.49Å; W392-W467 HydrophobicContact CH2-CB 4.23Å
393	N	36.8	Very low	34.1	Very low	145 Å²	145	91.1 Å²	91.1	78%	0.775	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-62.7	-19.5	179.9	-38.1	-3.8	0	0	0	112.7	P391	P391-N393 PolarHBondContact O-N 2.87Å
394	A	36.5	Very low	34.2	Very low	46 Å²	46	91.5 Å²	91.5	38%	0.38	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-83.6	-12.1	176.8	0	0	0	0	0	113.2	M334 P391 W392	M334-A394 HydrophobicContact CE-CB 4.1Å; P391-A394 VanDerWaalsContact O-CB 3.26Å; P391-A394 WeakPolarHBondContact O-CB 3.36Å; P391-A394 PolarHBondContact O-N 3.03Å; W392-A394 PolarHBondContact O-N 3.45Å; W392-A394 VanDerWaalsContact O-N 3.12Å
395	L	32.5	Very low	34	Very low	76 Å²	76	90.7 Å²	90.7	40%	0.398	55%	0.546	S	S	.	.	S	Bend	trans	-111.8	-0.2	-174.3	-67.7	170.3	0	0	0	113.8	V390 W392 P397	V390-L395 HydrophobicContact CG1-CD1 4.06Å; V390-L395 HydrophobicContact CG1-CG 4.25Å; W392-L395 PolarHBondContact O-N 2.72Å; L395-P397 WeakPolarHBondContact O-CD 3.5Å
396	V	29	Very low	33.8	Very low	87 Å²	87	90.8 Å²	90.8	53%	0.527	55%	0.545	S	S	.	.			trans	-104.5	107.7	-178.6	-178.4	0	0	0	0	110	T398	V396-T398 PolarHBondContact O-N 3.12Å
397	P	30.9	Very low	33.8	Very low	58 Å²	58	90.7 Å²	90.7	38%	0.377	53%	0.531	S	S	.	.			trans	-70	127.8	169.2	-13	29	0	0	0	109.6	L395 F401 F406	L395-P397 WeakPolarHBondContact O-CD 3.5Å; P397-F401 HydrophobicContact CB-CB 3.48Å; P397-F401 VanDerWaalsContact CB-CB 3.48Å; P397-F401 HydrophobicContact CB-CD1 4.16Å; P397-F401 HydrophobicContact CB-CD2 4.18Å; P397-F401 HydrophobicContact CB-CG 3.68Å; P397-F401 HydrophobicContact CG-CB 4.46Å; P397-F406 HydrophobicContact CG-CD2 4.12Å
398	T	27.9	Very low	33.8	Very low	107 Å²	107	93.4 Å²	93.4	66%	0.656	52%	0.524	S	S	*	.			trans	-48.8	149.2	165.2	26.7	0	0	0	0	111.2	V396 T400 F401	V396-T398 PolarHBondContact O-N 3.12Å; T398-T400 PolarHBondContact O-N 2.99Å; T398-F401 PolarHBondContact O-N 3.01Å
399	A	27.8	Very low	33.6	Very low	116 Å²	116	94.4 Å²	94.4	96%	0.959	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	13	-166.4	0	0	0	0	0	118.3
400	T	29.3	Very low	33.5	Very low	128 Å²	128	87.6 Å²	87.6	79%	0.785	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	5.1	178.8	48.4	0	0	0	0	113.5	T398	T398-T400 PolarHBondContact O-N 2.99Å
401	F	28	Very low	33.3	Very low	121 Å²	121	87.3 Å²	87.3	53%	0.531	49%	0.489	S	S	.	.			trans	-95.6	122.1	-170.5	-109	-101.7	0	0	0	114.5	P397 T398 V403 N405	P397-F401 HydrophobicContact CB-CB 3.48Å; P397-F401 VanDerWaalsContact CB-CB 3.48Å; P397-F401 HydrophobicContact CB-CD1 4.16Å; P397-F401 HydrophobicContact CB-CD2 4.18Å; P397-F401 HydrophobicContact CB-CG 3.68Å; P397-F401 HydrophobicContact CG-CB 4.46Å; T398-F401 PolarHBondContact O-N 3.01Å; F401-V403 PolarHBondContact O-N 3.28Å; F401-N405 HydrophobicContact CD1-CB 4.1Å; F401-N405 HydrophobicContact CE1-CB 4.21Å
402	N	32.2	Very low	33.2	Very low	83 Å²	83	90 Å²	90	44%	0.444	50%	0.498	S	S	.	.			trans	-60.5	125.4	172.2	-174.3	-20.2	0	0	0	110.6	N404 N405	N402-N404 PolarHBondContact O-N 3.01Å; N402-N404 PolarHBondContact OD1-N 3.27Å; N402-N405 WeakPolarHBondContact O-CB 3.26Å; N402-N405 PolarHBondContact O-N 2.96Å
403	V	33.4	Very low	33	Very low	63 Å²	63	87.4 Å²	87.4	38%	0.382	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.6	-171.5	-148.9	0	0	0	0	112.9	F401 N405 Y478	F401-V403 PolarHBondContact O-N 3.28Å; V403-N405 VanDerWaalsContact C-N 3.29Å; V403-N405 PolarHBondContact O-N 3.46Å; V403-Y478 HydrophobicContact CB-CE2 3.81Å; V403-Y478 HydrophobicContact CG1-CE2 4.5Å; V403-Y478 HydrophobicContact CG2-CE2 3.5Å; V403-Y478 VanDerWaalsContact CG2-CE2 3.5Å; V403-Y478 WeakPolarHBondContact CG2-OH 3.35Å
404	N	35.7	Very low	32.7	Very low	108 Å²	108	84.1 Å²	84.1	58%	0.578	49%	0.494	S	S	*	.	H	α-helix	trans	-69.2	-22.8	169.6	-75	-22	0	0	0	113.5	N402	N402-N404 PolarHBondContact O-N 3.01Å; N402-N404 PolarHBondContact OD1-N 3.27Å
405	N	35	Very low	32.6	Very low	57 Å²	57	86.8 Å²	86.8	31%	0.305	51%	0.509	S	S	.	.	H	α-helix	trans	-83.8	-21.3	-175.8	-68.6	-16.1	0	0	0	113.4	F401 N402 V403 T409	F401-N405 HydrophobicContact CD1-CB 4.1Å; F401-N405 HydrophobicContact CE1-CB 4.21Å; N402-N405 WeakPolarHBondContact O-CB 3.26Å; N402-N405 PolarHBondContact O-N 2.96Å; V403-N405 VanDerWaalsContact C-N 3.29Å; V403-N405 PolarHBondContact O-N 3.46Å; N405-T409 PolarHBondContact O-N 3.05Å; N405-T409 PolarHBondContact O-OG1 3.27Å
406	F	34.8	Very low	32.4	Very low	47 Å²	47	90 Å²	90	21%	0.206	52%	0.522	C	S	.	.	H	α-helix	trans	-68.3	-37.2	-177.9	-173.7	-105.7	0	0	0	112.8	P397 L410	P397-F406 HydrophobicContact CG-CD2 4.12Å; F406-L410 HydrophobicContact CD1-CD1 3.94Å; F406-L410 HydrophobicContact CE1-CD1 3.4Å; F406-L410 VanDerWaalsContact CE1-CD1 3.4Å; F406-L410 HydrophobicContact CE2-CD1 4.14Å; F406-L410 HydrophobicContact CZ-CD1 3.52Å; F406-L410 PolarHBondContact O-N 2.75Å
407	W	36.9	Very low	32.6	Very low	61 Å²	61	89.6 Å²	89.6	23%	0.231	53%	0.528	C	S	.	.	H	α-helix	trans	-73.1	-30.8	-177.5	-68.4	105.2	0	0	0	113.4	V375 V378 L411 L471	V375-W407 HydrophobicContact CG1-CH2 4.29Å; V375-W407 HydrophobicContact CG1-CZ3 4.41Å; V375-W407 HydrophobicContact CG2-CE3 4.18Å; V375-W407 HydrophobicContact CG2-CH2 4.42Å; V375-W407 HydrophobicContact CG2-CZ3 4.13Å; V378-W407 HydrophobicContact CG1-CZ3 4.3Å; W407-L411 VanDerWaalsContact O-CD1 3.26Å; W407-L411 WeakPolarHBondContact O-CD1 3.5Å; W407-L411 WeakPolarHBondContact O-CG 3.36Å; W407-L411 PolarHBondContact O-N 3.44Å; W407-L471 HydrophobicContact CH2-CD1 3.85Å; W407-L471 HydrophobicContact CH2-CD2 4.46Å; W407-L471 HydrophobicContact CZ2-CD1 3.57Å; W407-L471 HydrophobicContact CZ2-CG 4.38Å
408	Q	36	Very low	32.7	Very low	130 Å²	130	92.9 Å²	92.9	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-74.5	-32.7	177.5	-70.8	-77.1	8.4	0	0	112
409	T	35.9	Very low	32.9	Very low	99 Å²	99	95.5 Å²	95.5	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-74.8	-32.1	177	-51	0	0	0	0	112.6	N405 L411	N405-T409 PolarHBondContact O-N 3.05Å; N405-T409 PolarHBondContact O-OG1 3.27Å; T409-L411 VanDerWaalsContact C-N 3.32Å
410	L	36.2	Very low	33	Very low	33 Å²	33	101.8 Å²	101.8	17%	0.173	55%	0.55	C	S	.	.	H	α-helix	trans	-71.2	-24.8	174.9	-111.7	125.8	0	0	0	113.4	V378 W382 F406 L412	V378-L410 HydrophobicContact CG1-CD2 3.88Å; W382-L410 HydrophobicContact CZ3-CD2 4.3Å; F406-L410 HydrophobicContact CD1-CD1 3.94Å; F406-L410 HydrophobicContact CE1-CD1 3.4Å; F406-L410 VanDerWaalsContact CE1-CD1 3.4Å; F406-L410 HydrophobicContact CE2-CD1 4.14Å; F406-L410 HydrophobicContact CZ-CD1 3.52Å; F406-L410 PolarHBondContact O-N 2.75Å; L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.14Å
411	L	36.2	Very low	33.1	Very low	70 Å²	70	105.7 Å²	105.7	37%	0.366	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-10.7	-178.9	-81.6	161	0	0	0	114.7	S374 W407 T409	S374-L411 VanDerWaalsContact CB-CD2 3.47Å; W407-L411 VanDerWaalsContact O-CD1 3.26Å; W407-L411 WeakPolarHBondContact O-CD1 3.5Å; W407-L411 WeakPolarHBondContact O-CG 3.36Å; W407-L411 PolarHBondContact O-N 3.44Å; T409-L411 VanDerWaalsContact C-N 3.32Å
412	L	33.9	Very low	33.1	Very low	143 Å²	143	105.1 Å²	105.1	75%	0.749	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	6.1	-176.3	-74.3	163.5	0	0	0	113.7	L410	L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.14Å
413	G	29.4	Very low	33	Very low	58 Å²	58	106.1 Å²	106.1	60%	0.598	59%	0.587	S	S	*	*	S	Bend	trans	-112.4	-12.5	-164.7	0	0	0	0	0	118.5
414	C	30.1	Very low	32.8	Very low	75 Å²	75	108.4 Å²	108.4	51%	0.507	61%	0.606	S	S	.	*			trans	-149	111.5	-162	-45.6	0	0	0	0	113.4	L385	L385-C414 HydrophobicContact CD1-CB 3.93Å; L385-C414 VanDerWaalsContact CD1-SG 3.57Å; L385-C414 HydrophobicContact CD2-CB 4.08Å; L385-C414 WeakPolarHBondContact CD2-SG 3.48Å; L385-C414 HydrophobicContact CG-CB 4.2Å
415	S	33.1	Very low	32.6	Very low	102 Å²	102	109.2 Å²	109.2	71%	0.713	62%	0.615	S	S	*	*			trans	-125.7	134.6	165.8	142.7	0	0	0	0	108.9	A417	S415-A417 PolarHBondContact O-N 3.08Å
416	E	28.8	Very low	32.4	Very low	143 Å²	143	113.8 Å²	113.8	67%	0.668	64%	0.639	S	S	*	*	S	Bend	trans	-95.5	30.1	-163.7	-160.5	172.6	-174.9	0	0	112.8	T384	T384-E416 WeakPolarHBondContact CB-OE1 3.28Å; T384-E416 HydrophobicContact CG2-CG 3.94Å; T384-E416 WeakPolarHBondContact CG2-OE1 3.44Å; T384-E416 PolarHBondContact OG1-OE1 3.42Å
417	A	33.8	Very low	32.2	Very low	79 Å²	79	120.3 Å²	120.3	65%	0.653	67%	0.67	S	S	*	*			trans	-117.8	-5.5	-164.6	0	0	0	0	0	117.8	S415	S415-A417 PolarHBondContact O-N 3.08Å
418	D	32.4	Very low	32.2	Very low	128 Å²	128	126 Å²	126	68%	0.684	70%	0.699	S	S	*	*	S	Bend	trans	-108.4	12.4	-169.2	-75.8	-33.7	0	0	0	116.8
419	I	32.5	Very low	32	Very low	161 Å²	161	127.1 Å²	127.1	83%	0.826	70%	0.704	S	S	*	*	S	Bend	trans	-109.1	12.1	-170.2	-59.9	178.5	0	0	0	114.7
420	R	29.4	Very low	31.7	Very low	248 Å²	248	134.6 Å²	134.6	94%	0.936	72%	0.721	S	S	*	*	S	Bend	trans	-119.1	17.8	-178.2	-73.9	-171.4	-179.2	179.6	2.2	117.9
421	K	30.8	Very low	31.6	Very low	210 Å²	210	140.5 Å²	140.5	91%	0.913	75%	0.751	S	S	*	*	S	Bend	trans	-136.2	15.5	177.8	-86.1	-173.8	177.5	177.9	0	117.2
422	S	29.3	Very low	31.4	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	77%	0.77	S	S	*	*	S	Bend	trans	-118.6	9	178.3	55	0	0	0	0	115.8
423	A	30	Very low	31.4	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	77%	0.772	S	S	*	*			trans	-112.8	31.8	-179.5	0	0	0	0	0	114
424	S	29.4	Very low	31.8	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	78%	0.779	S	S	*	*	S	Bend	trans	-123.9	48.8	176.1	178.1	0	0	0	0	111.5
425	V	30.4	Very low	32	Very low	125 Å²	125	147 Å²	147	76%	0.758	80%	0.796	S	S	*	*	S	Bend	trans	-151.3	139.7	157.5	-169.3	0	0	0	0	105.5
426	D	31.1	Very low	31.9	Very low	153 Å²	153	151 Å²	151	82%	0.818	81%	0.805	S	S	*	*			trans	91.4	53	177.9	-54.3	-27.3	0	0	0	118
427	H	30.7	Very low	32.2	Very low	183 Å²	183	148.8 Å²	148.8	85%	0.847	81%	0.812	S	S	*	*			trans	-125.3	71	146.2	-144	63.2	0	0	0	110
428	H	36.3	Very low	32.3	Very low	182 Å²	182	149.4 Å²	149.4	84%	0.843	82%	0.817	S	S	*	*			trans	-105.3	98	158.8	-99.8	-47.2	0	0	0	109.9	R430	H428-R430 PolarHBondContact O-N 2.77Å
429	Q	31.8	Very low	32.4	Very low	152 Å²	152	149.4 Å²	149.4	71%	0.71	82%	0.822	S	S	*	*			trans	0.2	107.8	142.3	-76.4	160.8	-26.5	0	0	115.7
430	R	29.8	Very low	32.7	Very low	257 Å²	257	147.1 Å²	147.1	97%	0.97	82%	0.82	S	S	*	*			trans	-101.8	103.8	150.4	-119.7	-179.1	-174.6	-179.6	2.5	107.5	H428	H428-R430 PolarHBondContact O-N 2.77Å
431	I	34.4	Very low	33	Very low	156 Å²	156	144.2 Å²	144.2	80%	0.8	82%	0.817	S	S	*	*			trans	-106.1	128.9	168.5	-63.7	175.5	0	0	0	106.8
432	G	32.1	Very low	33.2	Very low	75 Å²	75	139.9 Å²	139.9	77%	0.773	81%	0.811	S	S	*	*			trans	144.5	88.5	167.8	0	0	0	0	0	114.9
433	A	33.1	Very low	33.6	Very low	96 Å²	96	143.4 Å²	143.4	79%	0.793	82%	0.82	S	S	*	*			trans	-76.2	-165.5	167.6	0	0	0	0	0	111.4
434	P	38	Very low	33.7	Very low	115 Å²	115	143 Å²	143	75%	0.747	82%	0.816	S	S	*	*			cis	-137.5	175	-35.8	25.9	-3.9	0	0	0	113.6
435	K	34.2	Very low	34	Very low	198 Å²	198	146.9 Å²	146.9	86%	0.861	82%	0.824	S	S	*	*			trans	165.3	109.5	135.4	-97	176.9	175.6	178.9	0	109.5
436	M	31.3	Very low	34.2	Very low	184 Å²	184	144.7 Å²	144.7	91%	0.906	82%	0.82	S	S	*	*				56.6	103.8	81.7	-73.7	-109.5	-83.7	0	0	114.9
437	A	34.8	Very low	34.2	Very low	97 Å²	97	145.5 Å²	145.5	80%	0.802	82%	0.824	S	S	*	*				-178.1	128	118.2	0	0	0	0	0	113.3
438	A	35.5	Very low	34.4	Very low	92 Å²	92	144.9 Å²	144.9	76%	0.76	82%	0.821	S	S	*	*			trans	66.1	137.7	143.6	0	0	0	0	0	119.8
439	T	35.5	Very low	34.3	Very low	128 Å²	128	140.5 Å²	140.5	79%	0.785	82%	0.817	S	S	*	*			cis	-174.6	155.6	6.5	13.3	0	0	0	0	109.3
440	S	39.1	Very low	34.4	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	82%	0.816	S	S	*	*			trans	62.6	132.6	161.8	56.5	0	0	0	0	118.7
441	E	36	Very low	34.7	Very low	186 Å²	186	132.4 Å²	132.4	87%	0.869	80%	0.802	S	S	*	*			cis	-163.6	155.4	12.4	-117.2	-174.4	172.1	0	0	108
442	P	34.9	Very low	34.8	Very low	120 Å²	120	130.7 Å²	130.7	78%	0.779	80%	0.795	S	S	*	*			trans	-106.1	137.8	-176.1	36	-25.1	0	0	0	113.4
443	L	36.6	Very low	35	Very low	183 Å²	183	130.6 Å²	130.6	96%	0.958	78%	0.782	S	S	*	*			trans	-136.1	127.6	161.4	-91.8	168.8	0	0	0	111.4
444	A	32.2	Very low	35.2	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	77%	0.772	S	S	*	*			trans	-76.7	131.8	-172.2	0	0	0	0	0	113.1
445	M	35.3	Very low	35.4	Very low	193 Å²	193	129.6 Å²	129.6	95%	0.951	76%	0.76	S	S	*	*			trans	-164.9	141.3	149.8	-83.2	-152.3	169.5	0	0	106.7
446	A	35.2	Very low	35.7	Very low	80 Å²	80	122.7 Å²	122.7	66%	0.661	74%	0.74	S	S	*	*			cis	-170.2	143.5	-13.7	0	0	0	0	0	104.4	Q448	A446-Q448 PolarHBondContact O-N 2.95Å
447	N	31.9	Very low	36.2	Very low	169 Å²	169	116.2 Å²	116.2	90%	0.904	72%	0.716	S	S	*	*			trans	-52	113.2	168.6	-70.4	-37.1	0	0	0	110.9
448	Q	33.6	Very low	36.7	Very low	170 Å²	170	117 Å²	117	79%	0.794	71%	0.707	S	S	*	*			trans	-157.8	4.1	168.1	-114.2	170.2	27	0	0	116.1	A446	A446-Q448 PolarHBondContact O-N 2.95Å
449	A	34.4	Very low	37.2	Very low	91 Å²	91	118.3 Å²	118.3	75%	0.752	70%	0.697	S	S	*	*	S	Bend	trans	-92.8	-4.7	-170.9	0	0	0	0	0	115.9
450	T	35	Very low	37.5	Very low	111 Å²	111	118.3 Å²	118.3	68%	0.681	69%	0.69	S	S	*	*	S	Bend	trans	-104.3	0.2	-169.3	54.5	0	0	0	0	115.6
451	N	35.6	Very low	37.9	Very low	127 Å²	127	117.1 Å²	117.1	68%	0.679	67%	0.673	S	S	*	*	S	Bend	trans	-106	-5.3	-179.9	-70.6	-1.6	0	0	0	114.4	T455	N451-T455 PolarHBondContact O-OG1 3.24Å; N451-T455 VanDerWaalsContact O-OG1 3.09Å
452	N	37.3	Very low	38.5	Very low	121 Å²	121	111.2 Å²	111.2	65%	0.647	65%	0.653	S	S	*	*	H	α-helix	trans	-91.5	-16.7	-178.2	-77.5	-10.5	0	0	0	113.9	T455 A456	N452-T455 WeakPolarHBondContact CA-OG1 3.38Å; N452-T455 PolarHBondContact O-OG1 3.05Å; N452-A456 PolarHBondContact O-N 2.93Å
453	S	35.7	Very low	39	Very low	73 Å²	73	108 Å²	108	51%	0.51	63%	0.629	S	S	.	*	H	α-helix	trans	-75.2	-39.7	179.3	53.3	0	0	0	0	112.3	A456 A457	S453-A456 PolarHBondContact O-N 3.33Å; S453-A457 PolarHBondContact O-N 2.89Å; S453-A457 VanDerWaalsContact O-N 3.11Å
454	D	36.4	Very low	39.4	Very low	109 Å²	109	103.5 Å²	103.5	58%	0.583	61%	0.606	S	S	*	*	H	α-helix	trans	-72.8	-37.1	-176.8	-67	-6.5	0	0	0	111.1	A456 A457 D458	D454-A456 VanDerWaalsContact C-N 3.35Å; D454-A456 PolarHBondContact O-N 3.5Å; D454-A457 PolarHBondContact O-N 3.48Å; D454-D458 PolarHBondContact O-N 2.92Å
455	T	41.9	Very low	40.3	Very low	81 Å²	81	106.5 Å²	106.5	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-65.2	-35.9	172.8	30.4	0	0	0	0	112.5	N451 N452 Q459	N451-T455 PolarHBondContact O-OG1 3.24Å; N451-T455 VanDerWaalsContact O-OG1 3.09Å; N452-T455 WeakPolarHBondContact CA-OG1 3.38Å; N452-T455 PolarHBondContact O-OG1 3.05Å; T455-Q459 VanDerWaalsContact O-CB 3.28Å; T455-Q459 WeakPolarHBondContact O-CB 3.45Å; T455-Q459 PolarHBondContact O-N 3.43Å
456	A	40.7	Very low	40.9	Very low	53 Å²	53	99.5 Å²	99.5	44%	0.438	57%	0.569	S	S	.	*	H	α-helix	trans	-67.5	-41	175	0	0	0	0	0	112.1	N452 S453 D454 Q459 M460	N452-A456 PolarHBondContact O-N 2.93Å; S453-A456 PolarHBondContact O-N 3.33Å; D454-A456 VanDerWaalsContact C-N 3.35Å; D454-A456 PolarHBondContact O-N 3.5Å; A456-Q459 PolarHBondContact O-N 3.43Å; A456-M460 WeakPolarHBondContact O-CG 3.47Å; A456-M460 PolarHBondContact O-N 3.18Å
457	A	42.2	Very low	41.6	Very low	48 Å²	48	98.6 Å²	98.6	40%	0.397	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-43.7	176.7	0	0	0	0	0	112.1	S453 D454 M460 L461	S453-A457 PolarHBondContact O-N 2.89Å; S453-A457 VanDerWaalsContact O-N 3.11Å; D454-A457 PolarHBondContact O-N 3.48Å; A457-M460 WeakPolarHBondContact O-CB 3.5Å; A457-M460 PolarHBondContact O-N 2.98Å; A457-L461 PolarHBondContact O-N 3.42Å
458	D	45	Very low	42.4	Very low	114 Å²	114	94.4 Å²	94.4	61%	0.61	52%	0.523	S	S	*	.	H	α-helix	trans	-64.2	-40.2	176.1	-80.7	-24.1	0	0	0	112.2	D454 M460 L461 S462	D454-D458 PolarHBondContact O-N 2.92Å; D458-M460 VanDerWaalsContact C-N 3.34Å; D458-M460 PolarHBondContact O-N 2.9Å; D458-L461 PolarHBondContact O-N 3.24Å; D458-S462 WeakPolarHBondContact O-CB 3.14Å; D458-S462 PolarHBondContact O-N 3.44Å
459	Q	45.9	Very low	43.2	Very low	118 Å²	118	91.1 Å²	91.1	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-41.8	174.9	-163.8	77	35.4	0	0	111.2	T455 A456 S462 N463	T455-Q459 VanDerWaalsContact O-CB 3.28Å; T455-Q459 WeakPolarHBondContact O-CB 3.45Å; T455-Q459 PolarHBondContact O-N 3.43Å; A456-Q459 PolarHBondContact O-N 3.43Å; Q459-S462 PolarHBondContact O-N 3.19Å; Q459-N463 WeakPolarHBondContact O-CB 2.82Å; Q459-N463 PolarHBondContact O-N 3.33Å; Q459-N463 PolarHBondContact O-ND2 2.98Å
460	M	43	Very low	43.9	Very low	129 Å²	129	92.1 Å²	92.1	64%	0.635	50%	0.503	S	S	*	.	H	α-helix	trans	-62.4	-43.9	174.8	-76.6	-179.6	70.8	0	0	112	A456 A457 D458 N463 L464	A456-M460 WeakPolarHBondContact O-CG 3.47Å; A456-M460 PolarHBondContact O-N 3.18Å; A457-M460 WeakPolarHBondContact O-CB 3.5Å; A457-M460 PolarHBondContact O-N 2.98Å; D458-M460 VanDerWaalsContact C-N 3.34Å; D458-M460 PolarHBondContact O-N 2.9Å; M460-N463 PolarHBondContact O-N 3.06Å; M460-L464 WeakPolarHBondContact O-CB 3.02Å; M460-L464 PolarHBondContact O-N 3.28Å
461	L	46.6	Very low	44.5	Very low	88 Å²	88	89.1 Å²	89.1	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-41.2	177.1	-117.5	97.4	0	0	0	112.1	A457 D458 L464 R465	A457-L461 PolarHBondContact O-N 3.42Å; D458-L461 PolarHBondContact O-N 3.24Å; L461-L464 PolarHBondContact O-N 3.22Å; L461-R465 WeakPolarHBondContact O-CG 3.26Å; L461-R465 PolarHBondContact O-N 3.45Å
462	S	48.7	Very low	45.2	Very low	63 Å²	63	85 Å²	85	44%	0.441	46%	0.46	S	S	.	.	H	α-helix	trans	-61.5	-46.4	176	-174.8	0	0	0	0	111.5	D458 Q459 L464 R465 A466	D458-S462 WeakPolarHBondContact O-CB 3.14Å; D458-S462 PolarHBondContact O-N 3.44Å; Q459-S462 PolarHBondContact O-N 3.19Å; S462-L464 VanDerWaalsContact C-N 3.32Å; S462-L464 PolarHBondContact O-N 3.16Å; S462-R465 PolarHBondContact O-N 2.91Å; S462-A466 PolarHBondContact O-N 3.48Å
463	N	45	Very low	45.8	Very low	53 Å²	53	81 Å²	81	28%	0.283	44%	0.444	S	S	.	.	H	α-helix	trans	-63.3	-38.3	176.8	-68.6	-17.3	0	0	0	112	W392 Q459 M460 A466 W467	W392-N463 HydrophobicContact CZ2-CB 4.49Å; Q459-N463 WeakPolarHBondContact O-CB 2.82Å; Q459-N463 PolarHBondContact O-N 3.33Å; Q459-N463 PolarHBondContact O-ND2 2.98Å; M460-N463 PolarHBondContact O-N 3.06Å; N463-A466 PolarHBondContact O-N 2.91Å; N463-W467 WeakPolarHBondContact O-CB 3.14Å; N463-W467 PolarHBondContact O-N 3.42Å
464	L	46.2	Very low	46.3	Very low	88 Å²	88	78.4 Å²	78.4	46%	0.461	43%	0.428	S	S	.	.	H	α-helix	trans	-65.3	-41.4	176.6	-167.6	109	0	0	0	111.9	M460 L461 S462 W467 K468	M460-L464 WeakPolarHBondContact O-CB 3.02Å; M460-L464 PolarHBondContact O-N 3.28Å; L461-L464 PolarHBondContact O-N 3.22Å; S462-L464 VanDerWaalsContact C-N 3.32Å; S462-L464 PolarHBondContact O-N 3.16Å; L464-W467 PolarHBondContact O-N 3.19Å; L464-K468 PolarHBondContact O-N 3Å
465	R	50.4	Low	46.6	Very low	158 Å²	158	75.3 Å²	75.3	60%	0.596	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-48.2	173.9	-72.9	178.6	-172.5	142	1.6	111.2	L461 S462 W467 K468 D469	L461-R465 WeakPolarHBondContact O-CG 3.26Å; L461-R465 PolarHBondContact O-N 3.45Å; S462-R465 PolarHBondContact O-N 2.91Å; R465-W467 VanDerWaalsContact C-N 3.27Å; R465-W467 PolarHBondContact O-N 3.22Å; R465-K468 PolarHBondContact O-N 2.94Å; R465-K468 VanDerWaalsContact O-N 3.16Å; R465-D469 VanDerWaalsContact O-CG 3.28Å; R465-D469 PolarHBondContact O-N 2.92Å
466	A	48.9	Very low	46.8	Very low	45 Å²	45	78.3 Å²	78.3	37%	0.372	42%	0.416	S	S	.	.	H	α-helix	trans	-60.1	-37.2	176.8	0	0	0	0	0	112.3	S462 N463 N470	S462-A466 PolarHBondContact O-N 3.48Å; N463-A466 PolarHBondContact O-N 2.91Å; A466-N470 WeakPolarHBondContact O-CB 3.37Å; A466-N470 PolarHBondContact O-N 3Å; A466-N470 PolarHBondContact O-ND2 3.47Å
467	W	49.6	Very low	46.9	Very low	61 Å²	61	85.1 Å²	85.1	23%	0.231	43%	0.43	C	S	.	.	H	α-helix	trans	-66.6	-46.8	173.7	179.9	83.3	0	0	0	112.1	W382 W392 N463 L464 R465 D469 N470 L471	W382-W467 HydrophobicContact CH2-CZ2 4.41Å; W392-W467 HydrophobicContact CH2-CB 4.23Å; N463-W467 WeakPolarHBondContact O-CB 3.14Å; N463-W467 PolarHBondContact O-N 3.42Å; L464-W467 PolarHBondContact O-N 3.19Å; R465-W467 VanDerWaalsContact C-N 3.27Å; R465-W467 PolarHBondContact O-N 3.22Å; W467-D469 VanDerWaalsContact C-N 3.31Å; W467-D469 PolarHBondContact O-N 2.86Å; W467-N470 PolarHBondContact O-N 2.92Å; W467-L471 HydrophobicContact CH2-CD1 4.46Å; W467-L471 HydrophobicContact CH2-CD2 3.97Å; W467-L471 HydrophobicContact CZ2-CD1 4.01Å; W467-L471 HydrophobicContact CZ2-CD2 4.35Å; W467-L471 HydrophobicContact CZ3-CD2 4.27Å; W467-L471 VanDerWaalsContact O-CB 3.28Å; W467-L471 WeakPolarHBondContact O-CB 3.39Å; W467-L471 PolarHBondContact O-N 3.06Å
468	K	48.2	Very low	46.7	Very low	82 Å²	82	89.3 Å²	89.3	36%	0.357	44%	0.437	S	S	.	.	H	α-helix	trans	-55.2	-47.7	174.6	-179.8	-178	176.9	177	0	110.4	L464 R465 L471 I472 D486	L464-K468 PolarHBondContact O-N 3Å; R465-K468 PolarHBondContact O-N 2.94Å; R465-K468 VanDerWaalsContact O-N 3.16Å; K468-L471 WeakPolarHBondContact O-CB 3.48Å; K468-L471 PolarHBondContact O-N 2.99Å; K468-I472 HydrophobicContact CD-CD1 4.3Å; K468-I472 HydrophobicContact CG-CD1 3.73Å; K468-I472 HydrophobicContact CG-CG1 4.44Å; K468-I472 WeakPolarHBondContact O-CB 3.21Å; K468-I472 VanDerWaalsContact O-CG1 3.24Å; K468-I472 WeakPolarHBondContact O-CG1 3.25Å; K468-I472 PolarHBondContact O-N 3.26Å; K468-D486 PolarHBondContact NZ-OXT 3.49Å
469	D	50.7	Low	46.6	Very low	100 Å²	100	88.5 Å²	88.5	54%	0.535	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-42.1	-178.2	-67.6	-21.1	0	0	0	112	R465 W467 I472 A473	R465-D469 VanDerWaalsContact O-CG 3.28Å; R465-D469 PolarHBondContact O-N 2.92Å; W467-D469 VanDerWaalsContact C-N 3.31Å; W467-D469 PolarHBondContact O-N 2.86Å; D469-I472 PolarHBondContact O-N 3.32Å; D469-A473 WeakPolarHBondContact O-CB 3.48Å; D469-A473 PolarHBondContact O-N 3.41Å
470	N	48.9	Very low	46.2	Very low	113 Å²	113	86.8 Å²	86.8	60%	0.604	43%	0.428	S	S	*	.	H	α-helix	trans	-68.3	-37	175.9	-78	-51.4	0	0	0	112.6	A466 W467 A473 G474	A466-N470 WeakPolarHBondContact O-CB 3.37Å; A466-N470 PolarHBondContact O-N 3Å; A466-N470 PolarHBondContact O-ND2 3.47Å; W467-N470 PolarHBondContact O-N 2.92Å; N470-A473 PolarHBondContact O-N 3.18Å; N470-G474 PolarHBondContact O-N 3.15Å
471	L	47.9	Very low	46.2	Very low	47 Å²	47	86.4 Å²	86.4	25%	0.246	42%	0.42	C	S	.	.	H	α-helix	trans	-62.9	-50.6	174.3	-168.9	84.9	0	0	0	110.1	W407 W467 K468 A473 G474 V475	W407-L471 HydrophobicContact CH2-CD1 3.85Å; W407-L471 HydrophobicContact CH2-CD2 4.46Å; W407-L471 HydrophobicContact CZ2-CD1 3.57Å; W407-L471 HydrophobicContact CZ2-CG 4.38Å; W467-L471 HydrophobicContact CH2-CD1 4.46Å; W467-L471 HydrophobicContact CH2-CD2 3.97Å; W467-L471 HydrophobicContact CZ2-CD1 4.01Å; W467-L471 HydrophobicContact CZ2-CD2 4.35Å; W467-L471 HydrophobicContact CZ3-CD2 4.27Å; W467-L471 VanDerWaalsContact O-CB 3.28Å; W467-L471 WeakPolarHBondContact O-CB 3.39Å; W467-L471 PolarHBondContact O-N 3.06Å; K468-L471 WeakPolarHBondContact O-CB 3.48Å; K468-L471 PolarHBondContact O-N 2.99Å; L471-A473 VanDerWaalsContact C-N 3.32Å; L471-A473 PolarHBondContact O-N 3.48Å; L471-G474 PolarHBondContact O-N 3.25Å; L471-V475 WeakPolarHBondContact O-CB 3.18Å; L471-V475 WeakPolarHBondContact O-CG2 3.48Å; L471-V475 PolarHBondContact O-N 2.92Å
472	I	50.4	Low	45.9	Very low	42 Å²	42	84.6 Å²	84.6	22%	0.215	41%	0.411	C	S	.	.	H	α-helix	trans	-60.2	-43.7	176.9	-69.3	170.3	0	0	0	110.1	K468 D469 V475 R476	K468-I472 HydrophobicContact CD-CD1 4.3Å; K468-I472 HydrophobicContact CG-CD1 3.73Å; K468-I472 HydrophobicContact CG-CG1 4.44Å; K468-I472 WeakPolarHBondContact O-CB 3.21Å; K468-I472 VanDerWaalsContact O-CG1 3.24Å; K468-I472 WeakPolarHBondContact O-CG1 3.25Å; K468-I472 PolarHBondContact O-N 3.26Å; D469-I472 PolarHBondContact O-N 3.32Å; I472-V475 PolarHBondContact O-N 3.19Å; I472-R476 HydrophobicContact CG2-CG 4.3Å; I472-R476 VanDerWaalsContact O-CB 3.26Å; I472-R476 WeakPolarHBondContact O-CB 3.26Å; I472-R476 WeakPolarHBondContact O-CG 3.02Å; I472-R476 PolarHBondContact O-N 3.33Å
473	A	49.6	Very low	45.4	Very low	37 Å²	37	86.6 Å²	86.6	31%	0.306	42%	0.422	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.3	0	0	0	0	0	112.2	D469 N470 L471 R476 R477	D469-A473 WeakPolarHBondContact O-CB 3.48Å; D469-A473 PolarHBondContact O-N 3.41Å; N470-A473 PolarHBondContact O-N 3.18Å; L471-A473 VanDerWaalsContact C-N 3.32Å; L471-A473 PolarHBondContact O-N 3.48Å; A473-R476 PolarHBondContact O-N 3.32Å; A473-R477 WeakPolarHBondContact O-CG 3.25Å; A473-R477 PolarHBondContact O-N 3.11Å
474	G	46.8	Very low	45	Very low	17 Å²	17	87 Å²	87	18%	0.175	43%	0.433	C	S	.	.	H	α-helix	trans	-63.1	-49.6	175.4	0	0	0	0	0	111.5	N470 L471 R476 R477 Y478	N470-G474 PolarHBondContact O-N 3.15Å; L471-G474 PolarHBondContact O-N 3.25Å; G474-R476 VanDerWaalsContact C-N 3.32Å; G474-R476 PolarHBondContact O-N 3.33Å; G474-R477 WeakPolarHBondContact O-CB 3.31Å; G474-R477 PolarHBondContact O-N 3.32Å; G474-R477 VanDerWaalsContact O-N 3.12Å; G474-Y478 VanDerWaalsContact O-CD2 3.26Å; G474-Y478 WeakPolarHBondContact O-CD2 3.38Å; G474-Y478 PolarHBondContact O-N 3.5Å
475	V	43.3	Very low	44.4	Very low	45 Å²	45	88 Å²	88	27%	0.273	44%	0.437	S	S	.	.	H	α-helix	trans	-60	-42	177	172.8	0	0	0	0	111	L471 I472 R477 Y478 H479 I482	L471-V475 WeakPolarHBondContact O-CB 3.18Å; L471-V475 WeakPolarHBondContact O-CG2 3.48Å; L471-V475 PolarHBondContact O-N 2.92Å; I472-V475 PolarHBondContact O-N 3.19Å; V475-R477 PolarHBondContact O-N 3.14Å; V475-Y478 PolarHBondContact O-N 3.43Å; V475-H479 CarbonylContact O-C 3.57Å; V475-H479 WeakPolarHBondContact O-CA 3.26Å; V475-H479 WeakPolarHBondContact O-CB 3.22Å; V475-H479 PolarHBondContact O-N 3.5Å; V475-I482 HydrophobicContact CG1-CB 4.4Å; V475-I482 HydrophobicContact CG1-CD1 3.3Å; V475-I482 HydrophobicContact CG1-CG1 4.4Å; V475-I482 HydrophobicContact CG1-CG2 4.42Å
476	R	44.8	Very low	43.4	Very low	143 Å²	143	88.6 Å²	88.6	54%	0.54	45%	0.452	S	S	.	.	H	α-helix	trans	-66.7	-33	175.1	-75.2	178	-179.8	-172.3	3.7	113.2	I472 A473 G474 P480	I472-R476 HydrophobicContact CG2-CG 4.3Å; I472-R476 VanDerWaalsContact O-CB 3.26Å; I472-R476 WeakPolarHBondContact O-CB 3.26Å; I472-R476 WeakPolarHBondContact O-CG 3.02Å; I472-R476 PolarHBondContact O-N 3.33Å; A473-R476 PolarHBondContact O-N 3.32Å; G474-R476 VanDerWaalsContact C-N 3.32Å; G474-R476 PolarHBondContact O-N 3.33Å; R476-P480 WeakPolarHBondContact O-CA 3.48Å
477	R	43.9	Very low	43.1	Very low	197 Å²	197	90.8 Å²	90.8	74%	0.743	46%	0.456	S	S	*	.	H	α-helix	trans	-65.4	-39	174.8	-81.1	-175.7	-153.9	-177	7.3	112.5	A473 G474 V475	A473-R477 WeakPolarHBondContact O-CG 3.25Å; A473-R477 PolarHBondContact O-N 3.11Å; G474-R477 WeakPolarHBondContact O-CB 3.31Å; G474-R477 PolarHBondContact O-N 3.32Å; G474-R477 VanDerWaalsContact O-N 3.12Å; V475-R477 PolarHBondContact O-N 3.14Å
478	Y	37.4	Very low	42.8	Very low	136 Å²	136	92.3 Å²	92.3	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-93.1	-21.4	-178.2	-70.8	-78.6	0	0	0	113.5	V403 G474 V475	V403-Y478 HydrophobicContact CB-CE2 3.81Å; V403-Y478 HydrophobicContact CG1-CE2 4.5Å; V403-Y478 HydrophobicContact CG2-CE2 3.5Å; V403-Y478 VanDerWaalsContact CG2-CE2 3.5Å; V403-Y478 WeakPolarHBondContact CG2-OH 3.35Å; G474-Y478 VanDerWaalsContact O-CD2 3.26Å; G474-Y478 WeakPolarHBondContact O-CD2 3.38Å; G474-Y478 PolarHBondContact O-N 3.5Å; V475-Y478 PolarHBondContact O-N 3.43Å
479	H	42	Very low	42.5	Very low	96 Å²	96	92.9 Å²	92.9	44%	0.444	47%	0.474	S	S	.	.			trans	-143.9	80.1	-176.9	-125.6	-80.1	0	0	0	110.2	V475 Y481 I482	V475-H479 CarbonylContact O-C 3.57Å; V475-H479 WeakPolarHBondContact O-CA 3.26Å; V475-H479 WeakPolarHBondContact O-CB 3.22Å; V475-H479 PolarHBondContact O-N 3.5Å; H479-Y481 PolarHBondContact O-N 3.38Å; H479-I482 HydrophobicContact CB-CD1 3.54Å; H479-I482 HydrophobicContact CB-CG1 3.9Å; H479-I482 PolarHBondContact O-N 3.18Å
480	P	39	Very low	42	Very low	82 Å²	82	92.5 Å²	92.5	53%	0.532	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-3.7	-175	22.2	-31.4	0	0	0	114.8	R476	R476-P480 WeakPolarHBondContact O-CA 3.48Å
481	Y	42.8	Very low	41.6	Very low	122 Å²	122	91.2 Å²	91.2	48%	0.478	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	10.2	-175.7	-58.9	-74.3	0	0	0	114.4	I33 H479 P483	I33-Y481 HydrophobicContact CD1-CE2 3.99Å; H479-Y481 PolarHBondContact O-N 3.38Å; Y481-P483 VanDerWaalsContact O-CD 3.26Å; Y481-P483 WeakPolarHBondContact O-CD 3.37Å
482	I	39.4	Very low	41.2	Very low	50 Å²	50	94.1 Å²	94.1	26%	0.256	48%	0.477	S	S	.	.			trans	-69.3	116	169.3	-72.5	171.2	0	0	0	107	V475 H479 A484 I485	V475-I482 HydrophobicContact CG1-CB 4.4Å; V475-I482 HydrophobicContact CG1-CD1 3.3Å; V475-I482 HydrophobicContact CG1-CG1 4.4Å; V475-I482 HydrophobicContact CG1-CG2 4.42Å; H479-I482 HydrophobicContact CB-CD1 3.54Å; H479-I482 HydrophobicContact CB-CG1 3.9Å; H479-I482 PolarHBondContact O-N 3.18Å; I482-A484 PolarHBondContact O-N 3.41Å; I482-I485 HydrophobicContact CG2-CD1 4.3Å; I482-I485 HydrophobicContact CG2-CG1 4.33Å
483	P	38.2	Very low	40.5	Very low	104 Å²	104	97.9 Å²	97.9	68%	0.675	50%	0.496	S	S	*	.			trans	-53.1	136.2	171.3	-17.1	29.4	0	0	0	107.3	Y481 I485	Y481-P483 VanDerWaalsContact O-CD 3.26Å; Y481-P483 WeakPolarHBondContact O-CD 3.37Å; P483-I485 PolarHBondContact O-N 3.47Å
484	A	36.7	Very low	39.8	Very low	62 Å²	62	102.5 Å²	102.5	51%	0.512	51%	0.51	S	S	.	.			trans	-44	105.9	176.9	0	0	0	0	0	109.6	I482 D486	I482-A484 PolarHBondContact O-N 3.41Å; A484-D486 PolarHBondContact O-N 3.39Å
485	I	34.9	Very low	39.2	Very low	109 Å²	109	109.7 Å²	109.7	56%	0.559	54%	0.538	S	S	*	.			trans	-74.3	76.5	160	-59.7	173.9	0	0	0	102.8	I482 P483	I482-I485 HydrophobicContact CG2-CD1 4.3Å; I482-I485 HydrophobicContact CG2-CG1 4.33Å; P483-I485 PolarHBondContact O-N 3.47Å
486	D	28.8	Very low	38.9	Very low	170 Å²	170	115.5 Å²	115.5	91%	0.909	56%	0.562	S	S	*	*			trans	-71.5	0	174.6	-118.5	-18.7	0	0	0	110.5	K468 A484	K468-D486 PolarHBondContact NZ-OXT 3.49Å; A484-D486 PolarHBondContact O-N 3.39Å

Retrieved 486 of 486 residues in 111 ms (Link to these results)

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