A0A077ZAV0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZAV0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 240 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	38	Very low	243 Å²	243	165.3 Å²	165.3	100%	1.197	88%	0.884	S	S	*	*				0	118.9	0	-81.3	-178.3	165.4	0	0	108.2
2	L	39.1	Very low	37.6	Very low	179 Å²	179	172.2 Å²	172.2	94%	0.937	89%	0.888	S	S	*	*			trans	47.7	89.9	164.8	-61.6	168.6	0	0	0	119.7
3	T	40.9	Very low	37.2	Very low	142 Å²	142	168.5 Å²	168.5	87%	0.871	88%	0.878	S	S	*	*			trans	-91.8	117.5	154.7	46.4	0	0	0	0	109
4	G	39.2	Very low	36.9	Very low	83 Å²	83	164.7 Å²	164.7	86%	0.856	87%	0.869	S	S	*	*			trans	-101.3	98.7	177.9	0	0	0	0	0	111.6
5	E	42	Very low	36.5	Very low	193 Å²	193	164.2 Å²	164.2	90%	0.902	87%	0.874	S	S	*	*			trans	-82.6	115.5	166.9	-69.4	-168.8	137.9	0	0	109.4	N7	E5-N7 PolarHBondContact O-N 3.46Å
6	A	43.8	Very low	36.3	Very low	93 Å²	93	159.6 Å²	159.6	77%	0.769	86%	0.86	S	S	*	*			trans	-82.7	105	172.3	0	0	0	0	0	109.6	F8	A6-F8 PolarHBondContact O-N 2.82Å
7	N	37	Very low	35.9	Very low	162 Å²	162	159.2 Å²	159.2	87%	0.866	86%	0.855	S	S	*	*			trans	-69.7	113.8	174.4	-135.3	1.7	0	0	0	109.7	E5	E5-N7 PolarHBondContact O-N 3.46Å
8	F	35.7	Very low	35.8	Very low	196 Å²	196	155.1 Å²	155.1	86%	0.86	85%	0.847	S	S	*	*			trans	-101.7	101	174.9	-117.8	-88.8	0	0	0	109.7	A6	A6-F8 PolarHBondContact O-N 2.82Å
9	E	34.3	Very low	35.7	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	84%	0.843	S	S	*	*			trans	-82	128.4	167	-85.9	-169.7	145.3	0	0	110.8	R11	E9-R11 PolarHBondContact O-N 2.9Å
10	P	37	Very low	35.6	Very low	120 Å²	120	152.8 Å²	152.8	78%	0.779	84%	0.84	S	S	*	*			trans	-78.2	106.5	171.6	30	-31.6	0	0	0	110.7	R12	P10-R12 PolarHBondContact O-N 3.22Å; P10-R12 VanDerWaalsContact O-N 3.16Å
11	R	30.3	Very low	35.6	Very low	238 Å²	238	156.4 Å²	156.4	90%	0.898	84%	0.842	S	S	*	*			trans	-57.1	113.7	166.9	-81.4	-177	172.2	-159.3	-1.4	110.4	E9 V13	E9-R11 PolarHBondContact O-N 2.9Å; R11-V13 PolarHBondContact O-N 3.48Å
12	R	33	Very low	35.5	Very low	248 Å²	248	151.2 Å²	151.2	94%	0.936	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.5	119.5	167.6	-70	-177.2	176.7	-174.5	-0.7	109.7	P10	P10-R12 PolarHBondContact O-N 3.22Å; P10-R12 VanDerWaalsContact O-N 3.16Å
13	V	32.3	Very low	35.5	Very low	124 Å²	124	147.8 Å²	147.8	75%	0.752	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-95.8	131.5	172	-164.6	0	0	0	0	108.8	R11 V15	R11-V13 PolarHBondContact O-N 3.48Å; V13-V15 PolarHBondContact O-N 3.05Å
14	P	33.8	Very low	35.5	Very low	116 Å²	116	149.7 Å²	149.7	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.4	125.3	-179.1	27.9	-31.2	0	0	0	111.7	S16	P14-S16 PolarHBondContact O-N 3.44Å
15	V	31.2	Very low	35.4	Very low	157 Å²	157	153.2 Å²	153.2	95%	0.952	80%	0.795	S	S	*	*			trans	-79.4	108.7	170.3	178.6	0	0	0	0	108.2	V13	V13-V15 PolarHBondContact O-N 3.05Å
16	S	32.3	Very low	35.2	Very low	91 Å²	91	147.3 Å²	147.3	64%	0.636	78%	0.779	S	S	*	*			trans	-132.9	125.1	179.3	-171	0	0	0	0	110.6	P14	P14-S16 PolarHBondContact O-N 3.44Å
17	I	30.3	Very low	34.9	Very low	153 Å²	153	150.1 Å²	150.1	79%	0.785	78%	0.776	S	S	*	*	S	Bend	trans	71.4	81.2	158.6	-49.1	149.1	0	0	0	116.8
18	A	33.2	Very low	34.9	Very low	85 Å²	85	148.5 Å²	148.5	70%	0.702	77%	0.768	S	S	*	*	S	Bend	trans	-134.3	-12	153.1	0	0	0	0	0	114	H20	A18-H20 PolarHBondContact O-N 3.28Å
19	A	34	Very low	35.1	Very low	95 Å²	95	142.9 Å²	142.9	79%	0.785	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	11.3	-172.6	0	0	0	0	0	115.7
20	H	34.8	Very low	35.3	Very low	169 Å²	169	140.8 Å²	140.8	78%	0.782	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	6	-174.9	-117.8	59	0	0	0	115.7	A18	A18-H20 PolarHBondContact O-N 3.28Å
21	R	35.4	Very low	35.5	Very low	229 Å²	229	144.2 Å²	144.2	86%	0.864	76%	0.758	S	S	*	*	S	Bend	trans	-108.9	-10.8	178.1	-83.9	-175.8	164.9	167.8	-4.1	115.5
22	L	36.2	Very low	35.9	Very low	133 Å²	133	137.5 Å²	137.5	70%	0.696	75%	0.748	S	S	*	*	S	Bend	trans	-90.1	-11.5	-174.6	-95.3	131.2	0	0	0	115.7
23	T	40	Very low	36.1	Very low	108 Å²	108	130.1 Å²	130.1	66%	0.663	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-11.7	-179.3	44.9	0	0	0	0	114.5
24	K	39.1	Very low	36.4	Very low	182 Å²	182	129.7 Å²	129.7	79%	0.791	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-18.8	178	-76.1	-174.3	176.5	-177.3	0	114.7
25	Q	38.7	Very low	36.3	Very low	156 Å²	156	131.6 Å²	131.6	73%	0.729	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-28.4	179	-103.5	176.4	-17.2	0	0	113.5	H27	Q25-H27 VanDerWaalsContact C-N 3.29Å; Q25-H27 PolarHBondContact O-N 3.13Å
26	A	38	Very low	36.7	Very low	70 Å²	70	132.1 Å²	132.1	58%	0.579	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-17.7	178.5	0	0	0	0	0	114
27	H	36.8	Very low	36.8	Very low	152 Å²	152	132.2 Å²	132.2	70%	0.704	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-12	-179.1	-113.1	-74.8	0	0	0	114.6	Q25	Q25-H27 VanDerWaalsContact C-N 3.29Å; Q25-H27 PolarHBondContact O-N 3.13Å
28	N	36.5	Very low	36.9	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	74%	0.744	S	S	*	*	S	Bend	trans	-98.1	-12.5	179.4	-90.7	-2.4	0	0	0	114.2
29	A	39.5	Very low	37	Very low	77 Å²	77	132.8 Å²	132.8	64%	0.636	75%	0.75	S	S	*	*	S	Bend	trans	-86.4	-10.1	-179.4	0	0	0	0	0	114.2
30	V	38.9	Very low	37.1	Very low	126 Å²	126	138.7 Å²	138.7	76%	0.764	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-7.8	-176.4	-177.9	0	0	0	0	112.6
31	K	41.1	Very low	37.4	Very low	191 Å²	191	135.7 Å²	135.7	83%	0.83	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	11.4	-178	-79.4	-174.8	174	-176.8	0	114.8
32	S	38.3	Very low	37.5	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	74%	0.736	S	S	*	*			trans	-133.6	18.9	-165.4	-43.4	0	0	0	0	115.5
33	A	37.5	Very low	37.9	Very low	94 Å²	94	131.6 Å²	131.6	78%	0.777	74%	0.741	S	S	*	*			trans	-100.7	117.1	176.2	0	0	0	0	0	110.2
34	P	39.6	Very low	38	Very low	114 Å²	114	134.1 Å²	134.1	74%	0.74	75%	0.751	S	S	*	*			trans	-80.3	152.1	-176	32.5	-33.2	0	0	0	112.7	L36	P34-L36 PolarHBondContact O-N 3.32Å
35	D	31.2	Very low	38.4	Very low	156 Å²	156	133.3 Å²	133.3	83%	0.834	76%	0.755	S	S	*	*			trans	-50.1	115.6	172.6	-143.4	-6.2	0	0	0	111.9
36	L	40.4	Very low	38.7	Very low	169 Å²	169	133.1 Å²	133.1	89%	0.885	76%	0.759	S	S	*	*			trans	-122.4	72.9	168.2	-76.5	175	0	0	0	108.8	P34	P34-L36 PolarHBondContact O-N 3.32Å
37	A	34.3	Very low	38.9	Very low	92 Å²	92	133.7 Å²	133.7	76%	0.76	76%	0.764	S	S	*	*			trans	-70.8	135.7	154.4	0	0	0	0	0	109.3
38	G	31	Very low	39.7	Very low	72 Å²	72	133.3 Å²	133.3	74%	0.742	77%	0.772	S	S	*	*			trans	116	80.4	159.2	0	0	0	0	0	116
39	H	36.7	Very low	39.9	Very low	179 Å²	179	134.7 Å²	134.7	83%	0.829	78%	0.779	S	S	*	*			trans	-147.9	96.1	142.5	-137.2	51.6	0	0	0	109.8
40	R	34.3	Very low	40.3	Very low	218 Å²	218	139 Å²	139	82%	0.823	79%	0.792	S	S	*	*			trans	-72.3	131.1	159.2	-97.8	179.8	161.7	128.4	-5.5	107
41	V	42.4	Very low	40.7	Very low	106 Å²	106	141.4 Å²	141.4	64%	0.642	80%	0.795	S	S	*	*			trans	-119.6	108	158	-172.2	0	0	0	0	104.2
42	D	37.3	Very low	41.2	Very low	125 Å²	125	141 Å²	141	67%	0.668	80%	0.796	S	S	*	*			trans	-80.3	123.1	167.8	-58.8	-63	0	0	0	106.3
43	D	44.3	Very low	41.6	Very low	151 Å²	151	144 Å²	144	81%	0.807	80%	0.804	S	S	*	*			trans	-139	114.6	161.1	-85.6	-51.3	0	0	0	107
44	D	41.5	Very low	41.7	Very low	161 Å²	161	142.6 Å²	142.6	86%	0.861	80%	0.799	S	S	*	*			trans	-60.2	135.2	176.7	-64.9	-71.2	0	0	0	111.5
45	D	48	Very low	41.6	Very low	165 Å²	165	140.6 Å²	140.6	88%	0.882	80%	0.799	S	S	*	*			trans	-152	134.6	149.6	-115.3	-36.6	0	0	0	110.8
46	D	45.6	Very low	42.1	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	80%	0.801	S	S	*	*			trans	-70.8	149.7	-159.6	-84.9	-58.4	0	0	0	116.6
47	A	41.4	Very low	42.3	Very low	82 Å²	82	144 Å²	144	68%	0.678	80%	0.799	S	S	*	*			trans	52.4	119.3	137.2	0	0	0	0	0	120.4
48	V	53.7	Low	42.7	Very low	145 Å²	145	145 Å²	145	88%	0.879	80%	0.798	S	S	*	*				-176.7	134.5	85.5	-81.2	0	0	0	0	110.7
49	D	40.7	Very low	43.3	Very low	156 Å²	156	149.9 Å²	149.9	83%	0.834	81%	0.806	S	S	*	*			trans	-67.4	140.2	164.4	-82.3	-48.3	0	0	0	110.6
50	D	47.9	Very low	43.3	Very low	168 Å²	168	149 Å²	149	90%	0.898	80%	0.802	S	S	*	*			trans	-164.8	135.6	130.2	-110.5	-29.1	0	0	0	110.7
51	E	47.9	Very low	43.4	Very low	177 Å²	177	144 Å²	144	83%	0.827	80%	0.801	S	S	*	*			trans	-74.9	149.9	-173.7	-53.5	-158.1	160.7	0	0	113.1
52	E	50.7	Low	43	Very low	182 Å²	182	144.3 Å²	144.3	85%	0.85	80%	0.798	S	S	*	*				173.7	129	118.4	-102.5	-169.4	151.3	0	0	111.3
53	D	47.3	Very low	42.8	Very low	160 Å²	160	145.1 Å²	145.1	86%	0.856	80%	0.803	S	S	*	*			trans	55.9	139.9	130.1	-155.7	20.5	0	0	0	121.3
54	G	40.5	Very low	42.2	Very low	65 Å²	65	145 Å²	145	67%	0.67	80%	0.798	S	S	*	*			trans	123.3	71.1	157.9	0	0	0	0	0	117
55	G	37.3	Very low	41.7	Very low	71 Å²	71	146.4 Å²	146.4	73%	0.732	80%	0.796	S	S	*	*				66.8	101.9	121.9	0	0	0	0	0	119.6
56	K	40.3	Very low	40.9	Very low	203 Å²	203	143.7 Å²	143.7	88%	0.883	79%	0.786	S	S	*	*				34.9	107.5	128.4	-60.6	-179.1	-179	175.8	0	117.6
57	K	44.9	Very low	40.3	Very low	194 Å²	194	141.2 Å²	141.2	84%	0.843	79%	0.786	S	S	*	*				174.6	140.1	110.4	-93	163	-174.3	179.3	0	110.7	L59	K57-L59 PolarHBondContact O-N 3.15Å
58	P	43.4	Very low	39.8	Very low	113 Å²	113	144.7 Å²	144.7	73%	0.734	79%	0.79	S	S	*	*			trans	-73.3	115.2	172	28.9	-26.6	0	0	0	108.7	H60	P58-H60 PolarHBondContact O-N 3.16Å; P58-H60 VanDerWaalsContact O-N 3.09Å
59	L	42.4	Very low	38.8	Very low	175 Å²	175	146.7 Å²	146.7	92%	0.916	79%	0.789	S	S	*	*			trans	-60.7	111.8	173	-81.3	160.6	0	0	0	108.9	K57 S61	K57-L59 PolarHBondContact O-N 3.15Å; L59-S61 PolarHBondContact O-N 3.21Å
60	H	36.9	Very low	38.3	Very low	159 Å²	159	147.1 Å²	147.1	74%	0.736	79%	0.786	S	S	*	*			trans	-55.6	118.1	167.3	-77.7	13.8	0	0	0	109.6	P58 D62	P58-H60 PolarHBondContact O-N 3.16Å; P58-H60 VanDerWaalsContact O-N 3.09Å; H60-D62 VanDerWaalsContact C-N 3.33Å; H60-D62 PolarHBondContact O-N 3.5Å
61	S	36.4	Very low	37.4	Very low	115 Å²	115	145.1 Å²	145.1	80%	0.804	78%	0.783	S	S	*	*			trans	-81.6	80.3	166.4	60.5	0	0	0	0	109.3	L59 N63	L59-S61 PolarHBondContact O-N 3.21Å; S61-N63 PolarHBondContact O-N 2.94Å
62	D	34.1	Very low	36.6	Very low	111 Å²	111	142.1 Å²	142.1	59%	0.594	78%	0.777	S	S	*	*			trans	-76.7	67.8	168.2	-88.2	-45.3	0	0	0	110.3	H60 Q64	H60-D62 VanDerWaalsContact C-N 3.33Å; H60-D62 PolarHBondContact O-N 3.5Å; D62-Q64 VanDerWaalsContact C-N 3.26Å; D62-Q64 PolarHBondContact O-N 3.28Å; D62-Q64 PolarHBondContact OD1-NE2 3.22Å
63	N	34.2	Very low	35.5	Very low	142 Å²	142	138.1 Å²	138.1	76%	0.759	78%	0.775	S	S	*	*			trans	-89.5	71.4	161	-97.1	1.3	0	0	0	108.9	S61 F65	S61-N63 PolarHBondContact O-N 2.94Å; N63-F65 VanDerWaalsContact C-N 3.29Å; N63-F65 PolarHBondContact O-N 3.36Å
64	Q	31.6	Very low	34.7	Very low	150 Å²	150	141.3 Å²	141.3	70%	0.701	78%	0.775	S	S	*	*			trans	-75.9	79.5	167.8	-64.3	-174.9	21.7	0	0	109.7	D62 V66	D62-Q64 VanDerWaalsContact C-N 3.26Å; D62-Q64 PolarHBondContact O-N 3.28Å; D62-Q64 PolarHBondContact OD1-NE2 3.22Å; Q64-V66 VanDerWaalsContact C-N 3.34Å; Q64-V66 PolarHBondContact O-N 2.95Å; Q64-V66 VanDerWaalsContact O-N 3.15Å
65	F	31.3	Very low	34.2	Very low	189 Å²	189	144.2 Å²	144.2	83%	0.829	78%	0.779	S	S	*	*			trans	-78.2	92.2	158.2	-90.7	-86	0	0	0	108.4	N63 A67	N63-F65 VanDerWaalsContact C-N 3.29Å; N63-F65 PolarHBondContact O-N 3.36Å; F65-A67 PolarHBondContact O-N 3.2Å
66	V	30.8	Very low	34.1	Very low	109 Å²	109	148.3 Å²	148.3	66%	0.661	79%	0.785	S	S	*	*			trans	-61.5	102.4	166.8	176.3	0	0	0	0	108.1	Q64 M68	Q64-V66 VanDerWaalsContact C-N 3.34Å; Q64-V66 PolarHBondContact O-N 2.95Å; Q64-V66 VanDerWaalsContact O-N 3.15Å; V66-M68 VanDerWaalsContact C-N 3.29Å; V66-M68 HydrophobicContact CG1-CG 3.75Å; V66-M68 PolarHBondContact O-N 2.97Å
67	A	32.2	Very low	33.6	Very low	100 Å²	100	142.9 Å²	142.9	83%	0.826	78%	0.778	S	S	*	*			trans	-70	83.5	170.9	0	0	0	0	0	110	F65 H69	F65-A67 PolarHBondContact O-N 3.2Å; A67-H69 PolarHBondContact O-N 2.87Å
68	M	30.6	Very low	32.9	Very low	154 Å²	154	145.4 Å²	145.4	76%	0.759	78%	0.782	S	S	*	*			trans	-93.7	75.9	167.7	-85.8	-77	-76.5	0	0	109.8	V66	V66-M68 VanDerWaalsContact C-N 3.29Å; V66-M68 HydrophobicContact CG1-CG 3.75Å; V66-M68 PolarHBondContact O-N 2.97Å
69	H	33.2	Very low	32.4	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.866	78%	0.779	S	S	*	*			trans	-131.7	87.2	159.2	-88	-65.1	0	0	0	108.9	A67	A67-H69 PolarHBondContact O-N 2.87Å
70	Q	30.7	Very low	32	Very low	165 Å²	165	147.1 Å²	147.1	77%	0.771	78%	0.779	S	S	*	*			trans	-70.1	134.7	159.9	-84.5	-164.9	5.2	0	0	109.6
71	P	28.9	Very low	31.8	Very low	127 Å²	127	149.7 Å²	149.7	83%	0.825	79%	0.788	S	S	*	*			trans	-86.6	110.2	170	32.3	-25.9	0	0	0	108.6
72	T	30.5	Very low	31.5	Very low	114 Å²	114	147.9 Å²	147.9	70%	0.699	79%	0.787	S	S	*	*			trans	-112.4	83	168.8	12.2	0	0	0	0	110.8	R74	T72-R74 PolarHBondContact O-N 3.21Å
73	A	28.2	Very low	31.5	Very low	98 Å²	98	147.5 Å²	147.5	81%	0.81	80%	0.799	S	S	*	*			trans	-68.4	114.1	149.8	0	0	0	0	0	107.8
74	R	30.5	Very low	31.3	Very low	227 Å²	227	145.7 Å²	145.7	86%	0.857	80%	0.798	S	S	*	*			trans	-116.7	97.9	164.4	-102.5	-175.8	168.2	163.6	-1.9	109.6	T72	T72-R74 PolarHBondContact O-N 3.21Å
75	V	29.9	Very low	31.6	Very low	126 Å²	126	145.1 Å²	145.1	76%	0.764	80%	0.799	S	S	*	*			trans	-65.3	131	156.1	178.1	0	0	0	0	107.4
76	N	35.5	Very low	31.7	Very low	157 Å²	157	143 Å²	143	84%	0.84	80%	0.797	S	S	*	*			trans	-152.2	104.7	150.4	-96.4	-18.6	0	0	0	109.6
77	A	29.5	Very low	32	Very low	89 Å²	89	145.6 Å²	145.6	74%	0.736	81%	0.806	S	S	*	*			trans	-61.5	150.9	157.7	0	0	0	0	0	110.2
78	R	29.9	Very low	32.1	Very low	246 Å²	246	150.1 Å²	150.1	93%	0.928	81%	0.808	S	S	*	*				154.8	136.7	123.1	-169.7	164.1	-168.1	175.5	2.7	114.3
79	A	34.1	Very low	32.1	Very low	82 Å²	82	146.1 Å²	146.1	68%	0.678	81%	0.805	S	S	*	*			trans	70.5	108.5	155.8	0	0	0	0	0	118.5
80	R	32.9	Very low	32.1	Very low	243 Å²	243	145.7 Å²	145.7	92%	0.917	80%	0.804	S	S	*	*				54.8	104.7	77.2	-71.9	-168.5	176.5	-168.1	-0.3	114.5
81	K	33.7	Very low	32.2	Very low	213 Å²	213	143.1 Å²	143.1	93%	0.926	80%	0.8	S	S	*	*				164	123.9	118.5	-100	-178.7	170.3	-178.5	0	112.2
82	G	29	Very low	32.3	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	80%	0.801	S	S	*	*				86.4	143	123.5	0	0	0	0	0	120.2
83	A	34.2	Very low	32.6	Very low	103 Å²	103	150.6 Å²	150.6	85%	0.851	81%	0.811	S	S	*	*			trans	78	102.2	167.5	0	0	0	0	0	115.4
84	S	30.8	Very low	33	Very low	105 Å²	105	151.1 Å²	151.1	73%	0.734	81%	0.806	S	S	*	*			cis	78	127.8	38.3	-155.1	0	0	0	0	114.9
85	L	37.2	Very low	33.2	Very low	138 Å²	138	147.4 Å²	147.4	72%	0.723	80%	0.803	S	S	*	*			trans	88.6	105.1	160.2	-50.2	180	0	0	0	117.9
86	D	33.2	Very low	33.4	Very low	145 Å²	145	153.4 Å²	153.4	78%	0.775	81%	0.812	S	S	*	*				46.8	112.8	120.6	-52.6	-37	0	0	0	117.9
87	D	37.8	Very low	33.3	Very low	162 Å²	162	154.6 Å²	154.6	87%	0.866	81%	0.812	S	S	*	*				-157.7	144.9	119.2	-144.2	-8.1	0	0	0	112.9
88	K	33.2	Very low	33.4	Very low	196 Å²	196	161.4 Å²	161.4	85%	0.852	82%	0.819	S	S	*	*			trans	-79.6	149.3	177.4	-69.9	170.4	175.4	172.3	0	109.5
89	G	31.6	Very low	33.5	Very low	69 Å²	69	159.2 Å²	159.2	71%	0.711	82%	0.819	S	S	*	*			trans	113.7	114.2	145.9	0	0	0	0	0	115.6
90	Q	32.1	Very low	33.2	Very low	178 Å²	178	166.9 Å²	166.9	83%	0.832	83%	0.831	S	S	*	*				82.2	118.5	128	-136.5	154.9	5.6	0	0	118
91	T	32.8	Very low	33	Very low	112 Å²	112	162 Å²	162	69%	0.687	83%	0.827	S	S	*	*			trans	61.1	100.2	145.7	51.8	0	0	0	0	118.2
92	D	32.7	Very low	32.7	Very low	161 Å²	161	161.4 Å²	161.4	86%	0.861	83%	0.828	S	S	*	*				173.3	130.4	110.6	-94.6	-30.2	0	0	0	110.9
93	R	37.1	Very low	32.7	Very low	236 Å²	236	162 Å²	162	89%	0.891	83%	0.825	S	S	*	*			trans	-64.6	145.9	157.8	-80.2	179	172.6	168.5	-1.8	106.4
94	P	35.6	Very low	32.4	Very low	110 Å²	110	164.8 Å²	164.8	71%	0.714	83%	0.826	S	S	*	*				-163	112.1	55.4	36.2	-11.2	0	0	0	115.7
95	D	35	Very low	32.2	Very low	149 Å²	149	164.3 Å²	164.3	80%	0.797	83%	0.829	S	S	*	*			trans	-161.4	42.4	169.5	-108.4	-31.2	0	0	0	116.9	H97	D95-H97 PolarHBondContact O-N 2.95Å
96	R	33.6	Very low	31.8	Very low	252 Å²	252	162.6 Å²	162.6	95%	0.951	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	29.7	172	-78.2	-167.2	179	-177.3	0.9	114
97	H	33.8	Very low	31.7	Very low	182 Å²	182	158.6 Å²	158.6	84%	0.843	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	14.2	-175.4	-116.4	53.3	0	0	0	116	D95	D95-H97 PolarHBondContact O-N 2.95Å
98	R	31.2	Very low	31.1	Very low	232 Å²	232	161.6 Å²	161.6	88%	0.875	82%	0.817	S	S	*	*	S	Bend	trans	-129.8	13.5	-176.8	-101.7	-177.3	173.9	169.7	-0.9	118.5
99	Q	31.5	Very low	31.1	Very low	199 Å²	199	156 Å²	156	93%	0.93	80%	0.796	S	S	*	*	S	Bend	trans	-114.5	18	176.5	-93.3	179.3	-0.3	0	0	115.1
100	R	28	Very low	31.1	Very low	244 Å²	244	155.8 Å²	155.8	92%	0.921	79%	0.787	S	S	*	*			trans	-111.4	41.1	-171.6	-130.9	178.8	-180	-127.3	-0.6	113.9
101	V	28.9	Very low	31.3	Very low	140 Å²	140	152.1 Å²	152.1	85%	0.848	78%	0.779	S	S	*	*	S	Bend	trans	-148.3	67.1	172.5	-165.6	0	0	0	0	110.5
102	Q	28.2	Very low	31.7	Very low	200 Å²	200	152.5 Å²	152.5	94%	0.935	78%	0.777	S	S	*	*	S	Bend	trans	-158.7	6.7	163.9	-120.7	171.8	26.8	0	0	116.4
103	A	28.5	Very low	31.8	Very low	88 Å²	88	147.6 Å²	147.6	73%	0.727	75%	0.749	S	S	*	*			trans	-130.4	86.7	-179.9	0	0	0	0	0	109.5
104	N	27	Very low	31.6	Very low	162 Å²	162	139.2 Å²	139.2	87%	0.866	74%	0.737	S	S	*	*			trans	-162.1	38.1	167.7	-95.1	-11.7	0	0	0	112.3
105	A	28.2	Very low	31.7	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	74%	0.744	S	S	*	*			trans	-117.1	11.8	168.2	0	0	0	0	0	112.6	G107	A105-G107 PolarHBondContact O-N 2.95Å
106	V	28.6	Very low	31.7	Very low	102 Å²	102	138 Å²	138	62%	0.618	72%	0.724	S	S	*	*			trans	-92.3	90	171.6	-170	0	0	0	0	106.2	Y108	V106-Y108 PolarHBondContact O-N 3.46Å
107	G	29.4	Very low	31.6	Very low	60 Å²	60	129.3 Å²	129.3	62%	0.619	70%	0.7	S	S	*	*			trans	-56.1	113.6	171	0	0	0	0	0	108.4	A105 L109	A105-G107 PolarHBondContact O-N 2.95Å; G107-L109 PolarHBondContact O-N 2.92Å
108	Y	26.9	Very low	31.4	Very low	225 Å²	225	123.3 Å²	123.3	88%	0.882	68%	0.678	S	S	*	*			trans	-64.6	86.4	169.5	-76.5	-92.2	0	0	0	107.7	V106	V106-Y108 PolarHBondContact O-N 3.46Å
109	L	31.6	Very low	31.3	Very low	80 Å²	80	116.2 Å²	116.2	42%	0.419	66%	0.664	S	S	.	*			trans	-62	139.4	154.8	-75.2	159.1	0	0	0	106.7	G107 M113 I121	G107-L109 PolarHBondContact O-N 2.92Å; L109-M113 HydrophobicContact CB-CB 3.66Å; L109-M113 HydrophobicContact CB-CG 4.02Å; L109-M113 HydrophobicContact CD1-CE 4.18Å; L109-M113 HydrophobicContact CD2-CE 3.94Å; L109-M113 HydrophobicContact CG-CE 4.48Å; L109-I121 HydrophobicContact CD1-CD1 3.23Å; L109-I121 HydrophobicContact CD1-CG1 4.04Å
110	A	32.6	Very low	31.3	Very low	63 Å²	63	109.4 Å²	109.4	52%	0.521	64%	0.636	S	S	.	*			trans	-38.7	146.3	-176.5	0	0	0	0	0	112.5	D112 M113	A110-D112 PolarHBondContact O-N 2.9Å; A110-M113 WeakPolarHBondContact O-CB 3.3Å; A110-M113 PolarHBondContact O-N 2.9Å
111	P	35.4	Very low	31.6	Very low	102 Å²	102	99.4 Å²	99.4	66%	0.662	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-9.9	-172.3	20.6	-32.5	0	0	0	115.6
112	D	42.2	Very low	31.7	Very low	119 Å²	119	97.7 Å²	97.7	64%	0.636	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	1.4	173.8	-148.2	9.2	0	0	0	113.8	A110 G114	A110-D112 PolarHBondContact O-N 2.9Å; D112-G114 VanDerWaalsContact C-N 3.29Å; D112-G114 PolarHBondContact O-N 2.85Å
113	M	35.4	Very low	31.9	Very low	59 Å²	59	93.5 Å²	93.5	29%	0.291	57%	0.57	S	S	.	*	S	Bend	trans	-95.1	55.1	173.2	-69.2	-78.1	-83.8	0	0	110	L109 A110 N115	L109-M113 HydrophobicContact CB-CB 3.66Å; L109-M113 HydrophobicContact CB-CG 4.02Å; L109-M113 HydrophobicContact CD1-CE 4.18Å; L109-M113 HydrophobicContact CD2-CE 3.94Å; L109-M113 HydrophobicContact CG-CE 4.48Å; A110-M113 WeakPolarHBondContact O-CB 3.3Å; A110-M113 PolarHBondContact O-N 2.9Å; M113-N115 PolarHBondContact O-N 3.36Å
114	G	31.2	Very low	32.7	Very low	60 Å²	60	91.8 Å²	91.8	62%	0.619	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	110.2	-179.8	0	0	0	0	0	112	D112 L116	D112-G114 VanDerWaalsContact C-N 3.29Å; D112-G114 PolarHBondContact O-N 2.85Å; G114-L116 PolarHBondContact O-N 3.04Å
115	N	38.2	Very low	33.7	Very low	161 Å²	161	87.5 Å²	87.5	86%	0.861	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	38.7	160.9	-61.7	-27.3	0	0	0	117.3	M113 P117	M113-N115 PolarHBondContact O-N 3.36Å; N115-P117 VanDerWaalsContact O-CD 3.31Å; N115-P117 WeakPolarHBondContact O-CD 3.24Å
116	L	34.6	Very low	34.6	Very low	72 Å²	72	85 Å²	85	38%	0.377	50%	0.5	S	S	.	.			trans	-67.5	122.7	157.1	-100.6	88	0	0	0	108.2	G114 C118 V120 I121	G114-L116 PolarHBondContact O-N 3.04Å; L116-C118 PolarHBondContact O-N 3.3Å; L116-V120 HydrophobicContact CD2-CG1 3.99Å; L116-I121 HydrophobicContact CB-CD1 3.77Å; L116-I121 HydrophobicContact CB-CG1 4.08Å; L116-I121 HydrophobicContact CD2-CG1 4.08Å
117	P	32.7	Very low	35.5	Very low	70 Å²	70	83.5 Å²	83.5	46%	0.455	49%	0.488	S	S	.	.			trans	-56.1	133.6	174	-18.8	29.4	0	0	0	108.5	N115 S119 V120 I121	N115-P117 VanDerWaalsContact O-CD 3.31Å; N115-P117 WeakPolarHBondContact O-CD 3.24Å; P117-S119 VanDerWaalsContact CB-OG 3.32Å; P117-S119 WeakPolarHBondContact CB-OG 3.3Å; P117-S119 PolarHBondContact O-N 3Å; P117-V120 HydrophobicContact CB-CG2 4.08Å; P117-V120 HydrophobicContact CG-CG2 3.86Å; P117-V120 WeakPolarHBondContact O-CB 3.3Å; P117-V120 PolarHBondContact O-N 2.56Å; P117-I121 PolarHBondContact O-N 3.12Å
118	C	29.2	Very low	36.8	Very low	56 Å²	56	83.5 Å²	83.5	38%	0.378	47%	0.473	S	S	.	.	H	α-helix	trans	-51.5	-26.7	173.4	-72.4	0	0	0	0	111.8	L116 N122	L116-C118 PolarHBondContact O-N 3.3Å; C118-N122 WeakPolarHBondContact O-CB 3.4Å; C118-N122 PolarHBondContact O-N 3.05Å; C118-N122 PolarHBondContact O-ND2 2.72Å
119	S	29.9	Very low	38.1	Very low	83 Å²	83	78.5 Å²	78.5	58%	0.58	46%	0.457	S	S	*	.	H	α-helix	trans	-63.7	-37.4	172.4	56.5	0	0	0	0	113.9	P117 L123	P117-S119 VanDerWaalsContact CB-OG 3.32Å; P117-S119 WeakPolarHBondContact CB-OG 3.3Å; P117-S119 PolarHBondContact O-N 3Å; S119-L123 VanDerWaalsContact O-CB 3.27Å; S119-L123 WeakPolarHBondContact O-CB 3.48Å; S119-L123 PolarHBondContact O-N 3.11Å
120	V	30.8	Very low	39.3	Very low	56 Å²	56	79.9 Å²	79.9	34%	0.339	46%	0.46	S	S	.	.	H	α-helix	trans	-71.4	-42.2	178.2	177.1	0	0	0	0	110.4	L116 P117 L123 Q124	L116-V120 HydrophobicContact CD2-CG1 3.99Å; P117-V120 HydrophobicContact CB-CG2 4.08Å; P117-V120 HydrophobicContact CG-CG2 3.86Å; P117-V120 WeakPolarHBondContact O-CB 3.3Å; P117-V120 PolarHBondContact O-N 2.56Å; V120-L123 PolarHBondContact O-N 3.49Å; V120-Q124 WeakPolarHBondContact O-CB 3.06Å; V120-Q124 WeakPolarHBondContact O-CG 3.41Å; V120-Q124 PolarHBondContact O-N 3.13Å
121	I	33.6	Very low	40.5	Very low	34 Å²	34	79.8 Å²	79.8	17%	0.174	45%	0.449	C	S	.	.	H	α-helix	trans	-65.1	-45.6	176	-65.3	149.1	0	0	0	110.4	L109 L116 P117 L123 Q124 I125	L109-I121 HydrophobicContact CD1-CD1 3.23Å; L109-I121 HydrophobicContact CD1-CG1 4.04Å; L116-I121 HydrophobicContact CB-CD1 3.77Å; L116-I121 HydrophobicContact CB-CG1 4.08Å; L116-I121 HydrophobicContact CD2-CG1 4.08Å; P117-I121 PolarHBondContact O-N 3.12Å; I121-L123 VanDerWaalsContact C-N 3.32Å; I121-L123 PolarHBondContact O-N 3.34Å; I121-Q124 PolarHBondContact O-N 3.37Å; I121-I125 HydrophobicContact CG2-CD1 3.67Å; I121-I125 HydrophobicContact CG2-CG1 4.39Å; I121-I125 VanDerWaalsContact O-CG1 3.26Å; I121-I125 WeakPolarHBondContact O-CG1 3.45Å; I121-I125 PolarHBondContact O-N 3.4Å
122	N	32.2	Very low	41.6	Very low	104 Å²	104	78.7 Å²	78.7	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-65.2	-35.3	177.9	-73	-20.4	0	0	0	112.4	C118 S126	C118-N122 WeakPolarHBondContact O-CB 3.4Å; C118-N122 PolarHBondContact O-N 3.05Å; C118-N122 PolarHBondContact O-ND2 2.72Å; N122-S126 VanDerWaalsContact O-CB 3.3Å; N122-S126 WeakPolarHBondContact O-CB 3.25Å; N122-S126 PolarHBondContact O-N 3.09Å
123	L	31.9	Very low	42.3	Very low	112 Å²	112	76.8 Å²	76.8	59%	0.586	43%	0.427	S	S	*	.	H	α-helix	trans	-65.5	-43.5	175	-157.1	77.2	0	0	0	110.7	S119 V120 I121 S126 D127	S119-L123 VanDerWaalsContact O-CB 3.27Å; S119-L123 WeakPolarHBondContact O-CB 3.48Å; S119-L123 PolarHBondContact O-N 3.11Å; V120-L123 PolarHBondContact O-N 3.49Å; I121-L123 VanDerWaalsContact C-N 3.32Å; I121-L123 PolarHBondContact O-N 3.34Å; L123-S126 PolarHBondContact O-N 3.31Å; L123-D127 WeakPolarHBondContact O-CB 3.49Å; L123-D127 PolarHBondContact O-N 3.11Å
124	Q	44.9	Very low	43.3	Very low	51 Å²	51	82.8 Å²	82.8	24%	0.238	45%	0.447	C	S	.	.	H	α-helix	trans	-66.3	-40	177.9	-70.3	169.2	-0.4	0	0	112.2	V120 I121 M128 I228	V120-Q124 WeakPolarHBondContact O-CB 3.06Å; V120-Q124 WeakPolarHBondContact O-CG 3.41Å; V120-Q124 PolarHBondContact O-N 3.13Å; I121-Q124 PolarHBondContact O-N 3.37Å; Q124-M128 HydrophobicContact CB-CE 4.28Å; Q124-M128 WeakPolarHBondContact O-CB 3.46Å; Q124-M128 WeakPolarHBondContact O-CE 3.49Å; Q124-M128 WeakPolarHBondContact O-CG 3.41Å; Q124-M128 PolarHBondContact O-N 3.39Å; Q124-I228 HydrophobicContact CB-CD1 4.06Å; Q124-I228 HydrophobicContact CG-CD1 3.51Å; Q124-I228 HydrophobicContact CG-CG1 3.79Å; Q124-I228 VanDerWaalsContact NE2-CD1 3.26Å
125	I	49.4	Very low	44.3	Very low	72 Å²	72	80.4 Å²	80.4	37%	0.369	42%	0.42	S	S	.	.	H	α-helix	trans	-65.8	-43.5	174.5	-67.5	167.5	0	0	0	110.5	I121 D127 M128 Q129	I121-I125 HydrophobicContact CG2-CD1 3.67Å; I121-I125 HydrophobicContact CG2-CG1 4.39Å; I121-I125 VanDerWaalsContact O-CG1 3.26Å; I121-I125 WeakPolarHBondContact O-CG1 3.45Å; I121-I125 PolarHBondContact O-N 3.4Å; I125-D127 PolarHBondContact O-N 3.29Å; I125-M128 HydrophobicContact CG1-CE 4.46Å; I125-M128 PolarHBondContact O-N 3.37Å; I125-Q129 HydrophobicContact CG2-CG 4.46Å; I125-Q129 WeakPolarHBondContact O-CB 3.25Å; I125-Q129 VanDerWaalsContact O-CG 3.31Å; I125-Q129 WeakPolarHBondContact O-CG 3.5Å; I125-Q129 PolarHBondContact O-N 3.4Å
126	S	45	Very low	44.9	Very low	45 Å²	45	79.7 Å²	79.7	32%	0.315	41%	0.406	S	S	.	.	H	α-helix	trans	-63.1	-41.3	177.7	-175.4	0	0	0	0	111.9	N122 L123 Q129 K130	N122-S126 VanDerWaalsContact O-CB 3.3Å; N122-S126 WeakPolarHBondContact O-CB 3.25Å; N122-S126 PolarHBondContact O-N 3.09Å; L123-S126 PolarHBondContact O-N 3.31Å; S126-Q129 PolarHBondContact O-N 3.39Å; S126-K130 WeakPolarHBondContact O-CG 2.77Å; S126-K130 PolarHBondContact O-N 3.34Å
127	D	49.6	Very low	45.9	Very low	69 Å²	69	81.5 Å²	81.5	37%	0.369	42%	0.416	S	S	.	.	H	α-helix	trans	-71.7	-36.7	178.4	-71	-20	0	0	0	112	L123 I125 K130 M131	L123-D127 WeakPolarHBondContact O-CB 3.49Å; L123-D127 PolarHBondContact O-N 3.11Å; I125-D127 PolarHBondContact O-N 3.29Å; D127-K130 PolarHBondContact O-N 2.79Å; D127-K130 IonicContact OD1-NZ 2.86Å; D127-K130 PolarHBondContact OD1-NZ 2.72Å; D127-M131 WeakPolarHBondContact O-CG 3.09Å; D127-M131 PolarHBondContact O-N 3.26Å
128	M	55.1	Low	47	Very low	61 Å²	61	82.8 Å²	82.8	30%	0.3	42%	0.423	S	S	.	.	H	α-helix	trans	-60.1	-46.9	168.9	-78.1	-173.3	-84.6	0	0	111.2	Q124 I125 K130 M131 F132	Q124-M128 HydrophobicContact CB-CE 4.28Å; Q124-M128 WeakPolarHBondContact O-CB 3.46Å; Q124-M128 WeakPolarHBondContact O-CE 3.49Å; Q124-M128 WeakPolarHBondContact O-CG 3.41Å; Q124-M128 PolarHBondContact O-N 3.39Å; I125-M128 HydrophobicContact CG1-CE 4.46Å; I125-M128 PolarHBondContact O-N 3.37Å; M128-K130 PolarHBondContact O-N 2.77Å; M128-M131 HydrophobicContact CG-CE 4.12Å; M128-M131 WeakPolarHBondContact O-CB 3.48Å; M128-M131 PolarHBondContact O-N 3.34Å; M128-M131 VanDerWaalsContact O-N 3.15Å; M128-F132 HydrophobicContact CB-CD2 4.44Å; M128-F132 HydrophobicContact CB-CE2 4.41Å; M128-F132 WeakPolarHBondContact O-CD2 3.35Å; M128-F132 PolarHBondContact O-N 3.33Å
129	Q	55.6	Low	48.2	Very low	120 Å²	120	84.4 Å²	84.4	56%	0.561	43%	0.425	S	S	*	.	H	α-helix	trans	-58.1	-45.5	176	-77.8	175.9	-18.3	0	0	111.9	I125 S126 M131 F132 T133	I125-Q129 HydrophobicContact CG2-CG 4.46Å; I125-Q129 WeakPolarHBondContact O-CB 3.25Å; I125-Q129 VanDerWaalsContact O-CG 3.31Å; I125-Q129 WeakPolarHBondContact O-CG 3.5Å; I125-Q129 PolarHBondContact O-N 3.4Å; S126-Q129 PolarHBondContact O-N 3.39Å; Q129-M131 VanDerWaalsContact C-N 3.33Å; Q129-M131 PolarHBondContact O-N 3.07Å; Q129-F132 PolarHBondContact O-N 3.23Å; Q129-T133 PolarHBondContact O-N 2.97Å; Q129-T133 PolarHBondContact O-OG1 3.49Å
130	K	55.6	Low	49.2	Very low	108 Å²	108	89 Å²	89	47%	0.47	44%	0.437	S	S	.	.	H	α-helix	trans	-61.1	-40.9	175.7	-70.6	170.3	-159.4	152.8	0	112.1	S126 D127 M128 T133 R134	S126-K130 WeakPolarHBondContact O-CG 2.77Å; S126-K130 PolarHBondContact O-N 3.34Å; D127-K130 PolarHBondContact O-N 2.79Å; D127-K130 IonicContact OD1-NZ 2.86Å; D127-K130 PolarHBondContact OD1-NZ 2.72Å; M128-K130 PolarHBondContact O-N 2.77Å; K130-T133 PolarHBondContact O-N 3.13Å; K130-R134 WeakPolarHBondContact O-CB 3.42Å; K130-R134 WeakPolarHBondContact O-CG 3.45Å; K130-R134 PolarHBondContact O-N 3.14Å
131	M	57.9	Low	50.2	Low	61 Å²	61	87.5 Å²	87.5	30%	0.3	43%	0.426	S	S	.	.	H	α-helix	trans	-62.4	-46.1	175.3	-75	-171.4	-69.4	0	0	110.8	D127 M128 Q129 R134 L135 L235	D127-M131 WeakPolarHBondContact O-CG 3.09Å; D127-M131 PolarHBondContact O-N 3.26Å; M128-M131 HydrophobicContact CG-CE 4.12Å; M128-M131 WeakPolarHBondContact O-CB 3.48Å; M128-M131 PolarHBondContact O-N 3.34Å; M128-M131 VanDerWaalsContact O-N 3.15Å; Q129-M131 VanDerWaalsContact C-N 3.33Å; Q129-M131 PolarHBondContact O-N 3.07Å; M131-R134 PolarHBondContact O-N 3.38Å; M131-L135 WeakPolarHBondContact O-CB 3.46Å; M131-L135 PolarHBondContact O-N 3.44Å; M131-L235 HydrophobicContact CE-CD1 3.68Å; M131-L235 HydrophobicContact SD-CD1 4.11Å
132	F	58.7	Low	51.2	Low	79 Å²	79	88.5 Å²	88.5	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-44.3	176.3	-80.3	-66.7	0	0	0	112.7	M128 Q129 R134 L135 Y136 V146 L150	M128-F132 HydrophobicContact CB-CD2 4.44Å; M128-F132 HydrophobicContact CB-CE2 4.41Å; M128-F132 WeakPolarHBondContact O-CD2 3.35Å; M128-F132 PolarHBondContact O-N 3.33Å; Q129-F132 PolarHBondContact O-N 3.23Å; F132-R134 PolarHBondContact O-N 2.98Å; F132-L135 WeakPolarHBondContact O-CB 3.44Å; F132-L135 PolarHBondContact O-N 2.76Å; F132-Y136 WeakPolarHBondContact O-CB 3.19Å; F132-Y136 PolarHBondContact O-N 2.85Å; F132-V146 HydrophobicContact CD1-CG1 4.11Å; F132-V146 HydrophobicContact CE1-CG1 3.94Å; F132-L150 HydrophobicContact CZ-CD2 4.34Å
133	T	56.6	Low	52.2	Low	80 Å²	80	92.1 Å²	92.1	49%	0.491	44%	0.443	S	S	.	.	H	α-helix	trans	-63.3	-41.1	176.7	-55.7	0	0	0	0	111.6	Q129 K130 N137	Q129-T133 PolarHBondContact O-N 2.97Å; Q129-T133 PolarHBondContact O-OG1 3.49Å; K130-T133 PolarHBondContact O-N 3.13Å; T133-N137 WeakPolarHBondContact O-CB 3.44Å; T133-N137 PolarHBondContact O-N 2.93Å; T133-N137 PolarHBondContact O-ND2 3.12Å
134	R	56.5	Low	53.2	Low	184 Å²	184	93.7 Å²	93.7	69%	0.694	44%	0.441	S	S	*	.	H	α-helix	trans	-62	-47.8	174.1	-76	177.7	179.1	-173.1	-0.5	111	K130 M131 F132 Y136 N137 T138	K130-R134 WeakPolarHBondContact O-CB 3.42Å; K130-R134 WeakPolarHBondContact O-CG 3.45Å; K130-R134 PolarHBondContact O-N 3.14Å; M131-R134 PolarHBondContact O-N 3.38Å; F132-R134 PolarHBondContact O-N 2.98Å; R134-Y136 PolarHBondContact O-N 3.36Å; R134-N137 PolarHBondContact O-N 3.2Å; R134-T138 WeakPolarHBondContact O-CB 3.43Å; R134-T138 PolarHBondContact O-N 3.43Å; R134-T138 PolarHBondContact O-OG1 3.49Å
135	L	52	Low	53.5	Low	10 Å²	10	95.2 Å²	95.2	5%	0.052	45%	0.448	C	S	.	.	H	α-helix	trans	-56.2	-48.6	177.8	-97.7	145.7	0	0	0	112.6	M131 F132 N137 T138 H139 V146 L239	M131-L135 WeakPolarHBondContact O-CB 3.46Å; M131-L135 PolarHBondContact O-N 3.44Å; F132-L135 WeakPolarHBondContact O-CB 3.44Å; F132-L135 PolarHBondContact O-N 2.76Å; L135-N137 PolarHBondContact O-N 2.8Å; L135-T138 PolarHBondContact O-N 3.37Å; L135-H139 PolarHBondContact O-N 3.4Å; L135-V146 HydrophobicContact CB-CG1 4.44Å; L135-V146 HydrophobicContact CB-CG2 4.45Å; L135-V146 HydrophobicContact CD1-CG1 3.98Å; L135-V146 HydrophobicContact CD2-CG1 3.98Å; L135-V146 HydrophobicContact CD2-CG2 4.07Å; L135-V146 HydrophobicContact CG-CG1 4.36Å; L135-L239 HydrophobicContact CD1-CD1 4.1Å; L135-L239 HydrophobicContact CD1-CD2 4.41Å; L135-L239 HydrophobicContact CD1-CG 4.36Å; L135-L239 HydrophobicContact CD2-CD1 4.41Å; L135-L239 HydrophobicContact CD2-CD2 3.25Å; L135-L239 HydrophobicContact CD2-CG 3.86Å; L135-L239 HydrophobicContact CG-CD1 4.17Å; L135-L239 HydrophobicContact CG-CD2 3.69Å; L135-L239 HydrophobicContact CG-CG 4.17Å
136	Y	50.7	Low	53.8	Low	146 Å²	146	92.2 Å²	92.2	57%	0.573	43%	0.433	S	S	*	.	H	α-helix	trans	-60.2	-45	178.1	-176.5	-97.9	0	0	0	111.8	F132 R134 H140	F132-Y136 WeakPolarHBondContact O-CB 3.19Å; F132-Y136 PolarHBondContact O-N 2.85Å; R134-Y136 PolarHBondContact O-N 3.36Å; Y136-H140 PolarHBondContact O-N 2.83Å
137	N	56.7	Low	54.4	Low	110 Å²	110	94.5 Å²	94.5	59%	0.588	44%	0.437	S	S	*	.	H	α-helix	trans	-73.7	-25.8	-178.3	-69.1	-14.5	0	0	0	113.9	T133 R134 L135	T133-N137 WeakPolarHBondContact O-CB 3.44Å; T133-N137 PolarHBondContact O-N 2.93Å; T133-N137 PolarHBondContact O-ND2 3.12Å; R134-N137 PolarHBondContact O-N 3.2Å; L135-N137 PolarHBondContact O-N 2.8Å
138	T	54.9	Low	54.7	Low	97 Å²	97	97.2 Å²	97.2	60%	0.595	44%	0.443	S	S	*	.	H	α-helix	trans	-90.2	-32.7	-172.6	-43	0	0	0	0	112.7	R134 L135	R134-T138 WeakPolarHBondContact O-CB 3.43Å; R134-T138 PolarHBondContact O-N 3.43Å; R134-T138 PolarHBondContact O-OG1 3.49Å; L135-T138 PolarHBondContact O-N 3.37Å
139	H	54.3	Low	54.7	Low	91 Å²	91	99.7 Å²	99.7	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-119.1	-0.2	-169.3	-67.9	-75.2	0	0	0	114.8	L135 L141	L135-H139 PolarHBondContact O-N 3.4Å; H139-L141 HydrophobicContact CB-CB 4.17Å; H139-L141 HydrophobicContact CB-CD1 3.4Å; H139-L141 HydrophobicContact CB-CG 3.56Å; H139-L141 PolarHBondContact O-N 3.02Å
140	H	51.3	Low	54.9	Low	179 Å²	179	94.8 Å²	94.8	83%	0.829	43%	0.427	S	S	*	.			trans	47.9	21.1	-168.4	-65.8	-80.2	0	0	0	113	Y136 S142	Y136-H140 PolarHBondContact O-N 2.83Å; H140-S142 PolarHBondContact O-N 3.32Å
141	L	51.4	Low	55	Low	24 Å²	24	93 Å²	93	13%	0.126	42%	0.422	C	S	.	.			trans	-71.3	126.2	179.7	-77.2	163.4	0	0	0	106.9	H139 W143 E145 V146	H139-L141 HydrophobicContact CB-CB 4.17Å; H139-L141 HydrophobicContact CB-CD1 3.4Å; H139-L141 HydrophobicContact CB-CG 3.56Å; H139-L141 PolarHBondContact O-N 3.02Å; L141-W143 PolarHBondContact O-N 2.77Å; L141-E145 HydrophobicContact CD2-CB 4.06Å; L141-E145 HydrophobicContact CD2-CG 3.83Å; L141-E145 WeakPolarHBondContact CD2-OE1 3.15Å; L141-E145 WeakPolarHBondContact CD2-OE2 3.26Å; L141-V146 HydrophobicContact CB-CG2 3.73Å; L141-V146 HydrophobicContact CD1-CG2 4.33Å
142	S	55.7	Low	54.8	Low	55 Å²	55	92.9 Å²	92.9	39%	0.385	43%	0.427	S	S	.	.			trans	-53.7	140.5	169.8	67.6	0	0	0	0	108.6	H140 R144 E145 V146	H140-S142 PolarHBondContact O-N 3.32Å; S142-R144 PolarHBondContact O-N 2.79Å; S142-E145 PolarHBondContact O-N 3.06Å; S142-E145 PolarHBondContact OG-N 2.87Å; S142-V146 PolarHBondContact O-N 2.93Å
143	W	52.6	Low	54.5	Low	181 Å²	181	91.5 Å²	91.5	69%	0.686	42%	0.422	S	S	*	.	H	α-helix	trans	-46.9	-34.4	175.6	71	-90.1	0	0	0	111.5	L141 V146 F147	L141-W143 PolarHBondContact O-N 2.77Å; W143-V146 PolarHBondContact O-N 3.39Å; W143-F147 HydrophobicContact CE3-CB 4.32Å; W143-F147 HydrophobicContact CZ3-CB 4.49Å; W143-F147 HydrophobicContact CZ3-CD1 4.44Å; W143-F147 WeakPolarHBondContact O-CB 3.12Å; W143-F147 PolarHBondContact O-N 3.31Å
144	R	52.2	Low	54.3	Low	145 Å²	145	89.6 Å²	89.6	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-58.4	-47.2	176.9	-171.1	174.3	-177.2	-165.5	-6.8	110.9	S142 F147 Y148	S142-R144 PolarHBondContact O-N 2.79Å; R144-F147 PolarHBondContact O-N 2.76Å; R144-Y148 HydrophobicContact CG-CD2 3.64Å; R144-Y148 HydrophobicContact CG-CE2 3.3Å; R144-Y148 WeakPolarHBondContact O-CB 3.25Å; R144-Y148 WeakPolarHBondContact O-CD2 3.39Å; R144-Y148 PolarHBondContact O-N 3.25Å
145	E	52.2	Low	54	Low	82 Å²	82	84.4 Å²	84.4	38%	0.383	39%	0.394	S	S	.	.	H	α-helix	trans	-71.3	-40.3	-178.7	-159	169.7	160.2	0	0	112.7	L141 S142 F147 Y148 R149	L141-E145 HydrophobicContact CD2-CB 4.06Å; L141-E145 HydrophobicContact CD2-CG 3.83Å; L141-E145 WeakPolarHBondContact CD2-OE1 3.15Å; L141-E145 WeakPolarHBondContact CD2-OE2 3.26Å; S142-E145 PolarHBondContact O-N 3.06Å; S142-E145 PolarHBondContact OG-N 2.87Å; E145-F147 VanDerWaalsContact C-N 3.31Å; E145-F147 PolarHBondContact O-N 2.95Å; E145-Y148 PolarHBondContact O-N 3.31Å; E145-R149 WeakPolarHBondContact O-CB 3.23Å; E145-R149 VanDerWaalsContact O-CG 3.31Å; E145-R149 WeakPolarHBondContact O-CG 3.39Å; E145-R149 PolarHBondContact O-N 2.9Å; E145-R149 IonicContact OE1-CZ 3.75Å; E145-R149 IonicContact OE1-NE 3.73Å; E145-R149 IonicContact OE1-NH2 2.94Å; E145-R149 PolarHBondContact OE1-NH2 3.21Å
146	V	54.9	Low	53.9	Low	10 Å²	10	89.3 Å²	89.3	6%	0.061	42%	0.415	C	S	.	.	H	α-helix	trans	-62	-42.8	173.2	-179	0	0	0	0	110.6	F132 L135 L141 S142 W143 L150	F132-V146 HydrophobicContact CD1-CG1 4.11Å; F132-V146 HydrophobicContact CE1-CG1 3.94Å; L135-V146 HydrophobicContact CB-CG1 4.44Å; L135-V146 HydrophobicContact CB-CG2 4.45Å; L135-V146 HydrophobicContact CD1-CG1 3.98Å; L135-V146 HydrophobicContact CD2-CG1 3.98Å; L135-V146 HydrophobicContact CD2-CG2 4.07Å; L135-V146 HydrophobicContact CG-CG1 4.36Å; L141-V146 HydrophobicContact CB-CG2 3.73Å; L141-V146 HydrophobicContact CD1-CG2 4.33Å; S142-V146 PolarHBondContact O-N 2.93Å; W143-V146 PolarHBondContact O-N 3.39Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 PolarHBondContact O-N 3.15Å
147	F	58.8	Low	53.5	Low	93 Å²	93	84.9 Å²	84.9	41%	0.408	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-44.8	177.7	-175.8	-106	0	0	0	112.1	W143 R144 E145 L150 L151	W143-F147 HydrophobicContact CE3-CB 4.32Å; W143-F147 HydrophobicContact CZ3-CB 4.49Å; W143-F147 HydrophobicContact CZ3-CD1 4.44Å; W143-F147 WeakPolarHBondContact O-CB 3.12Å; W143-F147 PolarHBondContact O-N 3.31Å; R144-F147 PolarHBondContact O-N 2.76Å; E145-F147 VanDerWaalsContact C-N 3.31Å; E145-F147 PolarHBondContact O-N 2.95Å; F147-L150 PolarHBondContact O-N 2.95Å; F147-L151 HydrophobicContact CD1-CD1 3.72Å; F147-L151 HydrophobicContact CD1-CG 4.27Å; F147-L151 HydrophobicContact CE1-CD1 3.29Å; F147-L151 HydrophobicContact CE1-CG 4.01Å; F147-L151 HydrophobicContact CZ-CD1 3.79Å; F147-L151 HydrophobicContact CZ-CD2 4.31Å; F147-L151 HydrophobicContact CZ-CG 4.13Å; F147-L151 WeakPolarHBondContact O-CB 3.47Å; F147-L151 WeakPolarHBondContact O-CG 3.37Å; F147-L151 PolarHBondContact O-N 3Å
148	Y	55.7	Low	52.8	Low	126 Å²	126	81.2 Å²	81.2	49%	0.494	38%	0.384	S	S	.	.	H	α-helix	trans	-67.7	-36.5	176.8	-78.9	-62.4	0	0	0	113.1	R144 E145 L150 L151 S152	R144-Y148 HydrophobicContact CG-CD2 3.64Å; R144-Y148 HydrophobicContact CG-CE2 3.3Å; R144-Y148 WeakPolarHBondContact O-CB 3.25Å; R144-Y148 WeakPolarHBondContact O-CD2 3.39Å; R144-Y148 PolarHBondContact O-N 3.25Å; E145-Y148 PolarHBondContact O-N 3.31Å; Y148-L150 VanDerWaalsContact C-N 3.34Å; Y148-L151 HydrophobicContact CD1-CD1 4.37Å; Y148-L151 PolarHBondContact O-N 2.94Å; Y148-S152 VanDerWaalsContact O-CB 3.28Å; Y148-S152 WeakPolarHBondContact O-CB 3.45Å; Y148-S152 PolarHBondContact O-N 3.4Å
149	R	55.2	Low	52.1	Low	112 Å²	112	83 Å²	83	42%	0.423	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-42.6	173.1	-73.4	-176.8	-170.7	-158.1	5.4	111	E145 S152 Q153	E145-R149 WeakPolarHBondContact O-CB 3.23Å; E145-R149 VanDerWaalsContact O-CG 3.31Å; E145-R149 WeakPolarHBondContact O-CG 3.39Å; E145-R149 PolarHBondContact O-N 2.9Å; E145-R149 IonicContact OE1-CZ 3.75Å; E145-R149 IonicContact OE1-NE 3.73Å; E145-R149 IonicContact OE1-NH2 2.94Å; E145-R149 PolarHBondContact OE1-NH2 3.21Å; R149-S152 PolarHBondContact O-N 3.31Å; R149-Q153 WeakPolarHBondContact O-CG 3.14Å; R149-Q153 PolarHBondContact O-N 3.43Å
150	L	58	Low	51.3	Low	18 Å²	18	86.7 Å²	86.7	9%	0.094	40%	0.404	C	S	.	.	H	α-helix	trans	-62.7	-45.7	175	-176.1	63.7	0	0	0	111.6	F132 V146 F147 Y148 S152 Q153 L154 L235	F132-L150 HydrophobicContact CZ-CD2 4.34Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 PolarHBondContact O-N 3.15Å; F147-L150 PolarHBondContact O-N 2.95Å; Y148-L150 VanDerWaalsContact C-N 3.34Å; L150-S152 VanDerWaalsContact C-N 3.34Å; L150-S152 PolarHBondContact O-N 3.46Å; L150-Q153 PolarHBondContact O-N 3.16Å; L150-L154 HydrophobicContact CG-CD1 4.12Å; L150-L154 WeakPolarHBondContact O-CB 3.42Å; L150-L154 WeakPolarHBondContact O-CG 3.28Å; L150-L154 PolarHBondContact O-N 3.33Å; L150-L235 HydrophobicContact CD1-CD2 3.58Å; L150-L235 HydrophobicContact CD1-CG 3.83Å; L150-L235 HydrophobicContact CD2-CD2 4.16Å; L150-L235 HydrophobicContact CG-CD2 4.36Å
151	L	58.8	Low	50.6	Low	71 Å²	71	80.1 Å²	80.1	37%	0.372	38%	0.381	S	S	.	.	H	α-helix	trans	-61.6	-41	174.8	-75.3	-179.1	0	0	0	111.9	F147 Y148 L154 D155	F147-L151 HydrophobicContact CD1-CD1 3.72Å; F147-L151 HydrophobicContact CD1-CG 4.27Å; F147-L151 HydrophobicContact CE1-CD1 3.29Å; F147-L151 HydrophobicContact CE1-CG 4.01Å; F147-L151 HydrophobicContact CZ-CD1 3.79Å; F147-L151 HydrophobicContact CZ-CD2 4.31Å; F147-L151 HydrophobicContact CZ-CG 4.13Å; F147-L151 WeakPolarHBondContact O-CB 3.47Å; F147-L151 WeakPolarHBondContact O-CG 3.37Å; F147-L151 PolarHBondContact O-N 3Å; Y148-L151 HydrophobicContact CD1-CD1 4.37Å; Y148-L151 PolarHBondContact O-N 2.94Å; L151-L154 PolarHBondContact O-N 2.81Å; L151-D155 VanDerWaalsContact O-CB 3.25Å; L151-D155 WeakPolarHBondContact O-CB 3.33Å; L151-D155 PolarHBondContact O-N 2.84Å
152	S	53.7	Low	49.6	Very low	57 Å²	57	89 Å²	89	40%	0.399	42%	0.418	S	S	.	.	H	α-helix	trans	-66.2	-39.1	177.9	-176.5	0	0	0	0	112.1	Y148 R149 L150 D155 K156	Y148-S152 VanDerWaalsContact O-CB 3.28Å; Y148-S152 WeakPolarHBondContact O-CB 3.45Å; Y148-S152 PolarHBondContact O-N 3.4Å; R149-S152 PolarHBondContact O-N 3.31Å; L150-S152 VanDerWaalsContact C-N 3.34Å; L150-S152 PolarHBondContact O-N 3.46Å; S152-D155 PolarHBondContact O-N 3.4Å; S152-K156 WeakPolarHBondContact O-CG 2.98Å; S152-K156 PolarHBondContact O-N 3.48Å
153	Q	52.4	Low	48.5	Very low	50 Å²	50	91.4 Å²	91.4	23%	0.234	42%	0.422	C	S	.	.	H	α-helix	trans	-71.2	-38.5	174.9	-70	-66.6	-12	0	0	112	R149 L150 D155 K156 V157 L234 C238	R149-Q153 WeakPolarHBondContact O-CG 3.14Å; R149-Q153 PolarHBondContact O-N 3.43Å; L150-Q153 PolarHBondContact O-N 3.16Å; Q153-D155 VanDerWaalsContact C-N 3.34Å; Q153-K156 PolarHBondContact O-N 3.24Å; Q153-V157 WeakPolarHBondContact O-CG2 3.34Å; Q153-V157 PolarHBondContact O-N 3.35Å; Q153-V157 VanDerWaalsContact O-N 3.12Å; Q153-L234 HydrophobicContact CB-CD2 3.95Å; Q153-C238 WeakPolarHBondContact CG-SG 3.33Å
154	L	52.8	Low	47.6	Very low	40 Å²	40	88 Å²	88	21%	0.209	42%	0.423	C	S	.	.	H	α-helix	trans	-61.1	-44.9	170.8	-78	168.4	0	0	0	110.6	L150 L151 K156 V157 I158 L226 L234	L150-L154 HydrophobicContact CG-CD1 4.12Å; L150-L154 WeakPolarHBondContact O-CB 3.42Å; L150-L154 WeakPolarHBondContact O-CG 3.28Å; L150-L154 PolarHBondContact O-N 3.33Å; L151-L154 PolarHBondContact O-N 2.81Å; L154-K156 VanDerWaalsContact C-N 3.34Å; L154-K156 PolarHBondContact O-N 2.94Å; L154-V157 PolarHBondContact O-N 3.32Å; L154-V157 VanDerWaalsContact O-N 3.14Å; L154-I158 HydrophobicContact CB-CD1 4.21Å; L154-I158 WeakPolarHBondContact O-CB 3.37Å; L154-I158 WeakPolarHBondContact O-CD1 3.39Å; L154-I158 VanDerWaalsContact O-CG1 3.23Å; L154-I158 WeakPolarHBondContact O-CG1 3.45Å; L154-I158 PolarHBondContact O-N 3.16Å; L154-L226 HydrophobicContact CD2-CD2 4.35Å; L154-L234 HydrophobicContact CD2-CD1 4.03Å
155	D	49.5	Very low	46.8	Very low	76 Å²	76	86.1 Å²	86.1	41%	0.406	42%	0.419	S	S	.	.	H	α-helix	trans	-61.4	-39.1	177.9	-168.5	46.3	0	0	0	111.6	L151 S152 Q153 V157 I158 M159	L151-D155 VanDerWaalsContact O-CB 3.25Å; L151-D155 WeakPolarHBondContact O-CB 3.33Å; L151-D155 PolarHBondContact O-N 2.84Å; S152-D155 PolarHBondContact O-N 3.4Å; Q153-D155 VanDerWaalsContact C-N 3.34Å; D155-V157 PolarHBondContact O-N 2.64Å; D155-I158 PolarHBondContact O-N 2.89Å; D155-M159 WeakPolarHBondContact O-CB 3.49Å; D155-M159 WeakPolarHBondContact O-CG 3.37Å; D155-M159 PolarHBondContact O-N 3.48Å; D155-M159 WeakPolarHBondContact OD1-CE 3.43Å
156	K	49.6	Very low	45.9	Very low	112 Å²	112	87.6 Å²	87.6	49%	0.487	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-44.3	172.1	-73.8	172.6	-174.7	176.9	0	112.6	S152 Q153 L154 I158 Q160	S152-K156 WeakPolarHBondContact O-CG 2.98Å; S152-K156 PolarHBondContact O-N 3.48Å; Q153-K156 PolarHBondContact O-N 3.24Å; L154-K156 VanDerWaalsContact C-N 3.34Å; L154-K156 PolarHBondContact O-N 2.94Å; K156-I158 VanDerWaalsContact C-N 3.34Å; K156-Q160 WeakPolarHBondContact O-CB 3.36Å; K156-Q160 VanDerWaalsContact O-CG 3.26Å; K156-Q160 WeakPolarHBondContact O-CG 3.42Å; K156-Q160 PolarHBondContact O-N 3.28Å; K156-Q160 VanDerWaalsContact O-N 3.09Å
157	V	43.7	Very low	44.9	Very low	54 Å²	54	93.5 Å²	93.5	33%	0.327	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-37.5	178.4	172.1	0	0	0	0	111.5	Q153 L154 D155 A161 L234	Q153-V157 WeakPolarHBondContact O-CG2 3.34Å; Q153-V157 PolarHBondContact O-N 3.35Å; Q153-V157 VanDerWaalsContact O-N 3.12Å; L154-V157 PolarHBondContact O-N 3.32Å; L154-V157 VanDerWaalsContact O-N 3.14Å; D155-V157 PolarHBondContact O-N 2.64Å; V157-A161 PolarHBondContact O-N 3.28Å; V157-L234 HydrophobicContact CG2-CD1 4.07Å; V157-L234 HydrophobicContact CG2-CD2 3.48Å; V157-L234 VanDerWaalsContact CG2-CD2 3.48Å; V157-L234 HydrophobicContact CG2-CG 4.29Å
158	I	41.4	Very low	43.7	Very low	33 Å²	33	93.8 Å²	93.8	17%	0.169	47%	0.465	C	S	.	.	H	α-helix	trans	-70.6	-44.4	177.8	-82.5	162.8	0	0	0	111.5	L154 D155 K156 Q160 A161 F165	L154-I158 HydrophobicContact CB-CD1 4.21Å; L154-I158 WeakPolarHBondContact O-CB 3.37Å; L154-I158 WeakPolarHBondContact O-CD1 3.39Å; L154-I158 VanDerWaalsContact O-CG1 3.23Å; L154-I158 WeakPolarHBondContact O-CG1 3.45Å; L154-I158 PolarHBondContact O-N 3.16Å; D155-I158 PolarHBondContact O-N 2.89Å; K156-I158 VanDerWaalsContact C-N 3.34Å; I158-Q160 VanDerWaalsContact C-N 3.33Å; I158-A161 CarbonylContact O-C 3.18Å; I158-A161 PolarHBondContact O-N 3.41Å; I158-A161 VanDerWaalsContact O-N 3.11Å; I158-F165 HydrophobicContact CB-CE2 4.07Å; I158-F165 HydrophobicContact CD1-CE2 3.77Å; I158-F165 HydrophobicContact CD1-CZ 3.59Å; I158-F165 HydrophobicContact CG1-CE2 3.92Å; I158-F165 HydrophobicContact CG1-CZ 4.18Å; I158-F165 HydrophobicContact CG2-CD2 3.57Å; I158-F165 HydrophobicContact CG2-CE2 3.09Å; I158-F165 HydrophobicContact CG2-CZ 4.07Å
159	M	39.4	Very low	42.4	Very low	134 Å²	134	91 Å²	91	66%	0.66	47%	0.468	S	S	*	.	H	α-helix	trans	-71.1	-30.9	-179.6	-73.7	-76.5	177.4	0	0	111.4	D155 A161	D155-M159 WeakPolarHBondContact O-CB 3.49Å; D155-M159 WeakPolarHBondContact O-CG 3.37Å; D155-M159 PolarHBondContact O-N 3.48Å; D155-M159 WeakPolarHBondContact OD1-CE 3.43Å; M159-A161 VanDerWaalsContact C-N 3.26Å; M159-A161 PolarHBondContact O-N 2.85Å
160	Q	37.6	Very low	41.3	Very low	169 Å²	169	91.9 Å²	91.9	79%	0.79	48%	0.477	S	S	*	.	H	α-helix	trans	-66.8	-29.7	169.7	-78.8	-177.9	-6.1	0	0	112.6	K156 I158	K156-Q160 WeakPolarHBondContact O-CB 3.36Å; K156-Q160 VanDerWaalsContact O-CG 3.26Å; K156-Q160 WeakPolarHBondContact O-CG 3.42Å; K156-Q160 PolarHBondContact O-N 3.28Å; K156-Q160 VanDerWaalsContact O-N 3.09Å; I158-Q160 VanDerWaalsContact C-N 3.33Å
161	A	37	Very low	40.1	Very low	41 Å²	41	99 Å²	99	34%	0.339	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	81.5	177.5	0	0	0	0	0	109.2	V157 I158 M159 F163	V157-A161 PolarHBondContact O-N 3.28Å; I158-A161 CarbonylContact O-C 3.18Å; I158-A161 PolarHBondContact O-N 3.41Å; I158-A161 VanDerWaalsContact O-N 3.11Å; M159-A161 VanDerWaalsContact C-N 3.26Å; M159-A161 PolarHBondContact O-N 2.85Å; A161-F163 VanDerWaalsContact C-N 3.26Å; A161-F163 HydrophobicContact CB-CD2 3.45Å; A161-F163 VanDerWaalsContact CB-CD2 3.45Å; A161-F163 HydrophobicContact CB-CE2 3.31Å; A161-F163 HydrophobicContact CB-CZ 4.39Å; A161-F163 WeakPolarHBondContact O-CA 3.31Å; A161-F163 WeakPolarHBondContact O-CB 3.43Å; A161-F163 WeakPolarHBondContact O-CD2 3.16Å; A161-F163 WeakPolarHBondContact O-CG 3.39Å; A161-F163 PolarHBondContact O-N 3.38Å
162	K	29.7	Very low	39	Very low	209 Å²	209	101.7 Å²	101.7	91%	0.909	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-19.3	70.7	176.2	-63.7	-178.7	177.9	-179	0	116.5
163	F	32.6	Very low	38	Very low	107 Å²	107	107.3 Å²	107.3	47%	0.469	54%	0.539	S	S	.	.			trans	-110.8	122.8	-170	-86.4	-61.1	0	0	0	107.9	A161 F165	A161-F163 VanDerWaalsContact C-N 3.26Å; A161-F163 HydrophobicContact CB-CD2 3.45Å; A161-F163 VanDerWaalsContact CB-CD2 3.45Å; A161-F163 HydrophobicContact CB-CE2 3.31Å; A161-F163 HydrophobicContact CB-CZ 4.39Å; A161-F163 WeakPolarHBondContact O-CA 3.31Å; A161-F163 WeakPolarHBondContact O-CB 3.43Å; A161-F163 WeakPolarHBondContact O-CD2 3.16Å; A161-F163 WeakPolarHBondContact O-CG 3.39Å; A161-F163 PolarHBondContact O-N 3.38Å; F163-F165 HydrophobicContact CB-CE2 4.44Å; F163-F165 PolarHBondContact O-N 3.16Å; F163-F165 VanDerWaalsContact O-N 3.12Å
164	P	35.1	Very low	37.1	Very low	108 Å²	108	114.8 Å²	114.8	70%	0.701	57%	0.566	S	S	*	*			trans	-74.5	103.1	176.8	28.3	-30.7	0	0	0	110	V166	P164-V166 PolarHBondContact O-N 3.08Å; P164-V166 VanDerWaalsContact O-N 3.15Å
165	F	34.1	Very low	36.2	Very low	107 Å²	107	115.6 Å²	115.6	47%	0.469	58%	0.578	S	S	.	*			trans	-76	94.4	172.5	-98	-81.2	0	0	0	110.9	I158 F163 I168	I158-F165 HydrophobicContact CB-CE2 4.07Å; I158-F165 HydrophobicContact CD1-CE2 3.77Å; I158-F165 HydrophobicContact CD1-CZ 3.59Å; I158-F165 HydrophobicContact CG1-CE2 3.92Å; I158-F165 HydrophobicContact CG1-CZ 4.18Å; I158-F165 HydrophobicContact CG2-CD2 3.57Å; I158-F165 HydrophobicContact CG2-CE2 3.09Å; I158-F165 HydrophobicContact CG2-CZ 4.07Å; F163-F165 HydrophobicContact CB-CE2 4.44Å; F163-F165 PolarHBondContact O-N 3.16Å; F163-F165 VanDerWaalsContact O-N 3.12Å; F165-I168 HydrophobicContact CD1-CB 3.84Å; F165-I168 HydrophobicContact CD1-CD1 3.54Å; F165-I168 HydrophobicContact CD1-CG1 3.57Å; F165-I168 HydrophobicContact CE1-CB 4.13Å; F165-I168 HydrophobicContact CE1-CD1 2.98Å; F165-I168 HydrophobicContact CE1-CG1 3.33Å; F165-I168 HydrophobicContact CZ-CD1 3.85Å
166	V	33	Very low	35.4	Very low	113 Å²	113	116.7 Å²	116.7	69%	0.685	59%	0.589	S	S	*	*			trans	-109.2	-14.1	172.2	-176.7	0	0	0	0	112.3	P164	P164-V166 PolarHBondContact O-N 3.08Å; P164-V166 VanDerWaalsContact O-N 3.15Å
167	E	33.9	Very low	34.6	Very low	133 Å²	133	118.9 Å²	118.9	62%	0.621	61%	0.605	S	S	*	*	S	Bend	trans	-105.5	-20.8	-172.7	-78.9	-177.1	154.1	0	0	116.8	A169 Q170	E167-A169 VanDerWaalsContact C-N 3.27Å; E167-A169 PolarHBondContact O-N 2.86Å; E167-Q170 PolarHBondContact O-N 3.45Å; E167-Q170 VanDerWaalsContact O-N 3.13Å
168	I	34	Very low	34.2	Very low	100 Å²	100	123 Å²	123	51%	0.513	62%	0.624	S	S	.	*	H	α-helix	trans	-67.9	-29.5	178.1	-74	-173.5	0	0	0	112.3	F165 Q170 F171 D172	F165-I168 HydrophobicContact CD1-CB 3.84Å; F165-I168 HydrophobicContact CD1-CD1 3.54Å; F165-I168 HydrophobicContact CD1-CG1 3.57Å; F165-I168 HydrophobicContact CE1-CB 4.13Å; F165-I168 HydrophobicContact CE1-CD1 2.98Å; F165-I168 HydrophobicContact CE1-CG1 3.33Å; F165-I168 HydrophobicContact CZ-CD1 3.85Å; I168-Q170 PolarHBondContact O-N 3.29Å; I168-Q170 VanDerWaalsContact O-N 3.11Å; I168-F171 PolarHBondContact O-N 3.06Å; I168-D172 PolarHBondContact O-N 3.43Å
169	A	29.2	Very low	33.7	Very low	66 Å²	66	128.9 Å²	128.9	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-63.6	-16.4	175.5	0	0	0	0	0	113.4	E167	E167-A169 VanDerWaalsContact C-N 3.27Å; E167-A169 PolarHBondContact O-N 2.86Å
170	Q	31.4	Very low	33.4	Very low	132 Å²	132	128.3 Å²	128.3	62%	0.617	66%	0.661	S	S	*	*	H	α-helix	trans	-85.9	-24.7	174.4	-63.3	-169.4	11	0	0	113	E167 I168	E167-Q170 PolarHBondContact O-N 3.45Å; E167-Q170 VanDerWaalsContact O-N 3.13Å; I168-Q170 PolarHBondContact O-N 3.29Å; I168-Q170 VanDerWaalsContact O-N 3.11Å
171	F	33.1	Very low	33	Very low	168 Å²	168	124.3 Å²	124.3	74%	0.737	67%	0.665	S	S	*	*	H	α-helix	trans	-73.4	-36.2	172.4	-101.5	-89.2	0	0	0	111.7	I168 K173 R174 A175	I168-F171 PolarHBondContact O-N 3.06Å; F171-K173 VanDerWaalsContact C-N 3.28Å; F171-K173 PolarHBondContact O-N 2.76Å; F171-R174 PolarHBondContact O-N 3.42Å; F171-A175 PolarHBondContact O-N 2.93Å
172	D	35.2	Very low	32.8	Very low	127 Å²	127	128.4 Å²	128.4	68%	0.679	68%	0.681	S	S	*	*	H	α-helix	trans	-65.5	-30.8	178.3	-155	23.5	0	0	0	112.4	I168 R174 A175	I168-D172 PolarHBondContact O-N 3.43Å; D172-R174 VanDerWaalsContact C-N 3.3Å; D172-R174 PolarHBondContact O-N 3.39Å; D172-A175 PolarHBondContact O-N 2.88Å
173	K	33	Very low	33	Very low	175 Å²	175	123 Å²	123	76%	0.761	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-13.2	173.9	-68.8	-176.4	-178.9	-175.4	0	114.5	F171 P176	F171-K173 VanDerWaalsContact C-N 3.28Å; F171-K173 PolarHBondContact O-N 2.76Å; K173-P176 WeakPolarHBondContact O-CD 3.31Å
174	R	33.4	Very low	33	Very low	207 Å²	207	126.5 Å²	126.5	78%	0.781	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-5.8	174.4	-76.3	-177.8	169.9	176.1	-1.6	113.2	F171 D172 P176	F171-R174 PolarHBondContact O-N 3.42Å; D172-R174 VanDerWaalsContact C-N 3.3Å; D172-R174 PolarHBondContact O-N 3.39Å; R174-P176 WeakPolarHBondContact O-CD 3.43Å
175	A	34.9	Very low	32.9	Very low	56 Å²	56	125.7 Å²	125.7	46%	0.463	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-77	3.9	175.2	0	0	0	0	0	118.2	F171 D172 L177	F171-A175 PolarHBondContact O-N 2.93Å; D172-A175 PolarHBondContact O-N 2.88Å; A175-L177 VanDerWaalsContact C-N 3.29Å; A175-L177 PolarHBondContact O-N 3.5Å
176	P	31.6	Very low	32.9	Very low	100 Å²	100	125.8 Å²	125.8	65%	0.649	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-76.7	4.1	178.8	-13.1	28.2	0	0	0	116.9	K173 R174	K173-P176 WeakPolarHBondContact O-CD 3.31Å; R174-P176 WeakPolarHBondContact O-CD 3.43Å
177	L	34.4	Very low	32.6	Very low	158 Å²	158	124.4 Å²	124.4	83%	0.827	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-101.1	3.3	-174.8	-79.3	161.8	0	0	0	115.1	A175	A175-L177 VanDerWaalsContact C-N 3.29Å; A175-L177 PolarHBondContact O-N 3.5Å
178	L	35.1	Very low	32.6	Very low	139 Å²	139	125.1 Å²	125.1	73%	0.728	72%	0.722	S	S	*	*	S	Bend	trans	-106.9	2	-177.7	-74	165.3	0	0	0	114.6
179	N	29.6	Very low	32.3	Very low	157 Å²	157	128.2 Å²	128.2	84%	0.84	74%	0.735	S	S	*	*			trans	-107.5	68.4	175.3	-80.1	-13.1	0	0	0	111.1
180	T	33	Very low	32.2	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	74%	0.743	S	S	*	*			trans	-109.6	100.8	155.4	34.6	0	0	0	0	107	D182	T180-D182 PolarHBondContact O-N 3.46Å
181	G	30.4	Very low	31.9	Very low	86 Å²	86	129.9 Å²	129.9	89%	0.887	76%	0.755	S	S	*	*			trans	-70.4	43	-174.5	0	0	0	0	0	115.5
182	D	33.1	Very low	31.7	Very low	127 Å²	127	126.7 Å²	126.7	68%	0.679	75%	0.754	S	S	*	*	S	Bend	trans	-106.8	123.4	160.9	-80.5	-36.5	0	0	0	106	T180 K184	T180-D182 PolarHBondContact O-N 3.46Å; D182-K184 PolarHBondContact O-N 3.34Å
183	G	33.4	Very low	31.5	Very low	95 Å²	95	128.2 Å²	128.2	98%	0.979	76%	0.76	S	S	*	*	S	Bend	trans	-60.9	32.9	-177.1	0	0	0	0	0	116.6
184	K	31.4	Very low	31.7	Very low	181 Å²	181	126.6 Å²	126.6	79%	0.787	76%	0.76	S	S	*	*			trans	-90.1	111.7	168.8	-68.8	-177	178.2	175.2	0	108.3	D182	D182-K184 PolarHBondContact O-N 3.34Å
185	A	34.1	Very low	31.9	Very low	91 Å²	91	121.6 Å²	121.6	75%	0.752	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-47.5	134.7	173.9	0	0	0	0	0	111	S187	A185-S187 PolarHBondContact O-N 3.41Å; A185-S187 VanDerWaalsContact O-N 3.16Å
186	P	33.8	Very low	32.4	Very low	109 Å²	109	123.8 Å²	123.8	71%	0.708	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-62.4	121.5	-178.1	22.8	-30.6	0	0	0	109.9	T188	P186-T188 PolarHBondContact O-N 3.15Å
187	S	26.9	Very low	33.3	Very low	84 Å²	84	121.8 Å²	121.8	59%	0.587	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-48.4	125.7	172.3	163.4	0	0	0	0	110.6	A185 Q189	A185-S187 PolarHBondContact O-N 3.41Å; A185-S187 VanDerWaalsContact O-N 3.16Å; S187-Q189 PolarHBondContact O-N 3.42Å; S187-Q189 PolarHBondContact OG-N 2.87Å
188	T	33.4	Very low	34.7	Very low	147 Å²	147	118 Å²	118	90%	0.902	73%	0.734	S	S	*	*	S	Bend	trans	-65.6	20.6	176.5	33	0	0	0	0	114.4	P186	P186-T188 PolarHBondContact O-N 3.15Å
189	Q	28.5	Very low	35.7	Very low	166 Å²	166	116.5 Å²	116.5	78%	0.776	73%	0.726	S	S	*	*			trans	-125.3	65.3	-173.4	-60	-173.6	-0.7	0	0	111.3	S187	S187-Q189 PolarHBondContact O-N 3.42Å; S187-Q189 PolarHBondContact OG-N 2.87Å
190	S	27.3	Very low	37.4	Very low	101 Å²	101	111.4 Å²	111.4	71%	0.706	71%	0.707	S	S	*	*			trans	-156.5	54.4	157.8	53.5	0	0	0	0	111.3	S192	S190-S192 PolarHBondContact O-N 2.86Å
191	C	25.3	Very low	38.2	Very low	131 Å²	131	110.6 Å²	110.6	89%	0.885	69%	0.694	S	S	*	*			trans	-74.1	78.5	154.3	-150	0	0	0	0	106.4	I193	C191-I193 PolarHBondContact O-N 3.03Å; C191-I193 VanDerWaalsContact O-N 3.13Å
192	S	27.2	Very low	39.3	Very low	102 Å²	102	111.7 Å²	111.7	71%	0.713	67%	0.672	S	S	*	*			trans	-64.5	113.1	175.5	34.4	0	0	0	0	108.1	S190 L194	S190-S192 PolarHBondContact O-N 2.86Å; S192-L194 PolarHBondContact O-N 2.93Å
193	I	30.9	Very low	40.5	Very low	158 Å²	158	112.4 Å²	112.4	81%	0.81	67%	0.671	S	S	*	*			trans	-51.7	106.7	172.4	-61.5	161.8	0	0	0	106.7	C191	C191-I193 PolarHBondContact O-N 3.03Å; C191-I193 VanDerWaalsContact O-N 3.13Å
194	L	38.5	Very low	41.3	Very low	142 Å²	142	117 Å²	117	74%	0.743	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-56.2	135.1	168.8	-80	166.6	0	0	0	107.5	S192	S192-L194 PolarHBondContact O-N 2.93Å
195	P	37.3	Very low	42.2	Very low	102 Å²	102	113 Å²	113	66%	0.662	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-54.8	143.9	172.2	23.6	-31.6	0	0	0	108.6
196	P	46.4	Very low	43	Very low	102 Å²	102	112.3 Å²	112.3	66%	0.662	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-53.5	138.4	175	23.1	-32.1	0	0	0	108.7	T198	P196-T198 PolarHBondContact O-N 3.41Å
197	P	48.5	Very low	43.6	Very low	57 Å²	57	109.2 Å²	109.2	37%	0.37	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-53.9	137.7	-178.7	20.5	-31.4	0	0	0	109.7	E201 R202	P197-E201 WeakPolarHBondContact CA-OE2 3.18Å; P197-E201 HydrophobicContact CB-CB 4.07Å; P197-R202 HydrophobicContact CB-CG 4.49Å; P197-R202 HydrophobicContact CG-CG 4.33Å; P197-R202 PolarHBondContact O-NH1 3.24Å; P197-R202 PolarHBondContact O-NH2 3.33Å
198	T	64.6	Low	44.3	Very low	80 Å²	80	112.9 Å²	112.9	49%	0.491	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-63.1	155.8	176.2	47.5	0	0	0	0	110.3	P196 A200 E201 R202	P196-T198 PolarHBondContact O-N 3.41Å; T198-A200 PolarHBondContact O-N 2.86Å; T198-A200 VanDerWaalsContact O-N 3.13Å; T198-E201 PolarHBondContact N-OE2 2.95Å; T198-E201 WeakPolarHBondContact O-CA 3.32Å; T198-E201 WeakPolarHBondContact O-CB 3.33Å; T198-E201 PolarHBondContact O-N 2.8Å; T198-E201 WeakPolarHBondContact OG1-CG 3.44Å; T198-E201 PolarHBondContact OG1-OE2 3.19Å; T198-R202 PolarHBondContact O-N 3.41Å
199	D	56.1	Low	44.9	Very low	106 Å²	106	110.7 Å²	110.7	57%	0.567	60%	0.597	S	S	*	*	H	α-helix	trans	-58.7	-28.6	178.2	-71.8	-31.9	0	0	0	112.4	R202 Q203	D199-R202 PolarHBondContact O-N 2.87Å; D199-R202 IonicContact OD1-CZ 3.28Å; D199-R202 VanDerWaalsContact OD1-CZ 3.28Å; D199-R202 IonicContact OD1-NE 3Å; D199-R202 PolarHBondContact OD1-NE 3.47Å; D199-R202 IonicContact OD1-NH2 2.72Å; D199-R202 PolarHBondContact OD1-NH2 3.27Å; D199-Q203 WeakPolarHBondContact O-CB 3.07Å; D199-Q203 VanDerWaalsContact O-CG 3.3Å; D199-Q203 WeakPolarHBondContact O-CG 3.32Å; D199-Q203 PolarHBondContact O-N 3.47Å
200	A	65.5	Low	45.7	Very low	51 Å²	51	109 Å²	109	42%	0.421	59%	0.589	S	S	.	*	H	α-helix	trans	-65.1	-39.7	171.8	0	0	0	0	0	112.9	T198 R204	T198-A200 PolarHBondContact O-N 2.86Å; T198-A200 VanDerWaalsContact O-N 3.13Å; A200-R204 VanDerWaalsContact O-CG 3.3Å; A200-R204 WeakPolarHBondContact O-CG 3.48Å; A200-R204 PolarHBondContact O-N 3.42Å
201	E	49.9	Very low	46.3	Very low	105 Å²	105	110.2 Å²	110.2	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-71.8	-38.6	175.7	-73.9	166.2	141.9	0	0	111.5	P197 T198 R204 Q205	P197-E201 WeakPolarHBondContact CA-OE2 3.18Å; P197-E201 HydrophobicContact CB-CB 4.07Å; T198-E201 PolarHBondContact N-OE2 2.95Å; T198-E201 WeakPolarHBondContact O-CA 3.32Å; T198-E201 WeakPolarHBondContact O-CB 3.33Å; T198-E201 PolarHBondContact O-N 2.8Å; T198-E201 WeakPolarHBondContact OG1-CG 3.44Å; T198-E201 PolarHBondContact OG1-OE2 3.19Å; E201-R204 PolarHBondContact O-N 3.46Å; E201-Q205 PolarHBondContact O-N 3.38Å
202	R	54.4	Low	46.9	Very low	109 Å²	109	106 Å²	106	41%	0.411	56%	0.56	S	S	.	*	H	α-helix	trans	-60	-46.4	172	-79.5	-168.5	-87.3	-94.1	-0.3	111.7	P197 T198 D199 R204 Q205 V206	P197-R202 HydrophobicContact CB-CG 4.49Å; P197-R202 HydrophobicContact CG-CG 4.33Å; P197-R202 PolarHBondContact O-NH1 3.24Å; P197-R202 PolarHBondContact O-NH2 3.33Å; T198-R202 PolarHBondContact O-N 3.41Å; D199-R202 PolarHBondContact O-N 2.87Å; D199-R202 IonicContact OD1-CZ 3.28Å; D199-R202 VanDerWaalsContact OD1-CZ 3.28Å; D199-R202 IonicContact OD1-NE 3Å; D199-R202 PolarHBondContact OD1-NE 3.47Å; D199-R202 IonicContact OD1-NH2 2.72Å; D199-R202 PolarHBondContact OD1-NH2 3.27Å; R202-R204 VanDerWaalsContact C-N 3.32Å; R202-R204 PolarHBondContact O-N 2.9Å; R202-Q205 WeakPolarHBondContact O-CB 3.38Å; R202-Q205 PolarHBondContact O-N 3.29Å; R202-V206 WeakPolarHBondContact O-CG2 3.37Å; R202-V206 PolarHBondContact O-N 2.9Å
203	Q	58.3	Low	47.5	Very low	141 Å²	141	108 Å²	108	66%	0.659	56%	0.562	S	S	*	*	H	α-helix	trans	-63.4	-37	177	-77.1	174.4	-1.6	0	0	112.4	D199 V206 A207	D199-Q203 WeakPolarHBondContact O-CB 3.07Å; D199-Q203 VanDerWaalsContact O-CG 3.3Å; D199-Q203 WeakPolarHBondContact O-CG 3.32Å; D199-Q203 PolarHBondContact O-N 3.47Å; Q203-V206 PolarHBondContact O-N 3.27Å; Q203-A207 VanDerWaalsContact O-CB 3.24Å; Q203-A207 WeakPolarHBondContact O-CB 3.36Å; Q203-A207 PolarHBondContact O-N 3.07Å
204	R	49.5	Very low	47.9	Very low	193 Å²	193	107.1 Å²	107.1	73%	0.728	56%	0.559	S	S	*	*	H	α-helix	trans	-66.4	-37.4	173.8	-73.9	177	-166.6	-155.1	4.5	112.3	A200 E201 R202 F208	A200-R204 VanDerWaalsContact O-CG 3.3Å; A200-R204 WeakPolarHBondContact O-CG 3.48Å; A200-R204 PolarHBondContact O-N 3.42Å; E201-R204 PolarHBondContact O-N 3.46Å; R202-R204 VanDerWaalsContact C-N 3.32Å; R202-R204 PolarHBondContact O-N 2.9Å; R204-F208 VanDerWaalsContact O-CB 3.25Å; R204-F208 WeakPolarHBondContact O-CB 3.17Å; R204-F208 PolarHBondContact O-N 3.34Å
205	Q	49.7	Very low	47.4	Very low	97 Å²	97	103.3 Å²	103.3	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-64.5	-47.1	174.1	-106.6	172.1	-19.2	0	0	111.9	E201 R202 F208 E209	E201-Q205 PolarHBondContact O-N 3.38Å; R202-Q205 WeakPolarHBondContact O-CB 3.38Å; R202-Q205 PolarHBondContact O-N 3.29Å; Q205-F208 PolarHBondContact O-N 3.48Å; Q205-E209 WeakPolarHBondContact O-CG 3.48Å; Q205-E209 PolarHBondContact O-N 2.96Å
206	V	50.5	Low	47.3	Very low	75 Å²	75	108.9 Å²	108.9	46%	0.455	57%	0.568	S	S	.	*	H	α-helix	trans	-64	-43.4	177.4	175.8	0	0	0	0	111.2	R202 Q203 F208 E209 E210	R202-V206 WeakPolarHBondContact O-CG2 3.37Å; R202-V206 PolarHBondContact O-N 2.9Å; Q203-V206 PolarHBondContact O-N 3.27Å; V206-F208 VanDerWaalsContact C-N 3.27Å; V206-F208 PolarHBondContact O-N 3.31Å; V206-E209 PolarHBondContact O-N 3.49Å; V206-E210 HydrophobicContact CG1-CG 4.41Å; V206-E210 WeakPolarHBondContact O-CB 3.31Å; V206-E210 PolarHBondContact O-N 2.83Å
207	A	46.3	Very low	46.5	Very low	44 Å²	44	108.2 Å²	108.2	36%	0.364	57%	0.572	S	S	.	*	H	α-helix	trans	-65.8	-29	176.2	0	0	0	0	0	112.9	Q203 N211	Q203-A207 VanDerWaalsContact O-CB 3.24Å; Q203-A207 WeakPolarHBondContact O-CB 3.36Å; Q203-A207 PolarHBondContact O-N 3.07Å; A207-N211 VanDerWaalsContact O-CB 3.3Å; A207-N211 WeakPolarHBondContact O-CB 3.26Å; A207-N211 VanDerWaalsContact O-CG 3.3Å; A207-N211 PolarHBondContact O-N 2.94Å; A207-N211 PolarHBondContact O-ND2 3.22Å
208	F	41.7	Very low	45.8	Very low	162 Å²	162	108.2 Å²	108.2	71%	0.711	57%	0.568	S	S	*	*	H	α-helix	trans	-74.3	-38.7	174.3	-168.3	-95.7	0	0	0	111.4	R204 Q205 V206 S212	R204-F208 VanDerWaalsContact O-CB 3.25Å; R204-F208 WeakPolarHBondContact O-CB 3.17Å; R204-F208 PolarHBondContact O-N 3.34Å; Q205-F208 PolarHBondContact O-N 3.48Å; V206-F208 VanDerWaalsContact C-N 3.27Å; V206-F208 PolarHBondContact O-N 3.31Å; F208-S212 VanDerWaalsContact O-CB 3.25Å; F208-S212 WeakPolarHBondContact O-CB 3.43Å; F208-S212 PolarHBondContact O-N 2.95Å; F208-S212 VanDerWaalsContact O-N 3.16Å
209	E	46.7	Very low	44.3	Very low	100 Å²	100	114.5 Å²	114.5	47%	0.467	59%	0.588	S	S	.	*	H	α-helix	trans	-69.4	-42.8	176.2	-74	177.9	177.1	0	0	112.3	Q205 V206 S212 L213	Q205-E209 WeakPolarHBondContact O-CG 3.48Å; Q205-E209 PolarHBondContact O-N 2.96Å; V206-E209 PolarHBondContact O-N 3.49Å; E209-S212 WeakPolarHBondContact O-CB 3.2Å; E209-S212 PolarHBondContact O-N 3.42Å; E209-L213 WeakPolarHBondContact O-CD1 3.47Å; E209-L213 PolarHBondContact O-N 2.92Å
210	E	44.7	Very low	43.2	Very low	130 Å²	130	116.5 Å²	116.5	61%	0.607	60%	0.599	S	S	*	*	H	α-helix	trans	-67.7	-35	177.4	-75.6	-173.2	154.2	0	0	112.9	V206 S212	V206-E210 HydrophobicContact CG1-CG 4.41Å; V206-E210 WeakPolarHBondContact O-CB 3.31Å; V206-E210 PolarHBondContact O-N 2.83Å; E210-S212 VanDerWaalsContact C-N 3.3Å; E210-S212 PolarHBondContact O-N 3.37Å
211	N	41	Very low	41.4	Very low	128 Å²	128	121.8 Å²	121.8	68%	0.684	61%	0.608	S	S	*	*	H	α-helix	trans	-76.2	-17.3	174.3	-76.7	-45.3	0	0	0	113.5	A207	A207-N211 VanDerWaalsContact O-CB 3.3Å; A207-N211 WeakPolarHBondContact O-CB 3.26Å; A207-N211 VanDerWaalsContact O-CG 3.3Å; A207-N211 PolarHBondContact O-N 2.94Å; A207-N211 PolarHBondContact O-ND2 3.22Å
212	S	36.9	Very low	40.7	Very low	41 Å²	41	121.5 Å²	121.5	29%	0.287	61%	0.614	S	S	.	*	H	α-helix	trans	-82.5	-29.5	178	-165.2	0	0	0	0	111.9	F208 E209 E210 I218	F208-S212 VanDerWaalsContact O-CB 3.25Å; F208-S212 WeakPolarHBondContact O-CB 3.43Å; F208-S212 PolarHBondContact O-N 2.95Å; F208-S212 VanDerWaalsContact O-N 3.16Å; E209-S212 WeakPolarHBondContact O-CB 3.2Å; E209-S212 PolarHBondContact O-N 3.42Å; E210-S212 VanDerWaalsContact C-N 3.3Å; E210-S212 PolarHBondContact O-N 3.37Å; S212-I218 WeakPolarHBondContact O-CD1 3.32Å; S212-I218 WeakPolarHBondContact OG-CD1 3.41Å; S212-I218 WeakPolarHBondContact OG-CG1 3.45Å
213	L	40.9	Very low	39.9	Very low	144 Å²	144	123 Å²	123	75%	0.754	63%	0.628	S	S	*	*	H	α-helix	trans	-78.8	-20.7	-178.8	-78.6	151.8	0	0	0	114.1	E209 G215	E209-L213 WeakPolarHBondContact O-CD1 3.47Å; E209-L213 PolarHBondContact O-N 2.92Å; L213-G215 PolarHBondContact O-N 2.84Å
214	N	38.3	Very low	39.1	Very low	140 Å²	140	120 Å²	120	75%	0.749	62%	0.623	S	S	*	*	S	Bend	trans	-94.8	79.4	177.8	-86.6	-18.6	0	0	0	112.3	K216	N214-K216 PolarHBondContact O-N 3.36Å
215	G	29.1	Very low	38.5	Very low	63 Å²	63	114.3 Å²	114.3	65%	0.649	61%	0.612	S	S	*	*	S	Bend	trans	30.8	87.5	151.6	0	0	0	0	0	118.6	L213	L213-G215 PolarHBondContact O-N 2.84Å
216	K	33.5	Very low	38.3	Very low	218 Å²	218	112.9 Å²	112.9	95%	0.948	61%	0.608	S	S	*	*	S	Bend	trans	166	-4.1	137.5	-92.9	163.4	-178.2	177.7	0	114.7	N214	N214-K216 PolarHBondContact O-N 3.36Å
217	A	30.7	Very low	38.1	Very low	89 Å²	89	117.1 Å²	117.1	74%	0.736	62%	0.616	S	S	*	*			trans	-136	68	-169	0	0	0	0	0	114.3
218	I	34.1	Very low	38	Very low	57 Å²	57	118.5 Å²	118.5	29%	0.292	62%	0.616	S	S	.	*			trans	-139.2	65.2	161.8	-37.9	171	0	0	0	110.9	S212 R221	S212-I218 WeakPolarHBondContact O-CD1 3.32Å; S212-I218 WeakPolarHBondContact OG-CD1 3.41Å; S212-I218 WeakPolarHBondContact OG-CG1 3.45Å; I218-R221 HydrophobicContact CG2-CB 3.87Å; I218-R221 HydrophobicContact CG2-CG 3.48Å; I218-R221 VanDerWaalsContact CG2-CG 3.48Å
219	K	33	Very low	38.2	Very low	212 Å²	212	117.7 Å²	117.7	92%	0.922	61%	0.614	S	S	*	*			trans	-87.5	13.3	158.2	-81.5	-174.2	177.9	179.3	0	112.6
220	N	32	Very low	38.3	Very low	147 Å²	147	118 Å²	118	79%	0.786	62%	0.616	S	S	*	*			trans	-101.9	10.7	172.5	-74.5	-9.9	0	0	0	113.4	T222	N220-T222 PolarHBondContact O-N 3.37Å
221	R	29.2	Very low	38.6	Very low	162 Å²	162	114 Å²	114	61%	0.611	60%	0.599	S	S	*	*			trans	-85.3	83.2	172	-102	173.5	-176.2	178.1	4.7	110.1	I218	I218-R221 HydrophobicContact CG2-CB 3.87Å; I218-R221 HydrophobicContact CG2-CG 3.48Å; I218-R221 VanDerWaalsContact CG2-CG 3.48Å
222	T	33.4	Very low	38.9	Very low	100 Å²	100	109.8 Å²	109.8	61%	0.613	58%	0.581	S	S	*	*			trans	-176.8	28.1	155.2	13.8	0	0	0	0	115.9	N220 S224	N220-T222 PolarHBondContact O-N 3.37Å; T222-S224 PolarHBondContact O-N 2.86Å
223	I	38.5	Very low	39.5	Very low	140 Å²	140	109.4 Å²	109.4	72%	0.718	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-10.2	173.5	-64.6	174.9	0	0	0	112.2
224	S	41.6	Very low	40.1	Very low	79 Å²	79	103.3 Å²	103.3	55%	0.552	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	11.2	-166.4	-29.6	0	0	0	0	116	T222	T222-S224 PolarHBondContact O-N 2.86Å
225	S	36.7	Very low	40.7	Very low	72 Å²	72	97 Å²	97	50%	0.503	52%	0.518	S	S	.	.			trans	-133.5	50.9	-178.5	176.8	0	0	0	0	112.6	R227	S225-R227 PolarHBondContact O-N 2.92Å
226	L	45	Very low	41.8	Very low	68 Å²	68	96.4 Å²	96.4	36%	0.356	51%	0.507	S	S	.	.			trans	-70.9	105.6	145.4	-128.9	106.4	0	0	0	105.4	L154 I228 Q230 L231 L234	L154-L226 HydrophobicContact CD2-CD2 4.35Å; L226-I228 PolarHBondContact O-N 3Å; L226-Q230 HydrophobicContact CD2-CB 3.9Å; L226-Q230 HydrophobicContact CG-CB 4.08Å; L226-L231 HydrophobicContact CB-CD1 4.39Å; L226-L231 HydrophobicContact CD2-CB 3.98Å; L226-L231 HydrophobicContact CD2-CD1 4Å; L226-L231 HydrophobicContact CD2-CG 3.94Å; L226-L234 HydrophobicContact CD2-CD1 3.88Å
227	R	47.2	Very low	42.8	Very low	164 Å²	164	90.2 Å²	90.2	62%	0.619	49%	0.485	S	S	*	.			trans	-56.8	142.8	175.3	-70.4	-168.9	177.9	-168.7	1.3	107.4	S225 E229 Q230 L231	S225-R227 PolarHBondContact O-N 2.92Å; R227-E229 HydrophobicContact CB-CB 4.41Å; R227-E229 PolarHBondContact O-N 3.48Å; R227-Q230 HydrophobicContact CB-CG 4.42Å; R227-Q230 WeakPolarHBondContact O-CA 3.39Å; R227-Q230 WeakPolarHBondContact O-CB 3.39Å; R227-Q230 PolarHBondContact O-N 3.34Å; R227-L231 PolarHBondContact O-N 3.41Å; R227-L231 VanDerWaalsContact O-N 3.15Å
228	I	44.1	Very low	43.4	Very low	73 Å²	73	87 Å²	87	37%	0.374	46%	0.456	S	S	.	.	H	α-helix	trans	-46.6	-34.3	173.5	-51.4	-61.3	0	0	0	111.5	Q124 L226 L231 A232	Q124-I228 HydrophobicContact CB-CD1 4.06Å; Q124-I228 HydrophobicContact CG-CD1 3.51Å; Q124-I228 HydrophobicContact CG-CG1 3.79Å; Q124-I228 VanDerWaalsContact NE2-CD1 3.26Å; L226-I228 PolarHBondContact O-N 3Å; I228-L231 PolarHBondContact O-N 3.33Å; I228-A232 WeakPolarHBondContact O-CB 3.45Å; I228-A232 PolarHBondContact O-N 2.59Å
229	E	45.2	Very low	43.8	Very low	144 Å²	144	88 Å²	88	67%	0.673	46%	0.462	S	S	*	.	H	α-helix	trans	-61.7	-39.2	175.3	-62.6	174.7	167.6	0	0	113.4	R227 G233	R227-E229 HydrophobicContact CB-CB 4.41Å; R227-E229 PolarHBondContact O-N 3.48Å; E229-G233 PolarHBondContact O-N 3.29Å
230	Q	50.2	Low	44.5	Very low	107 Å²	107	88.5 Å²	88.5	50%	0.5	46%	0.464	S	S	.	.	H	α-helix	trans	-71.7	-38.1	175.7	-66.6	172.2	-42.7	0	0	111	L226 R227 G233 L234	L226-Q230 HydrophobicContact CD2-CB 3.9Å; L226-Q230 HydrophobicContact CG-CB 4.08Å; R227-Q230 HydrophobicContact CB-CG 4.42Å; R227-Q230 WeakPolarHBondContact O-CA 3.39Å; R227-Q230 WeakPolarHBondContact O-CB 3.39Å; R227-Q230 PolarHBondContact O-N 3.34Å; Q230-G233 PolarHBondContact O-N 2.89Å; Q230-L234 WeakPolarHBondContact O-CB 3.27Å; Q230-L234 WeakPolarHBondContact O-CG 3.3Å; Q230-L234 PolarHBondContact O-N 2.94Å
231	L	49.8	Very low	45.1	Very low	47 Å²	47	85.6 Å²	85.6	25%	0.246	45%	0.448	C	S	.	.	H	α-helix	trans	-71.1	-39.7	178.3	-136.7	146.1	0	0	0	111.1	L226 R227 I228 L234 L235	L226-L231 HydrophobicContact CB-CD1 4.39Å; L226-L231 HydrophobicContact CD2-CB 3.98Å; L226-L231 HydrophobicContact CD2-CD1 4Å; L226-L231 HydrophobicContact CD2-CG 3.94Å; R227-L231 PolarHBondContact O-N 3.41Å; R227-L231 VanDerWaalsContact O-N 3.15Å; I228-L231 PolarHBondContact O-N 3.33Å; L231-L234 PolarHBondContact O-N 3.39Å; L231-L235 HydrophobicContact CD2-CD1 4.1Å; L231-L235 WeakPolarHBondContact O-CB 3.44Å; L231-L235 WeakPolarHBondContact O-CG 3.33Å; L231-L235 PolarHBondContact O-N 3.25Å
232	A	48.2	Very low	46	Very low	38 Å²	38	81.5 Å²	81.5	31%	0.314	44%	0.439	S	S	.	.	H	α-helix	trans	-66.3	-38.2	171.4	0	0	0	0	0	112	I228 L235 A236	I228-A232 WeakPolarHBondContact O-CB 3.45Å; I228-A232 PolarHBondContact O-N 2.59Å; A232-L235 PolarHBondContact O-N 3.09Å; A232-A236 VanDerWaalsContact O-CB 3.32Å; A232-A236 WeakPolarHBondContact O-CB 3.48Å; A232-A236 PolarHBondContact O-N 3.24Å
233	G	49.5	Very low	46.7	Very low	34 Å²	34	80.5 Å²	80.5	35%	0.351	43%	0.43	S	S	.	.	H	α-helix	trans	-63.9	-40.1	173	0	0	0	0	0	112.9	E229 Q230 A236 N237	E229-G233 PolarHBondContact O-N 3.29Å; Q230-G233 PolarHBondContact O-N 2.89Å; G233-A236 PolarHBondContact O-N 3.17Å; G233-N237 PolarHBondContact O-N 3Å
234	L	52.4	Low	47.1	Very low	16 Å²	16	77 Å²	77	8%	0.084	41%	0.413	C	S	.	.	H	α-helix	trans	-66.8	-42.2	174.3	-79.5	161	0	0	0	112.3	Q153 L154 V157 L226 Q230 L231 N237 C238	Q153-L234 HydrophobicContact CB-CD2 3.95Å; L154-L234 HydrophobicContact CD2-CD1 4.03Å; V157-L234 HydrophobicContact CG2-CD1 4.07Å; V157-L234 HydrophobicContact CG2-CD2 3.48Å; V157-L234 VanDerWaalsContact CG2-CD2 3.48Å; V157-L234 HydrophobicContact CG2-CG 4.29Å; L226-L234 HydrophobicContact CD2-CD1 3.88Å; Q230-L234 WeakPolarHBondContact O-CB 3.27Å; Q230-L234 WeakPolarHBondContact O-CG 3.3Å; Q230-L234 PolarHBondContact O-N 2.94Å; L231-L234 PolarHBondContact O-N 3.39Å; L234-N237 PolarHBondContact O-N 3.05Å; L234-C238 PolarHBondContact O-N 3.01Å; L234-C238 VanDerWaalsContact O-N 3.08Å; L234-C238 PolarHBondContact O-SG 3.43Å
235	L	50.6	Low	47.5	Very low	7 Å²	7	76.9 Å²	76.9	4%	0.037	40%	0.404	C	S	.	.	H	α-helix	trans	-63.3	-40.4	174	-77.4	164.5	0	0	0	112	M131 L150 L231 A232 N237 C238 L239	M131-L235 HydrophobicContact CE-CD1 3.68Å; M131-L235 HydrophobicContact SD-CD1 4.11Å; L150-L235 HydrophobicContact CD1-CD2 3.58Å; L150-L235 HydrophobicContact CD1-CG 3.83Å; L150-L235 HydrophobicContact CD2-CD2 4.16Å; L150-L235 HydrophobicContact CG-CD2 4.36Å; L231-L235 HydrophobicContact CD2-CD1 4.1Å; L231-L235 WeakPolarHBondContact O-CB 3.44Å; L231-L235 WeakPolarHBondContact O-CG 3.33Å; L231-L235 PolarHBondContact O-N 3.25Å; A232-L235 PolarHBondContact O-N 3.09Å; L235-N237 VanDerWaalsContact C-N 3.31Å; L235-N237 PolarHBondContact O-N 3.15Å; L235-C238 WeakPolarHBondContact O-CB 3.39Å; L235-C238 PolarHBondContact O-N 2.93Å; L235-C238 VanDerWaalsContact O-N 3.16Å; L235-L239 PolarHBondContact O-N 3.43Å
236	A	53.2	Low	48.2	Very low	51 Å²	51	77.2 Å²	77.2	42%	0.421	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-32.8	176	0	0	0	0	0	112.7	A232 G233 L239	A232-A236 VanDerWaalsContact O-CB 3.32Å; A232-A236 WeakPolarHBondContact O-CB 3.48Å; A232-A236 PolarHBondContact O-N 3.24Å; G233-A236 PolarHBondContact O-N 3.17Å; A236-L239 PolarHBondContact O-N 3.38Å
237	N	53.9	Low	48.4	Very low	88 Å²	88	77.9 Å²	77.9	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-75.9	-21.1	173.1	-78.4	-14.8	0	0	0	113.5	G233 L234 L235 L239	G233-N237 PolarHBondContact O-N 3Å; L234-N237 PolarHBondContact O-N 3.05Å; L235-N237 VanDerWaalsContact C-N 3.31Å; L235-N237 PolarHBondContact O-N 3.15Å; N237-L239 VanDerWaalsContact C-N 3.26Å
238	C	44	Very low	48.5	Very low	20 Å²	20	71.2 Å²	71.2	14%	0.135	38%	0.383	C	S	.	.	H	α-helix	trans	-75.3	-17.3	171.1	-64.4	0	0	0	0	113.1	Q153 L234 L235	Q153-C238 WeakPolarHBondContact CG-SG 3.33Å; L234-C238 PolarHBondContact O-N 3.01Å; L234-C238 VanDerWaalsContact O-N 3.08Å; L234-C238 PolarHBondContact O-SG 3.43Å; L235-C238 WeakPolarHBondContact O-CB 3.39Å; L235-C238 PolarHBondContact O-N 2.93Å; L235-C238 VanDerWaalsContact O-N 3.16Å
239	L	43.3	Very low	48.9	Very low	80 Å²	80	71.1 Å²	71.1	42%	0.419	38%	0.384	S	S	.	.			trans	-101.5	-4	-173.6	-85.8	170.3	0	0	0	113.9	L135 L235 A236 N237	L135-L239 HydrophobicContact CD1-CD1 4.1Å; L135-L239 HydrophobicContact CD1-CD2 4.41Å; L135-L239 HydrophobicContact CD1-CG 4.36Å; L135-L239 HydrophobicContact CD2-CD1 4.41Å; L135-L239 HydrophobicContact CD2-CD2 3.25Å; L135-L239 HydrophobicContact CD2-CG 3.86Å; L135-L239 HydrophobicContact CG-CD1 4.17Å; L135-L239 HydrophobicContact CG-CD2 3.69Å; L135-L239 HydrophobicContact CG-CG 4.17Å; L235-L239 PolarHBondContact O-N 3.43Å; A236-L239 PolarHBondContact O-N 3.38Å; N237-L239 VanDerWaalsContact C-N 3.26Å
240	K	46.6	Very low	49.2	Very low	221 Å²	221	64.5 Å²	64.5	96%	0.961	36%	0.358	S	S	*	.			trans	-93.5	0	168.1	-71.6	179.3	179	173.6	0	109.5

Retrieved 240 of 240 residues in 32.2 ms (Link to these results)

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